NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.4565 8.2227 120.3134 52.5372 40.1052 174.4425 2 V 3.7100 7.3089 121.5437 62.9943 31.9360 174.6324 3 Q 4.6646 10.4020 131.2677 54.1664 32.6778 173.4568 4 L 5.2139 8.6388 125.1138 52.9916 44.9455 176.0025 5 V 4.3369 8.9158 124.4448 61.0542 33.8099 174.7745 6 E 5.0651 8.9072 127.6475 56.5746 30.7961 175.8929 7 S 4.5148 9.2813 114.8519 58.4225 66.4565 175.9529 8 G 3.9192 9.2737 108.3527 45.1782 0.0000 174.0014 9 G 3.7252 7.7085 108.2212 44.7295 0.0000 172.7085 10 G 3.9365 7.5746 105.7771 44.3623 0.0000 170.9195 11 L 4.8152 7.8709 122.3178 54.7115 42.9711 176.8476 12 V 4.5204 9.2898 125.7708 60.8493 35.1167 174.4335 13 Q 4.6917 8.6252 128.2653 54.7341 30.3897 173.5804 14 P 4.5005 0.0000 0.0000 64.4949 31.7675 176.9925 15 G 3.8974 9.6467 112.3397 45.0353 0.0000 173.5434 16 G 4.0105 8.1538 108.0106 45.8549 0.0000 172.7152 17 S 5.3114 8.1366 114.1231 57.0717 67.2826 173.6530 18 R 4.4000 8.7993 120.2444 55.3159 33.9456 173.1905 19 K 4.8496 8.5948 127.2838 54.6515 34.1539 174.9334 20 L 4.9219 8.6708 127.3688 53.2175 44.5918 175.6508 21 S 5.5377 9.1404 117.4363 57.1701 67.3722 172.8303 22 C 5.1816 9.0417 121.2128 55.1677 44.8608 172.5585 23 A 4.4892 9.0380 129.8776 51.2289 19.3056 175.7750 24 A 5.3091 8.0094 125.2651 50.6821 21.3008 176.0871 25 S 4.3041 9.1053 113.5688 58.5004 66.5586 175.9212 26 G 3.9648 10.9835 109.0376 46.5642 0.0000 172.5429 27 F 4.8297 7.2075 112.4181 56.1354 40.6181 174.9689 28 T 4.2428 8.4894 118.2754 61.6958 67.1770 175.1668 29 F 3.8241 8.3300 128.7552 61.2235 39.4166 177.4695 30 M 4.1782 8.0790 115.0131 57.4004 30.9672 176.9024 31 R 4.1624 8.0924 117.4432 56.6806 30.8513 176.0413 32 F 4.8904 8.0957 117.6880 55.1681 42.2585 175.4761 33 G 3.8221 8.7050 109.5221 46.6069 0.0000 172.1193 34 M 5.3772 8.8065 119.8996 53.6930 36.6885 174.1823 35 H 5.6791 9.1694 117.3386 53.9572 33.8188 172.4276 36 W 5.2470 9.2079 119.3648 55.0818 32.2437 174.9910 37 V 5.0789 9.7446 124.5423 61.0559 34.5768 174.3460 38 R 5.0615 9.1398 123.0476 54.4283 33.1177 174.6725 39 Q 4.9470 9.1722 120.7793 53.1696 31.7160 174.2694 40 A 4.5018 8.6689 128.3025 50.7417 19.6392 175.1462 41 P 4.0356 0.0000 0.0000 64.3029 32.2221 176.8993 42 E 3.7624 8.8698 123.3674 56.5708 26.4256 172.2780 43 K 4.4841 7.3643 117.8796 55.2362 36.3130 174.4970 44 G 4.0193 8.3034 109.9443 44.3978 0.0000 172.0322 45 L 4.7118 8.2498 118.9196 54.1108 42.8395 176.5146 46 E 4.7599 9.2832 124.1169 53.8035 32.5762 174.6306 47 W 4.5181 9.2846 135.0000 58.2282 31.2120 174.6817 48 V 4.0009 8.4607 126.2002 63.8697 32.8001 174.9917 49 A 4.5903 6.9845 119.3768 51.0013 22.7395 173.6839 50 Y 5.3837 9.2848 119.9784 56.1361 43.1498 174.1457 51 I 4.6193 7.3394 123.9279 59.0763 41.9399 174.7374 52 S 4.2947 8.5452 124.7537 57.5920 63.9707 175.1962 52A S 