NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2490 7.8827 121.4454 61.2219 38.6773 173.8340 17 V 4.2973 8.6796 126.3082 61.9553 32.5413 174.4586 18 G 3.8104 8.4091 114.0744 46.5837 0.0000 173.4031 19 G 4.2722 7.8374 110.4205 44.1238 0.0000 172.8054 20 Y 4.9738 7.9043 116.6695 55.1353 42.1456 175.0036 21 T 4.2450 8.5584 117.3636 63.9352 68.4185 175.2424 22 C 4.1769 8.6442 125.3744 59.4361 36.9103 175.5147 23 G 4.0096 8.4333 105.4877 44.7576 0.0000 172.6147 24 A 4.0687 8.4590 125.5383 53.4459 18.6040 176.9487 25 N 4.2472 8.8133 119.9139 54.6141 36.1128 175.3423 26 T 4.2311 7.5261 108.0566 62.4537 69.8861 175.2249 27 V 4.0305 7.0485 122.5554 60.2781 31.2636 173.5427 28 P 4.4808 0.0000 0.0000 64.1003 32.1927 178.3935 29 Y 4.8573 6.9722 116.0437 57.3186 38.7506 174.7213 30 Q 4.4977 7.3554 123.5608 56.4753 29.2137 175.7311 31 V 4.8402 9.0551 119.7313 59.7339 35.5404 174.3142 32 S 4.9354 9.0014 117.7844 56.6425 64.6580 172.7392 33 L 4.5272 8.5719 127.8376 53.5787 43.1255 175.0034 34 N 5.8492 8.9469 122.8599 50.1010 41.6453 175.0569 *37 S 4.3587 8.3698 121.3817 58.2832 64.0934 174.4538 38 G 3.9362 9.3998 108.4629 46.3069 0.0000 172.7067 39 Y 4.6304 6.4971 115.1807 55.6329 40.2765 173.2568 40 H 4.4110 8.9138 122.0735 56.8710 30.1133 174.6771 41 F 5.1146 8.1446 120.3769 56.8308 39.5960 174.2817 42 C 4.7780 6.8443 114.8976 56.0896 44.5858 174.1381 43 G 4.0590 8.7936 110.2179 46.3100 0.0000 172.1102 44 G 4.4280 7.6366 105.9622 46.5735 0.0000 172.6972 45 S 5.3946 8.5451 115.1080 56.4794 67.0587 173.6557 46 L 4.7641 9.2527 127.7910 54.8360 42.2907 177.0990 47 I 4.5179 8.5952 120.0398 61.2971 38.6714 174.4756 48 N 4.9131 7.6507 117.3982 51.8014 39.8188 174.7759 49 S 4.3156 8.7425 111.5971 60.4165 63.2178 174.5379 50 Q 4.5789 8.9912 120.8404 55.1928 31.0935 174.2618 51 W 5.4673 8.4677 117.7283 55.5805 33.1958 174.3555 52 V 5.1404 9.1739 123.9517 61.0582 34.2951 174.3794 53 V 4.9809 8.7824 126.8124 60.4897 34.0811 174.9275 54 S 5.0903 8.9126 116.7887 57.3464 66.3125 172.0259 55 A 4.5668 8.7658 120.6343 50.5485 19.5129 178.7245 56 A 3.7816 8.3264 124.9090 55.1246 18.4701 179.1047 57 H 4.5664 8.4649 110.2080 57.4950 28.8075 175.6120 58 C 4.6405 8.0045 117.2645 57.7909 40.5259 173.3380 59 Y 4.1852 7.4737 121.4191 58.1546 38.6844 175.3218 60 K 3.8645 7.0759 125.3380 55.0161 35.0497 174.9205 61 S 4.2756 8.0170 118.2394 58.6474 64.2048 173.4231 62 G 3.6659 8.3983 107.3055 46.7908 0.0000 173.7438 63 I 4.1407 7.5708 120.1511 60.3205 38.9960 175.1453 64 Q 4.6822 8.7591 128.7164 54.3512 31.1823 174.2622 65 V 4.2549 8.8319 127.4144 62.1467 33.2186 174.6334 66 R 5.1303 8.9811 127.8349 54.8010 32.1143 175.4924 67 L 4.7141 8.9409 124.4959 52.6952 44.8941 177.6020 *69 G 3.9040 8.2338 106.5824 45.3998 0.0000 172.5674 70 E 4.3949 8.2834 118.8859 55.4217 29.8537 174.0839 71 D 4.8733 7.9824 119.6546 55.3793 44.6995 174.4663 72 N 5.0104 9.0084 121.4283 53.1767 39.1025 176.2746 73 I 3.8619 8.3353 120.2797 62.6216 37.8330 176.4251 74 N 4.7173 7.9750 117.0072 53.0115 39.1648 174.6289 75 V 4.3167 7.3439 118.4996 60.6432 34.1232 174.9599 76 V 4.1161 8.5005 127.0129 62.8250 31.2521 175.1358 77 E 4.4938 9.4458 126.9411 55.3863 30.7353 176.9066 78 G 4.0434 8.2996 106.2558 45.3191 0.0000 174.2465 79 N 4.9000 8.1781 115.6984 53.0241 39.9821 174.4412 80 E 4.6734 7.9659 118.5475 56.2777 30.9375 176.3098 81 Q 4.2863 8.8547 120.8236 54.3376 32.5839 174.2663 82 F 5.5027 8.7044 123.6117 56.1024 40.6446 175.4252 83 I 4.6197 8.8066 125.3645 59.1300 40.4672 175.4866 84 S 4.6611 8.7071 121.3792 58.1039 63.7449 172.7496 85 A 4.6140 8.6550 128.4954 52.0166 18.3325 177.6080 86 S 4.5167 8.8437 116.7001 59.2800 64.8407 174.5932 87 K 4.6891 7.6332 120.4134 54.9488 35.6450 174.7331 88 S 5.3453 8.8265 121.9130 56.8281 66.1681 173.5206 89 I 4.5795 9.2745 124.8430 59.5290 39.8123 174.8843 90 V 4.1974 8.4848 127.5932 62.0223 32.6908 175.0475 91 H 3.3201 8.6035 126.6590 56.0246 