NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 H 4.7508 8.4449 116.3416 55.4476 30.0688 172.3891 3 M 4.2022 8.2686 121.8696 54.5027 33.3254 173.6466 4 A 5.0915 8.9791 124.7925 50.6615 22.9770 175.0486 5 L 5.0075 8.5229 120.4078 53.1540 45.8680 176.4809 6 R 4.5623 8.7120 121.9436 55.5027 32.2931 175.3397 7 I 4.6193 9.0861 123.7540 59.6703 39.8898 174.8113 8 I 4.8907 8.6172 127.2813 58.9035 40.6027 173.3062 9 P 4.9632 0.0000 0.0000 62.3653 32.7578 174.9396 10 C 5.1127 8.7262 123.2781 57.7558 33.5905 173.2736 11 L 4.6528 9.1302 127.4924 53.3578 42.6714 175.3094 12 D 4.9761 8.6529 125.2169 53.8602 42.3799 175.6112 13 I 4.6291 9.0615 125.9398 59.3546 39.1495 176.1716 14 D 4.9299 8.7192 130.5311 53.7426 41.2104 177.0508 15 G 3.9488 7.6343 118.5045 46.5315 0.0000 175.4003 16 G 3.5305 9.0698 112.4351 47.9140 0.0000 174.3928 17 A 3.9909 7.7036 124.1717 54.0055 19.3269 179.6705 *18 K 4.0578 7.7969 116.0070 53.8919 30.3663 180.4663 19 V 4.4515 8.3293 116.5338 64.7451 32.4356 176.9129 20 V 5.5647 8.5808 120.5349 58.5807 35.4637 175.8845 21 V 4.0875 8.2531 123.1573 61.3865 31.3638 176.5475 22 K 3.9114 8.9919 128.8606 59.8149 32.3438 178.0343 23 G 3.8881 8.1340 106.0372 45.5151 0.0000 172.7846 24 V 4.3812 7.3999 120.2446 60.7656 32.9004 175.2792 25 N 4.4199 8.8810 126.2683 56.0083 39.4150 175.0573 26 F 4.3872 8.2104 120.6895 57.5029 40.0622 175.0268 27 Q 4.0031 8.4010 128.0564 59.4506 28.6478 178.5812 28 G 3.6012 7.2129 104.4224 46.9295 0.0000 174.4895 29 I 4.4534 7.6495 120.0080 62.5639 38.8538 177.3447 30 R 4.4066 8.5029 120.1975 58.4780 29.8354 175.9769 31 E 4.5982 8.0774 120.3456 55.9034 28.5759 176.6828 32 V 4.0932 8.8855 117.6961 60.4296 32.6212 176.7260 33 G 3.9365 7.1814 107.7277 44.7268 0.0000 170.1196 34 D 4.8916 7.6646 117.9820 52.2625 43.2957 174.8221 35 P 4.2243 0.0000 0.0000 65.8651 31.3783 179.1007 36 V 3.5404 7.7387 116.1341 66.0863 31.6079 177.6389 37 E 3.9063 8.4104 118.2967 59.7418 29.3019 179.4043 38 M 3.7680 8.2835 118.6095 58.1264 31.9753 178.6731 39 A 4.0734 8.1004 120.9396 55.1535 18.5191 179.7043 40 V 3.4987 7.9001 116.8888 66.1857 31.4920 178.1591 41 R 3.7867 7.9580 118.2449 59.7531 29.4270 178.1067 42 Y 4.2428 8.2118 116.8754 60.8703 37.7045 178.1120 43 E 3.9389 8.6921 120.7314 59.4900 29.5845 178.4981 44 E 3.9695 8.1018 117.2696 59.5844 29.6383 178.5342 45 E 4.3769 8.0119 115.4546 56.2608 29.7885 177.2236 46 G 4.0095 8.2330 107.0610 44.8591 0.0000 174.4684 47 A 3.9653 7.7247 122.8267 52.7065 18.8235 177.4765 48 D 4.6962 8.8228 121.1826 56.1940 41.9306 176.3152 49 E 4.8418 7.8455 115.0510 55.3225 34.2491 174.4679 50 I 4.6129 8.6817 121.0163 59.5909 40.6442 174.7180 51 A 5.1949 8.6935 128.5303 50.5193 21.5607 175.7933 52 I 5.1113 9.1778 122.0290 59.5508 41.0683 174.4813 53 L 5.3247 9.0386 127.0433 52.8126 44.7826 175.2791 54 D 4.4221 8.4362 124.2567 53.3706 41.6956 176.0143 55 I 4.4872 8.0118 119.4928 61.0046 37.7934 177.0223 56 T 3.9107 8.3199 114.7814 62.7901 69.0126 174.3994 57 A 3.5871 7.9768 122.7895 52.7838 16.1440 177.2473 58 A 4.4744 7.5312 122.3438 50.9451 20.3101 175.7997 59 P 4.2278 0.0000 0.0000 66.8254 31.9251 179.0243 *60 E 4.0992 8.3657 114.4564 58.9028 30.0301 183.8287 61 G 4.1116 7.9238 104.6861 44.8081 0.0000 175.3189 62 R 4.0241 7.6233 120.3685 59.5114 30.1793 178.3315 63 A 4.0095 8.1849 119.6000 55.8644 18.2221 179.7378 64 T 3.8934 7.7728 113.4377 66.5025 68.6893 176.7476 65 F 4.1851 8.3022 122.6042 61.5196 39.4981 177.2052 66 I 3.5122 8.5101 119.7355 64.2987 36.8146 177.9337 67 D 4.2705 8.1194 118.9029 57.4207 40.9800 178.4859 68 S 4.0318 7.8755 115.6578 61.3881 62.7548 176.7091 69 V 3.3280 7.2822 120.8749 65.7687 31.1267 177.7412 70 K 4.3005 7.7471 120.4574 59.2493 32.0206 178.9538 71 R 3.9365 8.0516 118.0066 58.8871 29.7610 179.3691 72 V 3.5183 8.1039 118.4414 65.9542 31.3735 177.9444 73 A 3.9898 8.1036 119.6195 55.2733 18.2344 179.1657 74 E 4.0287 8.4034 116.5163 59.1988 29.6450 178.7282 75 A 4.3293 7.7734 118.5399 52.2983 19.1229 177.1929 76 V 4.6492 6.9487 109.3744 59.7770 35.5196 175.6128 77 S 4.6219 9.4178 116.6790 58.7812 64.0649 175.1823 78 I 4.1540 7.6121 113.3725 59.5425 38.6959 174.2042 79 P 4.6331 0.0000 0.0000 63.1278 32.7871 175.3870 80 V 4.7406 9.4034 122.7664 61.1498 34.2605 173.8170 