4.0395 8.1228 114.5650 60.0963 62.1829 175.6136 53 G 3.8462 7.8106 107.0036 44.7487 0.0000 174.2417 54 S 4.0191 7.9926 113.3042 58.8479 61.0845 172.3174 55 S 4.1801 7.5805 118.1092 60.9628 62.8484 174.6252 56 T 4.4620 8.2381 118.1156 61.6199 70.5125 173.8118 57 I 4.8597 8.1220 126.5843 59.5762 40.4255 174.5606 58 Y 5.3226 8.8307 123.3296 56.6522 41.8112 174.1815 59 Y 5.1899 8.9330 118.6467 55.9325 42.4377 174.9183 60 A 4.4309 8.4513 123.1608 51.7421 19.2997 178.5328 61 D 4.3463 9.1966 121.3829 57.9193 41.0297 178.8215 62 T 4.0469 7.8140 105.4275 62.4864 69.3646 174.7975 63 V 3.6674 7.5004 121.5414 63.1729 33.7094 177.5666 64 K 3.7915 7.2578 120.5141 58.8908 32.3106 177.0025 65 G 3.7777 7.7653 105.9034 46.9202 0.0000 174.7286 66 R 4.2402 7.6991 118.0309 57.1262 30.8914 175.7111 67 F 5.4982 7.8944 116.0807 55.9656 41.2129 175.6352 68 T 4.7399 9.0821 119.3011 61.8621 71.6875 172.6492 69 I 5.0894 9.1334 127.7785 59.8930 39.7909 174.5862 70 S 4.9559 8.8495 122.1696 57.7994 66.8435 172.8286 71 R 5.0322 8.4978 115.3541 55.0285 32.7570 174.5495 72 D 4.8092 9.2998 120.4799 51.9405 42.3332 175.6663 73 N 4.6667 9.0818 122.8712 56.0809 38.5669 174.9441 74 P 4.2710 0.0000 0.0000 64.9919 31.4909 177.7638 75 K 4.2798 7.9374 113.9546 54.9898 32.9460 176.0193 76 N 3.3566 8.2684 116.8192 54.3401 36.8910 173.7915 77 T 4.5871 6.9520 111.7886 61.4923 73.0743 173.5360 78 L 4.8775 8.3038 127.3655 53.4265 44.6799 175.0549 79 F 5.8300 9.3842 122.9753 55.8586 43.9711 174.0373 80 L 4.6002 8.7936 121.7712 53.7602 44.9345 174.4807 81 Q 4.5573 9.3720 129.6408 55.0193 30.8116 174.0828 82 M 4.7229 8.8498 126.3907 53.5608 35.0515 174.9395 82A T 4.9798 8.2363 111.4488 58.2750 72.7176 173.2647 82B S 3.7023 8.6183 115.0046 59.2062 60.6288 173.4368 82C L 4.3324 8.2723 120.0035 55.2646 42.5416 177.4599 83 R 4.9250 9.1744 122.0535 54.1069 32.8581 177.2691 84 S 4.4085 8.7972 116.7156 62.0434 62.8967 176.3968 85 E 4.3133 8.2146 113.8718 57.5661 29.0921 176.7348 86 D 4.8217 8.3339 119.0958 54.9086 41.6109 176.5430 87 T 4.3112 8.1374 117.4053 64.4847 68.9044 173.4562 88 A 4.3558 8.8372 127.0225 51.4334 23.7903 174.2145 89 L 4.7989 8.0762 121.7426 54.5019 43.7531 174.8271 90 Y 5.0824 9.6774 125.2014 56.6426 40.3147 174.2837 91 Y 5.6003 9.9436 122.4252 56.3705 41.6776 172.1260 92 C 4.8798 9.6771 117.6322 53.4750 43.5009 172.5846 93 A 5.0031 8.3817 123.1185 49.9036 22.2549 175.1360 94 R 4.2933 8.8342 121.9875 56.0857 31.8125 175.7709 95 S 5.0502 8.9795 121.4037 57.2431 62.3171 172.7906 96 G 4.8963 8.7195 115.1689 44.2895 0.0000 171.0441 97 G 3.7322 8.9685 112.2421 45.4203 0.0000 172.8633 98 I 4.6558 8.2785 124.8761 59.1852 40.1978 174.6557 99 E 4.7262 8.8391 126.9108 56.0242 30.1723 176.2961 100 R 4.7879 9.1347 122.8907 53.9351 33.6367 176.2008 100A Y 4.3880 8.8836 116.6766 58.9778 38.0185 