29.9153 174.2740 92 P 4.2996 0.0000 0.0000 65.1898 31.3511 177.1118 93 S 4.6789 7.7661 113.3645 58.0349 62.8672 173.1443 94 Y 4.2453 8.0489 123.2754 57.9086 38.8486 174.5087 95 N 4.6705 8.3176 126.2023 51.4024 39.9426 175.2021 96 S 3.8528 7.7010 120.2429 59.8179 63.7311 175.3824 97 N 4.3530 8.3111 119.2410 55.9293 38.4118 176.2845 98 T 3.8860 7.7605 105.2590 61.1317 69.6711 175.1901 99 L 3.6941 7.9293 120.7461 55.2017 39.9866 173.9326 100 N 4.3907 7.6319 118.4722 54.8248 39.4159 174.6474 101 N 4.6966 8.7201 120.9038 54.1997 36.1033 175.5350 102 D 4.7120 7.7998 118.2411 52.9972 40.4104 173.9529 103 I 4.8735 7.1800 120.9984 59.3529 42.1408 172.6325 104 M 5.4347 9.1899 127.1935 54.1151 36.3526 173.3150 105 L 5.3797 9.2258 124.2805 53.1638 44.9996 175.4219 106 I 4.9796 9.1373 123.6674 59.4688 40.2543 174.4047 107 K 3.7365 8.6452 129.4144 54.8053 33.4290 175.7440 108 L 4.5405 8.3051 127.5884 54.1128 42.0312 177.2710 109 K 4.1587 8.7881 122.7210 59.0067 32.4640 177.4497 110 S 4.6172 7.7174 111.0913 55.7718 66.1838 173.0643 111 A 4.4006 8.4260 123.3079 51.5940 18.5904 177.5253 112 A 4.1621 9.0900 125.2251 52.3332 19.4956 177.2615 113 S 4.4492 9.2063 116.3746 57.2506 62.8429 173.6317 114 L 4.6826 8.4545 128.1765 53.6293 42.7440 175.8903 115 N 4.9839 8.9830 120.0361 51.4592 40.3256 174.9659 116 S 4.1928 8.7437 111.9319 61.0308 62.7543 175.2677 117 R 4.3096 8.3954 118.5239 56.0726 31.0499 176.1978 118 V 4.4679 7.9347 117.2964 60.8555 33.5524 173.7648 119 A 5.1466 8.5063 128.6443 50.2210 22.7439 175.4288 120 S 4.8567 8.8180 115.5797 58.3243 64.4211 173.1008 121 I 4.3725 8.4004 122.2057 59.3184 39.0803 175.5373 122 S 4.3845 8.3934 124.6143 58.3222 63.9599 173.9808 123 L 4.2054 8.3918 123.7655 53.7065 42.2893 175.2695 124 P 4.5056 0.0000 0.0000 62.9541 32.1044 176.3705 125 T 4.2050 8.1962 108.6352 62.3789 69.8792 174.5289 *127 S 4.3702 7.5767 116.8802 58.4650 64.0105 174.0472 128 C 4.4098 8.5105 120.7645 56.5198 40.7403 173.6028 129 A 4.2294 7.5614 127.5043 51.9109 18.9220 177.6454 130 S 4.2161 8.2071 117.2841 57.7166 64.1275 173.4048 *132 A 4.3245 8.2659 124.9102 53.5356 19.2546 177.2173 133 G 3.9847 9.1641 111.7175 45.2340 0.0000 174.1644 134 T 3.9709 7.6230 117.7302 63.6055 69.3630 173.6048 135 Q 4.6196 8.6018 127.8400 56.1422 30.1133 175.3647 136 C 5.2300 9.2853 122.3957 55.2170 46.1011 172.3106 137 L 5.1863 8.8672 122.7193 53.6042 43.9099 174.9788 138 I 5.2674 9.2313 127.4888 58.8601 39.7295 174.9090 139 S 4.8853 8.4849 119.6352 56.5357 66.5124 173.1018 140 G 3.7214 7.7106 108.2642 46.4337 0.0000 173.2060 141 W 4.6236 8.7238 116.9531 56.1648 29.1972 176.8679 142 G 3.9889 8.4412 109.3823 44.5726 0.0000 173.1520 143 N 3.6645 8.4622 118.3971 54.2813 38.8967 174.5525 144 T 5.0458 8.1339 113.1800 60.5935 69.5513 174.4276 145 K 4.6194 7.7647 121.9040 54.5414 34.6406 176.4592 146 S 4.2087 8.8017 118.4624 60.1834 63.3641 174.1690 147 S 4.3691 8.1008 114.6329 58.6787 64.1264 173.7510 148 G 3.9217 9.5140 112.2430 44.2971 0.0000 171.0721 149 T 4.8680 7.8998 107.3563 59.9944 71.6668 173.9248 150 S 4.4756 9.5850 120.9501 57.6690 65.7236 172.2618 151 Y 4.7047 8.8544 126.3877 56.0015 38.5289 174.2387 152 P 4.5518 0.0000 0.0000 62.8433 32.5134 176.1019 153 D 4.6695 8.7180 118.9090 55.4829 41.6232 176.6115 154 V 5.3724 7.4604 111.0284 58.3787 34.5745 175.3932 155 L 3.3629 8.3779 124.3645 54.9982 42.9966 175.9169 156 K 4.8938 8.1926 125.2732 54.9496 34.8734 174.6951 157 C 5.2937 8.6704 120.1084 55.0385 40.4718 172.9303 158 L 5.0801 8.8541 123.3005 53.6202 45.3778 174.9112 159 K 5.1251 9.1010 125.5735 55.6003 33.3538 175.9827 160 A 4.8073 9.1890 125.6842 49.3389 23.1143 173.5507 161 P 4.9871 0.0000 0.0000 61.9125 33.8769 175.3353 162 I 4.2029 8.4663 123.2105 61.4922 37.8890 175.6913 163 L 4.7031 8.6462 127.6087 53.5461 42.9101 177.2581 164 S 4.2363 8.6142 116.0697 58.4789 63.6260 175.0385 165 D 4.4104 8.7338 121.4141 57.4629 40.9160 178.8500 166 S 