81 L 5.0201 8.9690 131.1444 53.5164 43.8828 175.1680 82 V 4.9323 8.5537 126.0802 61.6088 35.1108 174.7705 83 G 3.8719 9.0534 112.3993 45.7332 0.0000 171.9148 84 G 3.9945 8.2375 107.0146 48.1709 0.0000 174.0055 85 G 3.7076 8.3607 113.1935 46.4221 0.0000 173.7485 86 V 3.9696 7.0491 118.4338 61.4715 30.8452 175.7350 87 R 4.2111 8.9384 127.7711 57.8383 30.6751 177.0606 88 S 4.5681 7.4384 111.3842 56.3103 66.3567 175.8205 89 L 4.0722 8.3488 122.8090 58.6130 41.5938 178.6650 90 E 4.0626 8.1917 117.9680 59.2727 29.5830 178.8248 91 D 4.3495 8.0742 118.4360 57.2865 40.8821 178.5475 92 A 3.8712 8.0680 121.1808 55.5834 18.3171 179.7628 93 T 4.0263 8.2302 114.3597 67.2319 68.4908 176.9550 94 T 3.9082 8.1848 117.6571 66.6453 68.4617 176.7375 95 L 3.9209 7.8224 120.6541 57.6673 41.6029 179.4989 96 F 4.2613 8.1960 120.3409 61.2637 38.5438 178.5633 97 R 4.0603 8.1921 119.2071 61.3154 29.5654 180.2253 98 A 4.4033 8.1763 120.3495 52.5555 18.1908 178.2151 99 G 3.9380 7.8854 103.7714 44.8099 0.0000 174.5022 100 A 4.0210 7.7693 123.4624 52.9079 18.7628 177.5302 101 D 4.8309 8.8961 121.9063 56.0387 41.9922 177.2473 102 K 5.0952 7.8998 116.0664 54.6469 37.0518 175.5755 103 V 4.5787 8.7229 122.3954 61.0650 34.8317 173.9310 104 S 5.3108 8.9244 122.4174 56.7380 64.1192 173.5065 105 V 4.2056 8.5643 119.4693 60.9222 34.8819 174.2863 106 N 5.2242 8.8822 118.6408 53.9055 43.2570 176.3188 107 T 3.9021 8.6024 113.9557 66.8825 69.2859 175.8729 108 A 4.0732 8.0308 121.8591 54.8178 18.3424 179.4598 109 A 4.0849 8.0538 119.1351 55.4167 18.4181 179.7655 110 V 3.1489 7.8176 115.7059 66.0382 31.5547 177.9529 111 R 4.2311 7.8477 117.6706 58.0547 31.0727 176.0399 112 N 4.9205 8.3840 117.9022 49.9023 39.7307 172.1850 113 P 4.7942 0.0000 0.0000 64.7329 31.6001 177.8135 114 Q 4.0693 8.2225 116.2403 58.5470 28.4925 177.9932 115 L 3.9820 8.0930 121.7528 58.4668 41.8397 179.3308 116 V 3.5967 8.0862 117.6908 65.9563 31.3980 177.8965 117 A 4.3099 7.8049 121.3662 54.6584 18.2022 179.4869 118 L 3.9686 7.9721 117.6191 57.7338 41.6272 179.6685 119 L 4.2318 8.3396 119.0016 57.9239 41.6260 179.4505 120 A 4.0407 8.2756 122.2384 54.4139 18.0545 179.6160 121 R 3.7693 8.0072 116.5405 59.8417 30.3114 178.3832 122 E 3.8370 8.0959 116.8112 58.0902 29.5539 178.1240 123 F 4.5113 8.5723 114.9107 55.5819 41.2473 176.3443 124 G 3.9814 7.9453 106.4359 45.5542 0.0000 174.4055 125 S 4.3085 9.1046 116.2839 60.4031 62.4821 176.4655 126 Q 4.0560 8.1838 116.5551 58.7002 28.3317 177.2067 127 S 4.6678 8.3138 112.7790 58.4112 63.7424 173.0190 128 T 4.8816 7.9844 119.1713 62.0384 70.1943 173.4659 129 V 4.6780 8.6734 127.1600 60.9497 34.5650 174.3830 130 V 4.9047 8.4236 126.7951 61.0991 33.6200 174.0904 131 A 4.9241 8.7181 130.4924 51.2512 20.0559 176.4611 132 I 4.6119 8.9418 123.1764 59.7551 40.5726 174.2409 133 D 5.4555 8.8873 127.3376 52.7753 42.7714 175.6609 134 A 5.5944 9.1600 124.7815 50.2552 23.3705 174.6224 135 K 5.1481 8.9485 117.3536 54.8709 36.5464 175.3731 136 W 4.4951 9.1135 133.2721 57.3050 30.9884 175.5505 137 N 4.5343 7.5837 123.3023 52.2472 37.1820 175.0240 138 G 3.9434 6.3292 107.4639 45.4797 0.0000 174.5803 139 E 4.2708 7.5427 117.3163 57.3307 32.0782 174.9837 140 Y 4.4565 5.9295 113.9714 55.8357 41.8526 173.4442 141 Y 4.8006 8.9803 117.5360 57.7300 39.0693 174.3273 142 E 5.2950 9.3306 126.8449 54.5463 32.3537 175.0269 143 V 4.6119 8.9121 127.1807 62.9910 32.8463 174.1614 144 Y 4.9977 9.0101 125.4568 56.4282 40.5231 175.7277 145 V 4.1980 8.7110 116.9231 59.1282 35.1701 175.2127 146 K 3.6541 9.1746 117.9246 57.9160 29.1015 176.3218 147 G 3.6770 8.4053 99.1308 46.9466 0.0000 173.6419 148 G 3.9808 8.5089 105.0910 45.7753 0.0000 175.2584 149 R 4.3019 7.8547 119.5978 57.0047 31.1605 176.2577 150 E 4.6092 8.5227 120.1010 54.1106 31.2069 175.4014 151 A 3.0306 8.3232 129.5580 51.8372 18.6548 176.9010 152 T 4.0248 7.9796 110.7178 60.4496 70.2999 175.9268 153 G 3.8954 8.7116 110.4011 45.7113 0.0000 173.1464 154 L 4.4894 7.6367 119.9655 53.0731 43.4071 175.1808 155 D 5.2087 8.4131 121.4463 53.3256 42.3755 176.9635 156 A 4.3237 9.2935 130.1672 55.5570 18.4828 179.6247 157 V 3.6126 8.1435 116.1816 66.2316 31.6818 178.5383 158 K 4.0784 8.0790 117.8108 59.0049 31.9948 179.0806 159 W 4.4712 8.9098 128.9872 