176.1894 100B D 4.4947 7.6545 117.4821 52.0237 41.2613 175.7875 100C G 3.8370 6.4901 105.1998 46.1152 0.0000 170.6764 100D T 4.9175 8.3296 114.3088 60.3910 69.8072 173.7769 100E Y 4.3851 8.7114 130.8627 57.1001 40.2300 173.6547 100F Y 5.2978 7.9994 123.7374 56.6896 40.5221 175.1922 100G V 4.4368 8.2827 119.9852 61.0850 35.3804 173.3022 100H M 5.5197 8.9376 122.5625 54.6737 30.0934 175.5618 101 D 4.5745 8.5754 123.3799 55.0047 41.6538 175.9313 102 Y 5.1570 7.8771 116.6283 56.0088 41.9759 174.3330 103 W 5.2727 9.2267 122.6133 54.9419 33.0671 175.3526 104 G 4.1333 8.7970 110.2542 45.1547 0.0000 173.7467 105 Q 4.3048 8.8522 120.2018 57.0984 29.3090 177.2083 106 G 3.9513 9.3770 102.3411 45.4684 0.0000 172.2509 107 T 4.8180 8.8104 109.6452 59.5504 71.9041 173.1104 108 S 5.1001 8.5888 119.1004 57.4638 65.3983 172.7732 109 V 4.7531 9.2555 124.2923 61.3908 34.0471 174.0646 110 T 4.8146 9.0585 125.5061 62.0041 70.8109 173.8568 111 V 5.0274 9.0904 128.6255 61.3189 30.9606 174.7088 112 S 4.8170 8.3854 120.9995 57.0827 65.9294 174.2022 113 S 4.6604 8.5808 117.1850 57.7618 63.4572 174.2823 114 A 3.8599 7.5501 124.4944 51.9118 18.5154 177.4451 115 K 4.2021 8.0834 122.5376 55.4826 33.1048 176.5235 116 T 4.3581 8.7019 116.1139 63.0003 69.1855 173.3148 117 T 4.8133 9.1827 123.4918 60.8075 72.0242 172.3026 118 P 4.9405 0.0000 0.0000 61.8742 32.2996 174.2981 119 P 4.8051 0.0000 0.0000 62.7301 32.8866 175.4212 120 S 4.5099 8.7870 118.3621 57.1071 64.6175 173.1089 121 V 4.4684 7.9196 124.9913 61.2226 33.0903 174.3153 122 Y 5.1818 8.8433 125.6008 55.4697 41.4574 173.2297 123 P 4.9489 0.0000 0.0000 62.7835 32.9222 176.0917 124 L 4.7431 9.5351 123.0445 53.1143 42.9589 174.6803 125 A 4.9564 8.2902 124.6420 48.9171 21.3929 174.5527 126 P 4.2420 0.0000 0.0000 62.8842 32.0358 176.7525 127 G 3.9107 8.4142 109.7020 44.7488 0.0000 173.9683 128 S 4.1456 8.7858 114.4926 61.4587 62.3463 177.1346 129 A 4.4565 7.8476 120.1208 52.0746 17.9291 177.3092 130 A 4.2710 7.9160 124.3634 54.3175 16.7816 177.9437 131 Q 4.2584 7.7183 121.6906 55.3455 30.5414 175.0706 132 T 4.4329 7.7703 114.6561 61.5578 70.9514 172.9961 133 N 5.0562 8.4045 132.7452 53.2645 37.5437 177.6025 134 S 4.3203 8.8530 118.4253 61.8004 64.0759 173.9582 135 M 5.1640 7.9706 118.0190 53.4493 34.8313 175.8218 136 V 4.5377 9.0822 113.7291 59.9517 35.8672 174.7007 137 T 4.9793 8.5045 120.2730 62.0354 70.6735 173.5531 138 L 4.9588 8.4197 125.8798 53.4742 46.4007 174.9599 139 G 4.5088 7.9767 105.4484 47.1237 0.0000 171.7847 140 C 5.7241 9.3958 116.7898 55.0407 42.1263 173.2735 141 L 5.0798 9.2604 125.4908 53.5623 44.0516 175.3896 142 V 4.7211 9.3334 120.8826 59.7736 33.4859 174.2977 143 K 4.6830 9.0203 128.0082 54.6091 34.4554 176.1396 144 G 4.0668 8.0388 113.2973 47.2446 0.0000 172.1069 145 Y 5.1792 7.3448 116.2048 55.4207 