4.1740 8.0579 114.9128 61.3853 63.1758 176.4830 167 S 4.1597 8.0135 117.6743 60.8762 62.8052 175.7129 168 C 4.2811 8.3609 122.2604 59.7454 43.2715 175.8257 169 K 3.9780 8.2483 118.8670 59.5118 31.6389 179.3225 170 S 4.2581 8.1779 114.7739 61.2665 62.7480 176.0943 171 A 4.0555 7.8666 122.9566 53.5504 19.8836 177.3045 172 Y 4.8008 7.7567 113.8444 54.9863 38.1990 172.9778 173 P 4.4032 0.0000 0.0000 64.3293 32.2401 176.9261 174 G 4.0351 9.0908 110.0875 46.3594 0.0000 173.7962 175 Q 4.5529 8.1976 117.2762 55.1056 30.9685 175.7054 176 I 4.2494 7.9650 119.3234 60.4634 37.8325 175.6708 177 T 4.5065 8.2854 116.1225 59.8464 70.6078 175.4120 178 S 4.3851 8.5200 114.8352 60.1423 63.1255 174.3135 179 N 4.9331 8.2680 118.8598 53.4156 38.5219 173.8766 180 M 5.5565 7.9323 117.1642 53.5813 35.9204 174.7011 181 F 5.1375 8.8384 115.9952 55.5189 42.1977 172.8054 182 C 5.4422 8.9444 116.4123 55.9385 40.9958 172.6172 183 A 5.0321 9.4039 122.7028 50.6493 22.3326 174.0090 184A G 3.7100 7.3157 107.9064 44.3611 0.0000 174.8071 184 Y 4.6572 8.3846 122.6084 56.0118 41.0943 176.0894 185 L 4.1530 8.7652 125.4101 57.2916 41.9810 178.2641 186 E 4.5146 8.3459 116.7365 55.6148 30.1655 178.0141 187 G 3.8036 8.5980 109.7573 46.1312 0.0000 174.9002 188A G 4.1234 8.9725 107.3770 45.4237 0.0000 173.4969 188 K 4.7893 7.5262 117.8480 54.9123 35.0886 175.4765 189 D 4.6618 8.6885 122.8844 53.5608 45.5643 175.2014 190 S 4.8136 8.2478 114.9170 58.6016 64.7720 171.6570 191 C 4.7173 9.2837 118.9205 55.5051 43.8099 172.1114 192 Q 4.3073 8.5471 121.4115 57.7740 28.8222 177.1125 193 G 4.4496 9.2645 113.6226 45.6890 0.0000 173.8336 194 D 4.6561 8.5361 118.7044 55.3576 41.5730 176.4468 195 S 4.3517 8.0187 115.1384 60.0464 63.2480 175.7198 196 G 4.0842 8.7900 112.6605 46.3736 0.0000 173.6589 197 G 4.3218 7.7181 107.2219 45.0955 0.0000 171.0572 198 P 5.1395 0.0000 0.0000 62.0754 33.6309 175.5462 199 V 4.5996 8.7421 121.8164 61.4284 33.9561 174.0015 200 V 4.7678 8.5501 129.0337 61.4003 33.5926 173.8133 201 C 5.0555 8.7701 124.9992 55.5059 43.7543 174.6568 202 S 3.3223 9.7258 120.8784 59.7351 60.0328 173.3200 203 G 3.9190 8.4375 104.3737 45.7065 0.0000 173.8433 204 K 4.6846 7.6045 118.1350 53.0837 34.9639 175.3707 *209 L 4.2053 8.2752 122.8810 55.4128 42.4100 175.8422 210 Q 4.5616 9.1946 126.1652 56.5606 31.1093 175.8502 211 G 5.2747 8.0544 104.3572 45.5692 0.0000 171.4234 212 I 5.1858 8.1543 119.7197 58.8260 41.0308 174.9963 213 V 3.8664 8.8901 127.3807 64.3798 31.8698 174.6338 214 S 4.7085 8.3147 120.3363 58.7884 64.4247 173.4181 215 W 4.7857 6.9630 114.1774 55.6151 31.7386 172.4395 216 G 3.9125 8.4425 107.6995 46.4802 0.0000 173.0469 217 S 4.6137 8.5422 115.5087 56.9055 61.9208 172.7668 *219 G 4.4528 7.9526 118.2939 45.5641 0.0000 170.7553 220 C 4.9969 8.1233 115.6025 56.4806 40.9961 173.6461 221A A 3.8428 9.2448 124.5098 53.0714 16.8719 176.9719 221 Q 4.4512 7.4406 116.1086 56.3114 29.5450 175.9109 222 K 4.2702 8.5260 122.7603 57.9759 32.6401 175.9846 223 N 4.2449 9.4324 122.5191 54.1578 37.1285 175.2264 224 K 4.3245 7.5446 114.9242 53.9776 32.1685 173.6030 225 P 4.6202 0.0000 0.0000 61.9396 33.2521 177.7755 226 G 3.5346 8.4646 106.3543 46.3158 0.0000 172.6939 227 V 4.4263 7.8025 123.2569 60.6881 34.0172 174.0199 228 Y 4.9557 8.2104 124.5105 55.9469 41.9874 175.0297 229 T 4.3071 8.6044 120.4666 63.6260 70.0776 174.2005 230 K 4.9300 9.3228 128.4488 55.4815 31.4638 177.1804 231 V 3.9839 8.7898 126.6834 65.9242 31.4048 174.9532 232 C 4.3107 8.3613 112.6053 58.4426 41.4198 175.1212 233 N 4.1236 7.9675 117.2746 54.9053 38.4079 175.6196 234 Y 4.8115 7.8916 117.2510 57.5947 38.7089 177.4894 235 V 3.7036 7.8149 121.3628 66.1088 31.6370 177.9033 236 S 4.1578 8.0967 113.5474 60.8808 63.1166 176.1292 237 W 4.1602 8.2988 131.6891 60.2471 30.4622 177.7599 238 I 3.0175 8.2700 120.1193 64.1415 36.6022 178.4699 239 K 3.7456 8.0691 119.2001 59.5463 31.6945 179.3178 240 Q 3.9075 7.8255 