60.4250 30.6879 177.6349 160 A 3.7982 8.4854 121.2036 55.4096 17.7987 179.8329 161 K 3.9099 7.9683 116.5635 59.4154 32.0395 179.3280 162 E 3.8771 8.1233 119.6672 59.4074 29.6290 179.3654 163 V 3.3430 7.6403 112.7424 63.8771 30.9193 178.2110 164 E 3.8453 8.0089 119.4779 59.1957 29.2399 178.5056 165 E 3.9908 7.9399 118.4489 59.0624 29.8736 178.4321 166 L 4.1914 7.7773 118.8003 55.5550 41.2774 177.6650 167 G 3.8622 7.6440 105.8145 44.8099 0.0000 173.7171 168 A 4.1256 8.0007 124.2094 52.4469 18.6709 178.1450 169 G 3.9666 8.6764 109.2358 46.9931 0.0000 173.4191 170 E 5.0007 7.7252 119.1336 55.3549 33.3146 173.6772 171 I 4.8849 8.2990 126.8339 59.5366 40.0019 174.4253 172 L 4.7196 8.8587 129.8574 53.6941 43.2232 174.6574 173 L 5.0638 8.8506 130.3430 53.7870 43.8996 175.0524 174 T 5.7124 8.6770 123.1648 60.9029 72.0650 173.5235 175 S 4.8164 8.6561 120.8235 57.2809 62.8965 174.7098 176 I 3.7710 8.7007 130.4138 64.5152 37.2040 177.4333 177 D 4.5010 8.2809 119.1446 57.1467 40.9427 177.5896 178 R 4.2243 8.0541 116.9487 56.8327 31.0354 176.0666 179 D 4.3849 7.7615 117.4838 56.0180 41.1963 176.8977 180 G 3.9676 8.8559 114.0152 45.9498 0.0000 173.8149 181 T 4.0373 7.9483 109.5718 61.5896 69.4618 176.2176 182 G 3.8138 8.0531 109.3103 46.0356 0.0000 174.5579 183 L 4.1485 7.5396 118.4589 54.0730 42.0825 176.7788 184 G 3.4822 7.8728 107.3829 43.6201 0.0000 173.5827 185 Y 4.2317 7.7680 117.6301 57.1416 38.6684 176.8844 186 D 4.5944 8.4782 121.1825 53.6576 41.1070 177.2345 187 V 3.6912 8.1484 121.4083 63.6659 31.7187 177.9842 188 E 3.8988 8.1948 119.2584 58.8416 29.5997 178.1054 189 L 3.1430 7.9342 120.3902 57.9930 42.0225 178.9356 190 I 3.5678 7.6294 119.5244 64.3296 36.9850 178.1850 191 R 4.2682 8.0033 120.8951 59.0508 29.6842 178.6491 192 R 3.9243 7.7772 116.1650 59.2729 30.3018 179.0675 193 V 3.7217 7.8183 117.7206 66.0015 31.1653 178.0104 194 A 3.9563 8.3521 120.9140 55.2123 17.9500 179.2304 195 D 4.0786 8.1856 116.5129 57.0359 40.9250 178.5461 196 S 4.4034 8.0116 115.3004 59.4229 63.2021 174.4421 197 V 4.7672 6.5430 111.7719 58.4470 35.1195 175.5659 198 R 4.3007 9.5258 120.6269 57.4518 30.7662 177.6166 199 I 4.0589 7.6222 110.4941 59.8127 38.7464 174.3951 200 P 4.4203 0.0000 0.0000 62.7439 32.7873 175.3263 201 V 4.6657 8.2277 122.4754 61.2046 34.1790 174.2030 202 I 4.5714 8.8438 129.7486 60.3441 38.5361 174.9208 203 A 4.5985 8.8809 130.6393 51.4975 19.8243 176.0858 204 S 5.1334 9.2655 116.7003 57.6819 66.6659 172.9303 205 G 3.9538 8.6107 114.7378 48.7843 0.0000 173.7117 206 G 3.7757 9.0490 111.8226 45.5745 0.0000 173.1131 207 A 3.6364 7.1117 123.2346 52.1850 18.5840 177.3929 208 G 4.0015 8.6740 108.5864 43.8923 0.0000 172.2244 209 R 4.5165 7.0744 114.5760 53.4061 32.4456 176.1720 210 V 3.7649 8.1505 118.6165 65.0407 31.1094 178.0883 211 E 4.1493 7.9378 118.6173 59.6977 29.2305 178.7942 212 H 4.2810 7.9286 116.2380 58.8649 28.6557 177.8127 213 F 4.4765 7.7518 119.1522 60.7301 38.7387 177.0237 214 Y 4.1078 8.4136 118.6929 60.9055 38.8173 177.7410 215 E 3.9950 8.7397 119.3476 59.4372 29.5458 179.3189 216 A 3.8604 8.2904 120.5822 54.8286 18.3864 179.4230 217 A 3.7725 7.8373 119.0412 55.3964 18.2669 179.7913 218 A 3.7647 7.6539 117.7326 54.7500 18.5469 178.8625 219 A 4.2382 7.5559 117.4095 52.1333 18.7112 178.4584 220 G 4.0327 7.6897 104.5749 44.8515 0.0000 174.4657 221 A 4.1426 7.6924 122.7018 52.2822 19.0389 177.1495 222 D 4.9352 8.8516 119.3678 54.8638 43.1962 175.7367 223 A 5.1900 7.6474 118.2244 50.7944 23.2896 175.1127 224 V 4.7940 8.8416 112.4289 59.4514 35.1348 174.7335 225 L 5.9252 9.4411 126.9573 52.8951 44.4530 175.2635 226 A 4.5393 8.5524 124.2444 50.2575 22.3642 174.7004 227 A 4.2673 8.6410 118.6397 53.1118 21.2669 178.9008 228 S 3.5004 7.7318 111.3449 61.7173 63.1048 177.0541 229 L 3.9626 7.6551 121.8491 58.1203 41.8405 178.9067 230 F 4.6136 7.6979 117.2046 60.9048 38.9195 177.5253 231 H 4.6492 8.2431 116.3805 57.8691 28.5622 176.9087 232 F 4.9260 8.0954 117.1768 56.6939 39.1927 175.5687 233 R 4.0997 8.1944 116.6956 57.2359 28.0999 178.1162 234 V 3.8347 8.2347 119.3747 65.6435 31.8325 175.6819 235 L 4.9444 7.6205 116.4139 52.4552 45.8735 175.5705 236 S 4.9480 8.9300 115.7775 57.1559 66.2580 175.4129 237 I 3.6541 8.1918 123.1395 64.5393 36.7855 