116.8288 59.3578 28.7753 178.9761 241 T 3.7697 7.4219 116.7234 66.4551 68.1726 176.8383 242 I 2.8242 7.1449 113.5306 63.1221 37.6230 177.7926 243 A 4.1026 7.7295 121.7951 53.9664 18.1937 178.0437 244 S 4.6887 7.4048 110.9132 58.2945 63.9180 174.0488 245 N 4.7034 7.9624 123.4832 53.5570 39.3996 174.0921 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 16 I 7.88 4.25 1.80 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 1.37 0.55 0.93 0.00 0.00 17 V 8.68 4.30 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.89 0.00 0.00 18 G 8.41 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 19 G 7.84 4.27 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 0.00 20 Y 7.90 4.97 0.00 2.95 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 21 T 8.56 4.24 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 22 C 8.64 4.18 0.00 2.72 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 23 G 8.43 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 24 A 8.46 4.07 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 25 N 8.81 4.25 0.00 2.89 2.91 0.00 0.00 7.16 7.55 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 26 T 7.53 4.23 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 1.26 0.00 0.00 27 V 7.05 4.03 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 0.33 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.48 0.00 2.36 2.35 0.00 3.64 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 2.16 1.98 0.00 29 Y 6.97 4.86 0.00 3.26 3.44 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 30 Q 7.36 4.50 0.00 1.77 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.51 0.00 0.00 0.00 0.00 0.00 1.88 2.42 0.00 31 V 9.06 4.84 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 0.83 0.00 0.00 1.01 0.00 0.00 32 S 9.00 4.94 0.00 3.08 3.38 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 33 L 8.57 4.53 0.00 0.62 1.06 0.78 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.95 5.85 0.00 2.57 2.53 0.00 0.00 6.56 7.03 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 *37 S 8.37 4.36 0.00 3.69 3.62 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 38 G 9.40 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 39 Y 6.50 4.63 0.00 3.17 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 40 H 8.91 4.41 0.00 2.89 3.23 0.00 5.86 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 41 F 8.14 5.11 0.00 3.14 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.84 4.78 0.00 2.10 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 43 G 8.79 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.64 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 0.00 0.00 0.00 0.00 45 S 8.55 5.39 0.00 3.83 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 46 L 9.25 4.76 0.00 1.86 1.67 1.03 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.60 4.52 1.89 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 1.60 0.87 0.94 0.00 0.00 48 N 7.65 4.91 0.00 3.00 3.00 0.00 0.00 6.15 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 49 S 8.74 4.32 0.00 4.21 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.99 4.58 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.97 0.00 0.00 0.00 0.00 0.00 1.89 2.13 0.00 51 W 8.47 5.47 0.00 3.34 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 52 V 9.17 5.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.99 0.00 0.00 53 V 8.78 4.98 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 1.07 0.00 0.00 54 S 8.91 5.09 0.00 3.88 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.77 4.57 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 56 A 8.33 3.78 0.38 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 57 H 8.46 4.57 0.00 3.35 3.58 0.00 5.56 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 8.00 4.64 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 59 Y 7.47 4.19 0.00 2.97 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 60 K 7.08 3.86 0.00 1.46 1.24 0.00 0.68 0.00 0.00 0.61 0.00 0.00 2.58 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.93 1.03 7.81 61 S 8.02 4.28 0.00 3.96 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.40 3.67 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 0.00 0.00 0.00 63 I 7.57 4.14 1.86 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.71 0.93 0.00 0.00 64 Q 8.76 4.68 0.00 2.04 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.58 0.00 0.00 0.00 0.00 0.00 2.17 2.25 0.00 65 V 8.83 4.25 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 0.98 0.00 0.00 0.91 0.00 0.00 66 R 8.98 5.13 0.00 1.69 1.76 0.00 2.71 0.00 0.00 2.59 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.28 0.00 67 L 8.94 4.71 0.00 1.64 1.65 0.96 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.23 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 70 E 8.28 4.39 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 2.38 2.09 0.00 71 D 7.98 4.87 0.00 2.78 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.01 5.01 0.00 2.92 2.75 0.00 0.00 7.20 8.74 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 73 I 8.34 3.86 1.44 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.52 -0.41 0.00 0.00 74 N 7.98 4.72 0.00 2.72 2.88 0.00 0.00 6.64 8.00 0.00 0.00 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 V 7.34 4.32 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 0.78 0.00 0.00 1.00 0.00 0.00 76 V 8.50 4.12 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 0.88 0.00 0.00 1.02 0.00 0.00 77 E 9.45 4.49 0.00 1.97 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 2.26 2.47 0.00 78 G 8.30 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.18 4.90 0.00 2.65 2.81 0.00 0.00 7.18 7.67 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 80 E 7.97 4.67 0.00 1.44 1.70 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 2.74 2.62 0.00 81 Q 8.85 4.29 0.00 1.99 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.77 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 82 F 8.70 5.50 0.00 2.83 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 83 I 8.81 4.62 1.88 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 1.12 0.75 0.89 0.00 0.00 84 S 8.71 4.66 0.00 3.89 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 85 A 8.65 4.61 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 8.84 4.52 0.00 3.78 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.63 4.69 0.00 1.77 1.51 0.00 1.76 0.00 0.00 1.96 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.53 7.81 88 S 8.83 5.35 0.00 3.99 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 I 9.27 4.58 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 1.26 0.95 1.19 0.00 0.00 90 V 8.48 4.20 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 0.62 0.00 0.00 0.80 0.00 0.00 91 H 8.60 3.32 0.00 2.82 3.08 0.00 5.64 0.00 0.00 0.00 0.00 6.67 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 4.30 0.00 2.15 2.16 0.00 2.72 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.89 0.00 93 S 7.77 4.68 0.00 3.91 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 94 Y 8.05 4.25 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 95 N 8.32 4.67 0.00 2.57 2.44 0.00 0.00 6.44 7.38 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 96 S 7.70 3.85 0.00 3.97 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 97 N 8.31 4.35 0.00 2.76 2.78 0.00 0.00 6.85 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 98 T 7.76 3.89 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 1.10 0.00 0.00 99 L 7.93 3.69 0.00 1.46 1.84 0.98 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.63 4.39 0.00 2.73 2.65 0.00 0.00 7.26 7.72 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 0.00 101 N 8.72 4.70 0.00 2.94 2.62 0.00 0.00 7.25 8.27 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 0.00 102 D 7.80 4.71 0.00 3.22 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.18 