178.5931 238 A 4.0570 7.9422 121.2122 55.1834 18.2858 179.4846 239 Q 4.0297 8.2586 116.6754 59.0565 28.6831 179.2967 240 V 3.6992 7.8680 119.2842 66.0164 31.5460 178.2863 241 K 4.0064 8.5097 118.7041 59.5370 31.8525 179.6051 242 R 3.9680 8.2279 118.4020 59.2585 29.9029 178.4404 243 Y 4.0735 8.1528 119.3435 60.7088 38.8595 178.1736 244 L 4.0055 8.3703 120.0222 57.7373 41.8039 179.2361 245 K 4.1219 8.3443 121.2794 59.0395 31.8539 178.3107 246 E 3.9546 7.9687 118.1914 58.8140 29.5063 177.9385 247 R 4.3042 7.2292 115.7111 55.6750 30.2383 177.1704 248 G 3.8929 8.0317 106.8538 45.1893 0.0000 173.5005 249 V 4.2475 7.7985 120.8186 61.2886 33.1481 174.8263 250 E 4.3962 9.0465 130.1269 56.5099 30.3442 175.9497 251 V 4.7289 8.1588 118.8627 59.4960 36.3223 175.9725 252 R 4.1138 8.5699 122.9996 55.8133 28.7864 176.5313 253 I 3.9720 8.0581 124.3910 61.3566 37.1842 176.3145 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 H 8.44 4.75 0.00 3.30 3.36 0.00 5.49 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 3 M 8.27 4.20 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.49 0.00 4 A 8.98 5.09 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 L 8.52 5.01 0.00 1.50 1.51 1.04 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 6 R 8.71 4.56 0.00 1.77 1.81 0.00 3.22 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 7 I 9.09 4.62 1.76 0.00 0.00 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 1.31 0.84 0.77 0.00 0.00 8 I 8.62 4.89 1.98 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 1.21 1.03 0.94 0.00 0.00 9 P 0.00 4.96 0.00 1.55 0.82 0.00 3.54 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.16 0.00 10 C 8.73 5.11 0.00 3.00 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 11 L 9.13 4.65 0.00 1.67 1.68 0.98 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.65 4.98 0.00 2.84 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 13 I 9.06 4.63 2.13 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.36 1.11 0.00 0.00 14 D 8.72 4.93 0.00 2.67 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 15 G 7.63 3.95 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 0.00 0.00 0.00 16 G 9.07 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 A 7.70 3.99 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 *18 K 7.80 4.06 0.00 1.81 1.90 0.00 1.81 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.23 1.22 7.81 19 V 8.33 4.45 2.15 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 0.82 0.00 0.00 0.94 0.00 0.00 20 V 8.58 5.56 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 0.67 0.00 0.00 0.95 0.00 0.00 21 V 8.25 4.09 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.48 0.00 0.00 22 K 8.99 3.91 0.00 1.92 1.97 0.00 1.63 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.47 7.81 23 G 8.13 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 24 V 7.40 4.38 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 1.06 0.00 0.00 1.21 0.00 0.00 25 N 8.88 4.42 0.00 2.76 2.91 0.00 0.00 7.18 7.02 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 26 F 8.21 4.39 0.00 3.12 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 27 Q 8.40 4.00 0.00 2.02 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.34 2.49 0.00 28 G 7.21 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 29 I 7.65 4.45 2.15 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 1.61 0.91 1.04 0.00 0.00 30 R 8.50 4.41 0.00 2.11 2.13 0.00 3.11 0.00 0.00 3.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.93 0.00 31 E 8.08 4.60 0.00 2.02 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 2.34 2.41 0.00 32 V 8.89 4.09 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 0.82 0.00 0.00 0.89 0.00 0.00 33 G 7.18 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 34 D 7.66 4.89 0.00 2.70 2.64 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 35 P 0.00 4.22 0.00 2.17 2.10 0.00 3.64 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 2.12 2.18 0.00 36 V 7.74 3.54 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 1.12 0.00 0.00 0.90 0.00 0.00 37 E 8.41 3.91 0.00 2.01 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 2.30 2.48 0.00 38 M 8.28 3.77 0.00 1.90 2.07 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.39 0.00 39 A 8.10 4.07 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 40 V 7.90 3.50 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 1.04 0.00 0.00 0.99 0.00 0.00 41 R 7.96 3.79 0.00 1.83 1.83 0.00 3.01 0.00 0.00 2.89 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.56 0.00 42 Y 8.21 4.24 0.00 2.94 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 43 E 8.69 3.94 0.00 2.07 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 2.31 2.35 0.00 44 E 8.10 3.97 0.00 2.16 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 2.34 2.49 0.00 45 E 8.01 4.38 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 46 G 8.23 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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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 64 T 7.77 3.89 4.48 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 0.00 0.00 0.00 1.24 0.00 0.00 65 F 8.30 4.19 0.00 3.12 3.23 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 66 I 8.51 3.51 2.01 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.96 0.88 0.00 0.00 67 D 8.12 4.27 0.00 2.88 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 68 S 7.88 4.03 0.00 3.89 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 69 V 7.28 3.33 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 0.86 0.00 0.00 0.14 0.00 0.00 70 K 7.75 4.30 0.00 1.82 1.93 0.00 1.70 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.33 7.81 71 R 8.05 3.94 0.00 1.86 1.93 0.00 3.15 0.00 0.00 3.07 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0.00 0.00 2.12 2.10 0.00 80 V 9.40 4.74 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.98 0.00 0.00 81 L 8.97 5.02 0.00 1.74 1.51 0.93 0.52 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 82 V 8.55 4.93 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 1.08 0.00 0.00 0.86 0.00 0.00 83 G 9.05 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 84 G 8.24 3.99 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 0.00 0.00 0.00 85 G 8.36 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 86 V 7.05 3.97 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 0.80 0.00 0.00 1.01 0.00 0.00 87 R 8.94 4.21 0.00 1.95 1.98 0.00 3.26 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 88 S 7.44 4.57 0.00 4.02 3.95 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 89 L 8.35 4.07 0.00 1.86 1.79 1.12 0.95 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 90 E 8.19 4.06 0.00 2.06 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 2.46 2.38 0.00 91 D 8.07 4.35 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 92 A 8.07 3.87 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 T 8.23 4.03 4.56 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 1.45 0.00 0.00 94 T 8.18 3.91 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 95 L 7.82 3.92 0.00 1.56 1.51 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 96 F 8.20 4.26 0.00 2.92 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 97 R 8.19 4.06 0.00 1.90 1.85 0.00 3.27 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.52 0.00 98 A 8.18 4.40 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 99 G 7.89 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 0.00 100 A 7.77 4.02 1.09 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 0.00 101 D 8.90 4.83 0.00 2.70 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 0.00 102 K 7.90 5.10 0.00 1.66 1.67 0.00 1.64 0.00 0.00 1.89 0.00 0.00 2.78 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.47 7.81 103 V 8.72 4.58 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 0.71 0.00 0.00 -0.29 0.00 0.00 104 S 8.92 5.31 0.00 3.87 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 0.00 105 V 8.56 4.21 2.15 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 0.76 0.00 0.00 1.06 0.00 0.00 106 N 8.88 5.22 0.00 2.72 2.55 0.00 0.00 6.99 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 0.00 107 T 8.60 3.90 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 1.21 0.00 0.00 108 A 8.03 4.07 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 0.00 109 A 8.05 4.08 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 V 7.82 3.15 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 0.47 0.00 0.00 