4.87 1.49 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 1.33 1.10 0.09 0.00 0.00 104 M 9.19 5.43 0.00 2.13 1.83 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.65 0.00 105 L 9.23 5.38 0.00 1.76 1.83 0.04 1.09 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 0.00 106 I 9.14 4.98 1.93 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 1.18 0.97 0.89 0.00 0.00 107 K 8.65 3.74 0.00 0.79 1.00 0.00 1.20 0.00 0.00 1.31 0.00 0.00 2.63 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.75 0.21 7.81 108 L 8.31 4.54 0.00 1.52 1.49 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.79 4.16 0.00 1.58 1.84 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.46 7.81 110 S 7.72 4.62 0.00 3.89 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.43 4.40 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 9.09 4.16 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 0.00 113 S 9.21 4.45 0.00 3.85 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 0.00 114 L 8.45 4.68 0.00 1.69 1.61 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.98 4.98 0.00 2.88 2.91 0.00 0.00 6.39 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 0.00 116 S 8.74 4.19 0.00 4.01 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 0.00 117 R 8.40 4.31 0.00 1.98 2.02 0.00 3.20 0.00 0.00 3.16 7.38 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.58 4.37 0.00 3.88 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 0.00 128 C 8.51 4.41 0.00 2.92 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 0.00 129 A 7.56 4.23 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 0.00 130 S 8.21 4.22 0.00 3.84 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *132 A 8.27 4.32 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 0.00 133 G 9.16 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 0.00 134 T 7.62 3.97 4.12 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 1.14 0.00 0.00 135 Q 8.60 4.62 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.85 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 136 C 9.29 5.23 0.00 2.78 2.97 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 0.00 137 L 8.87 5.19 0.00 1.78 1.56 1.02 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.23 5.27 1.87 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.30 0.96 0.00 0.00 139 S 8.48 4.89 0.00 3.56 3.59 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 0.00 140 G 7.71 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.72 4.62 0.00 3.16 2.97 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 0.00 142 G 8.44 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 0.00 143 N 8.46 3.66 0.00 1.94 2.54 0.00 0.00 7.45 7.60 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 0.00 144 T 8.13 5.05 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 145 K 7.76 4.62 0.00 1.68 1.85 0.00 1.76 0.00 0.00 2.03 0.00 0.00 3.07 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.31 1.31 7.81 146 S 8.80 4.21 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.10 4.37 0.00 3.95 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 0.00 148 G 9.51 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 0.00 0.00 0.00 149 T 7.90 4.87 4.50 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 1.36 0.00 0.00 150 S 9.59 4.48 0.00 3.84 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.85 4.70 0.00 2.93 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 0.00 152 P 0.00 4.55 0.00 2.43 2.08 0.00 4.01 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 2.14 2.01 0.00 153 D 8.72 4.67 0.00 2.79 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 0.00 154 V 7.46 5.37 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.97 0.00 0.00 155 L 8.38 3.36 0.00 1.30 1.26 -0.55 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.19 4.89 0.00 1.73 1.52 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.48 7.81 157 C 8.67 5.29 0.00 1.34 