0.51 0.00 0.00 111 R 7.85 4.23 0.00 1.86 2.11 0.00 3.27 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 112 N 8.38 4.92 0.00 2.77 2.66 0.00 0.00 7.21 7.32 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 0.00 113 P 0.00 4.79 0.00 2.35 2.43 0.00 4.02 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.45 0.00 114 Q 8.22 4.07 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.80 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 115 L 8.09 3.98 0.00 1.84 1.93 1.02 0.66 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 0.00 116 V 8.09 3.60 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 0.99 0.00 0.00 0.95 0.00 0.00 117 A 7.80 4.31 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 L 7.97 3.97 0.00 1.95 1.78 0.96 0.67 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 0.00 119 L 8.34 4.23 0.00 1.97 1.94 1.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.28 4.04 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 0.00 121 R 8.01 3.77 0.00 1.82 2.09 0.00 3.27 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 122 E 8.10 3.84 0.00 1.84 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.23 0.00 123 F 8.57 4.51 0.00 2.79 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 0.00 0.00 0.00 0.00 124 G 7.95 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 0.00 125 S 9.10 4.31 0.00 3.87 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 0.00 126 Q 8.18 4.06 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.70 0.00 0.00 0.00 0.00 0.00 2.34 2.47 0.00 127 S 8.31 4.67 0.00 4.19 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 0.00 128 T 7.98 4.88 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 129 V 8.67 4.68 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 0.94 0.00 0.00 0.95 0.00 0.00 130 V 8.42 4.90 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 0.98 0.00 0.00 0.87 0.00 0.00 131 A 8.72 4.92 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 0.00 132 I 8.94 4.61 1.97 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.86 1.13 0.00 0.00 133 D 8.89 5.46 0.00 2.88 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 0.00 134 A 9.16 5.59 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 K 8.95 5.15 0.00 2.05 1.70 0.00 1.09 0.00 0.00 1.39 0.00 0.00 2.28 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.75 1.28 7.81 136 W 9.11 4.50 0.00 3.10 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 0.00 137 N 7.58 4.53 0.00 2.53 2.55 0.00 0.00 7.26 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 G 6.33 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 0.00 139 E 7.54 4.27 0.00 1.74 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 0.00 2.16 2.03 0.00 140 Y 5.93 4.46 0.00 3.04 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 8.98 4.80 0.00 3.31 3.15 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 0.00 142 E 9.33 5.29 0.00 1.63 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 2.14 2.49 0.00 143 V 8.91 4.61 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 0.84 0.00 0.00 1.13 0.00 0.00 144 Y 9.01 5.00 0.00 2.84 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 0.00 145 V 8.71 4.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.90 0.00 0.00 146 K 9.17 3.65 0.00 1.98 1.85 0.00 1.89 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.36 7.81 147 G 8.41 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.51 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 0.00 149 R 7.85 4.30 0.00 1.91 2.04 0.00 3.16 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 150 E 8.52 4.61 0.00 2.01 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.17 0.00 151 A 8.32 3.03 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 T 7.98 4.02 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 1.09 0.00 0.00 153 G 8.71 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 0.00 154 L 7.64 4.49 0.00 1.56 1.49 0.10 0.57 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 0.00 155 D 8.41 5.21 0.00 2.21 2.45 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 0.00 156 A 9.29 4.32 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 V 8.14 3.61 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 1.08 0.00 0.00 1.06 0.00 0.00 158 K 8.08 4.08 0.00 2.03 1.90 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.54 1.49 7.81 159 W 8.91 4.47 0.00 3.31 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 0.00 160 A 8.49 3.80 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 K 7.97 3.91 0.00 1.99 1.86 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.63 1.66 7.81 162 E 8.12 3.88 0.00 2.18 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 2.20 2.37 0.00 163 V 7.64 3.34 1.73 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 -0.64 0.00 0.00 0.60 0.00 0.00 164 E 8.01 3.85 0.00 1.97 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 2.26 2.27 0.00 165 E 7.94 3.99 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 166 L 7.78 4.19 0.00 1.81 1.66 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 167 G 7.64 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 0.00 168 A 8.00 4.13 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 0.00 169 G 8.68 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 0.00 170 E 7.73 5.00 0.00 2.01 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.45 0.00 171 I 8.30 4.88 1.84 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 1.03 0.42 0.95 0.00 0.00 172 L 8.86 4.72 0.00 1.77 1.59 0.95 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 173 L 8.85 5.06 0.00 1.78 1.61 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 174 T 8.68 5.71 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 1.29 0.00 0.00 175 S 8.66 4.82 0.00 3.89 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 0.00 176 I 8.70 3.77 1.76 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 1.28 0.65 0.79 0.00 0.00 177 D 8.28 4.50 0.00 2.71 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 0.00 178 R 8.05 4.22 0.00 1.81 1.97 0.00 3.34 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 179 D 7.76 4.38 0.00 2.83 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 G 8.86 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 0.00 181 T 7.95 4.04 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 182 G 8.05 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 0.00 183 L 7.54 4.15 0.00 1.60 1.66 0.89 0.91 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 0.00 184 G 7.87 3.48 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 Y 7.77 4.23 0.00 2.95 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 0.00 186 D 8.48 4.59 0.00 2.74 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 187 V 8.15 3.69 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 0.79 0.00 0.00 0.93 0.00 0.00 188 E 8.19 3.90 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.56 0.00 189 L 7.93 3.14 0.00 0.97 1.58 0.48 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 190 I 7.63 3.57 1.92 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 1.30 0.51 0.85 0.00 0.00 191 R 8.00 4.27 0.00 2.00 2.04 0.00 3.14 0.00 0.00 3.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.52 0.00 192 R 7.78 3.92 0.00 1.84 2.07 0.00 3.57 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.92 0.00 193 V 7.82 3.72 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 1.07 0.00 0.00 0.96 0.00 0.00 194 A 8.35 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 D 8.19 4.08 0.00 2.86 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 0.00 196 S 8.01 4.40 0.00 4.09 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 0.00 197 V 6.54 4.77 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 0.89 0.00 0.00 0.96 0.00 0.00 198 R 9.53 4.30 0.00 1.85 1.96 0.00 3.16 0.00 0.00 3.27 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 199 I 7.62 4.06 2.05 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.49 0.92 0.00 0.00 200 P 0.00 4.42 0.00 2.08 2.16 0.00 3.77 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 201 V 8.23 4.67 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 1.05 0.00 0.00 0.90 0.00 0.00 202 I 8.84 4.57 1.87 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 1.15 0.67 0.92 0.00 0.00 203 A 8.88 4.60 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 S 9.27 5.13 0.00 3.94 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 0.00 205 G 8.61 3.95 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 0.00 0.00 0.00 206 G 9.05 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 