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 0.00 0.00 0.00 158 L 8.85 5.08 0.00 1.68 1.47 1.09 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.10 5.13 0.00 1.80 1.81 0.00 1.79 0.00 0.00 1.88 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.51 1.68 7.81 160 A 9.19 4.81 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 0.00 161 P 0.00 4.99 0.00 2.04 2.11 0.00 3.10 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.86 0.00 162 I 8.47 4.20 1.85 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.34 0.70 0.00 0.00 163 L 8.65 4.70 0.00 1.68 1.61 0.93 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 0.00 164 S 8.61 4.24 0.00 4.00 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 0.00 165 D 8.73 4.41 0.00 2.84 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 0.00 166 S 8.06 4.17 0.00 4.10 4.12 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 0.00 167 S 8.01 4.16 0.00 4.05 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.36 4.28 0.00 3.21 3.36 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 0.00 169 K 8.25 3.98 0.00 1.86 1.91 0.00 1.91 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.64 7.81 170 S 8.18 4.26 0.00 3.97 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 0.00 171 A 7.87 4.06 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 0.00 172 Y 7.76 4.80 0.00 3.06 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 0.00 173 P 0.00 4.40 0.00 2.08 2.07 0.00 3.85 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 2.05 2.13 0.00 174 G 9.09 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.20 4.55 0.00 2.51 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.50 7.14 0.00 0.00 0.00 0.00 0.00 2.29 2.50 0.00 176 I 7.97 4.25 1.97 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 1.81 0.90 0.99 0.00 0.00 177 T 8.29 4.51 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 178 S 8.52 4.39 0.00 4.01 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 0.00 179 N 8.27 4.93 0.00 3.09 3.10 0.00 0.00 6.66 7.98 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 0.00 180 M 7.93 5.56 0.00 1.84 2.09 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 181 F 8.84 5.14 0.00 3.05 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 8.94 5.44 0.00 2.99 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.40 5.03 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 184A G 7.32 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 0.00 184 Y 8.38 4.66 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 0.00 185 L 8.77 4.15 0.00 1.71 1.74 0.92 0.96 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 0.00 186 E 8.35 4.51 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 187 G 8.60 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A G 8.97 4.12 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 0.00 188 K 7.53 4.79 0.00 1.79 1.85 0.00 0.86 0.00 0.00 1.32 0.00 0.00 2.52 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.49 1.21 7.81 189 D 8.69 4.66 0.00 2.84 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 0.00 0.00 0.00 0.00 190 S 8.25 4.81 0.00 4.03 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 0.00 191 C 9.28 4.72 0.00 2.91 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.55 4.31 0.00 2.27 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.18 5.22 0.00 0.00 0.00 0.00 0.00 2.58 2.66 0.00 193 G 9.26 4.45 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 0.00 194 D 8.54 4.66 0.00 2.94 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 0.00 195 S 8.02 4.35 0.00 3.99 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 0.00 196 G 8.79 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.72 4.32 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 0.00 198 P 0.00 5.14 0.00 2.30 2.34 0.00 3.69 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.22 0.00 199 V 8.74 4.60 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.53 0.00 0.00 200 V 8.55 4.77 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 0.92 0.00 0.00 0.67 0.00 0.00 201 C 8.77 5.06 0.00 2.79 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 0.00 202 S 9.73 3.32 0.00 3.95 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 0.00 203 G 8.44 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 0.00 0.00 0.00 204 K 7.60 4.68 0.00 1.73 1.65 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.30 1.40 7.81 *209 L 8.28 4.21 0.00 1.49 1.62 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 9.19 4.56 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.38 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 211 G 8.05 5.27 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 0.00 212 I 8.15 5.19 1.93 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 1.30 0.89 0.98 0.00 0.00 213 V 8.89 3.87 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 1.25 0.00 0.00 214 S 8.31 4.71 0.00 3.92 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 0.00 215 W 6.96 4.79 0.00 3.29 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 0.00 216 G 8.44 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.54 4.61 0.00 4.31 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 *219 G 7.95 4.45 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 0.00 220 C 8.12 5.00 0.00 2.95 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 221A A 9.24 3.84 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 7.44 4.45 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.96 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 222 K 8.53 4.27 0.00 1.72 1.72 0.00 2.18 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.64 1.53 7.81 223 N 9.43 4.24 0.00 2.80 2.79 0.00 0.00 6.95 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 K 7.54 4.32 0.00 1.72 1.77 0.00 1.63 0.00 0.00 1.21 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.46 7.81 225 P 0.00 4.62 0.00 2.26 2.11 0.00 3.68 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 226 G 8.46 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 0.00 227 V 7.80 4.43 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 -0.81 0.00 0.00 228 Y 8.21 4.96 0.00 1.43 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.60 4.31 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 1.26 0.00 0.00 230 K 9.32 4.93 0.00 2.11 1.91 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.68 7.81 231 V 8.79 3.98 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 1.21 0.00 0.00 1.13 0.00 0.00 232 C 8.36 4.31 0.00 3.16 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 0.00 233 N 7.97 4.12 0.00 2.39 2.26 0.00 0.00 6.93 6.95 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 0.00 234 Y 7.89 4.81 0.00 3.26 3.26 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 0.00 235 V 7.81 3.70 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 1.18 0.00 0.00 1.03 0.00 0.00 236 S 8.10 4.16 0.00 4.12 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 0.00 237 W 8.30 4.16 0.00 3.48 3.59 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 0.00 238 I 8.27 3.02 2.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.03 0.72 0.00 0.00 239 K 8.07 3.75 0.00 1.90 1.78 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.59 7.81 240 Q 7.83 3.91 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.02 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 241 T 7.42 3.77 3.55 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 0.76 0.00 0.00 242 I 7.14 2.82 0.95 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.22 -0.57 0.00 0.00 243 A 7.73 4.10 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 0.00 244 S 7.40 4.69 0.00 3.79 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 0.00 245 N 7.96 4.70 0.00 3.03 3.00 0.00 0.00 6.89 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 * Residues marked with a * may have inaccurate shift predictions.