0.00 0.00 0.00 207 A 7.11 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 G 8.67 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 0.00 209 R 7.07 4.52 0.00 1.77 1.83 0.00 2.84 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.31 0.00 210 V 8.15 3.76 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 0.85 0.00 0.00 211 E 7.94 4.15 0.00 1.99 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 212 H 7.93 4.28 0.00 2.79 3.04 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 F 7.75 4.48 0.00 3.49 3.22 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 0.00 214 Y 8.41 4.11 0.00 3.37 3.37 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 0.00 215 E 8.74 3.99 0.00 2.35 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 2.47 2.67 0.00 216 A 8.29 3.86 0.97 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 0.00 217 A 7.84 3.77 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 A 7.65 3.76 1.08 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 0.00 219 A 7.56 4.24 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 G 7.69 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 0.00 221 A 7.69 4.14 1.19 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 0.00 0.00 222 D 8.85 4.94 0.00 2.75 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 223 A 7.65 5.19 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 0.00 0.00 224 V 8.84 4.79 2.51 0.00 0.00 0.00 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 1.01 0.00 0.00 225 L 9.44 5.93 0.00 1.62 1.77 1.02 1.03 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 0.00 226 A 8.55 4.54 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 0.00 227 A 8.64 4.27 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 S 7.73 3.50 0.00 3.82 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 0.00 229 L 7.66 3.96 0.00 1.55 1.37 0.75 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 230 F 7.70 4.61 0.00 3.00 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 0.00 231 H 8.24 4.65 0.00 2.77 3.29 0.00 5.61 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 F 8.10 4.93 0.00 3.14 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 0.00 233 R 8.19 4.10 0.00 2.08 2.11 0.00 3.71 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 234 V 8.23 3.83 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 0.77 0.00 0.00 1.04 0.00 0.00 235 L 7.62 4.94 0.00 1.78 1.63 1.00 0.86 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 0.00 236 S 8.93 4.95 0.00 4.11 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 I 8.19 3.65 1.90 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.29 0.80 0.00 0.00 238 A 7.94 4.06 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 0.00 239 Q 8.26 4.03 0.00 2.38 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.76 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 240 V 7.87 3.70 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 0.75 0.00 0.00 0.99 0.00 0.00 241 K 8.51 4.01 0.00 1.82 1.86 0.00 1.70 0.00 0.00 1.77 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.62 7.81 242 R 8.23 3.97 0.00 1.94 2.03 0.00 3.16 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 243 Y 8.15 4.07 0.00 3.13 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 L 8.37 4.01 0.00 1.94 1.80 0.99 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 245 K 8.34 4.12 0.00 1.90 1.83 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.33 7.81 246 E 7.97 3.95 0.00 2.17 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 247 R 7.23 4.30 0.00 1.63 1.61 0.00 2.55 0.00 0.00 2.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.99 0.00 248 G 8.03 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 0.00 249 V 7.80 4.25 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 0.92 0.00 0.00 1.06 0.00 0.00 250 E 9.05 4.40 0.00 2.14 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 2.32 2.31 0.00 251 V 8.16 4.73 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 0.81 0.00 0.00 1.00 0.00 0.00 252 R 8.57 4.11 0.00 1.76 2.01 0.00 3.23 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 253 I 8.06 3.97 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.66 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.