42.1363 175.8949 146 F 4.9025 9.3864 120.1956 57.1785 43.5517 171.7693 147 P 3.8091 0.0000 0.0000 61.0276 33.9432 174.9608 148 E 4.1135 8.3887 118.4279 56.2878 29.9851 174.5518 149 P 5.0177 0.0000 0.0000 61.1727 34.0681 173.9034 150 V 4.5670 7.8375 116.4115 61.8507 34.5715 174.7392 151 T 4.6369 8.7453 117.5706 59.8948 71.3560 173.2915 152 V 4.8895 8.2522 123.5286 61.3575 34.3762 174.3542 153 T 4.8426 8.6391 116.3937 59.8089 73.1920 172.4236 154 W 5.0697 8.3391 120.7260 55.2566 32.7681 175.6950 155 N 4.2661 9.8789 123.2060 55.3733 36.0703 174.9793 156 S 3.7263 9.4898 107.1138 59.7354 60.9940 173.9853 157 G 4.1337 8.0817 108.6387 45.7624 0.0000 176.1848 158 S 4.1312 8.3155 116.1086 61.5911 62.8310 175.1116 159 L 4.3097 7.8706 123.4490 54.3516 40.5867 176.3712 160 S 4.6448 8.4514 117.7156 57.9558 65.1091 174.6348 161 S 4.3768 8.0228 114.7776 58.1667 63.4309 172.9988 162 G 3.8478 8.4869 111.7810 46.9016 0.0000 172.8465 163 V 4.7130 7.6642 117.8471 60.9218 34.2771 174.5025 164 H 4.5466 9.1311 123.7214 54.4772 32.1028 172.7265 165 T 4.8684 8.2580 121.2282 61.7504 69.4209 174.7988 166 F 4.4744 8.7737 125.9416 56.1317 39.8438 174.5219 167 P 4.3683 0.0000 0.0000 62.7489 31.8486 176.1857 168 A 4.6317 8.4342 122.9675 52.0472 19.6265 176.8694 169 V 4.4159 8.9173 121.0667 60.9788 34.3637 174.4388 170 L 4.2689 8.6878 130.2524 54.1072 42.4459 175.8342 171 Q 4.3381 8.5752 126.6980 54.8337 30.9104 175.3623 172 S 3.6260 8.6141 120.6832 61.6858 59.7117 172.2133 173 D 4.1631 7.8275 118.2925 52.9834 38.9980 175.2258 174 L 4.5820 7.1190 118.9705 55.0105 46.7676 175.8057 175 Y 4.7982 8.7550 122.1488 57.7761 39.7768 174.7811 176 T 5.3415 8.5401 117.1211 62.3225 73.4333 172.7917 177 L 5.2618 9.4068 126.6097 53.9867 46.5526 174.3934 178 S 5.3873 8.7674 115.9170 57.0369 67.2177 172.4665 179 S 5.5433 9.5831 115.0550 57.0044 66.0533 172.8395 180 S 5.4734 9.5394 120.8708 56.9052 66.4911 173.1973 181 V 5.0009 7.9778 112.6000 59.3629 36.1458 174.2404 182 T 4.9809 8.3215 120.0515 61.9231 70.7559 173.8380 183 V 4.5307 8.5901 119.5791 58.4114 35.5883 173.9175 184 P 4.7027 0.0000 0.0000 62.7104 32.1983 176.9031 185 S 4.2799 9.4964 119.4322 61.8564 63.0046 177.1011 186 S 4.1296 8.2306 113.0667 61.0861 62.6023 173.6803 187 P 4.4781 0.0000 0.0000 62.8540 31.4362 175.5395 188 R 4.8502 7.7799 118.8552 53.9998 32.6058 172.5573 189 P 4.7290 0.0000 0.0000 62.8211 31.5655 176.7650 190 S 4.2484 8.2806 115.8182 61.4945 62.7352 174.0851 191 E 4.6525 8.0928 119.5620 54.2688 31.1057 175.8225 192 T 4.3398 8.1939 118.2992 63.0062 69.7694 174.4284 193 V 4.9087 8.3008 124.3737 61.4073 34.6733 174.2240 194 T 5.3799 9.7957 117.8048 60.2033 72.5979 170.1352 195 C 4.4843 8.7699 118.6191 53.6780 45.4530 172.0972 196 N 5.3402 8.6992 120.0104 51.5510 40.7555 173.6887 197 V 4.7022 8.9128 124.3371 60.8265 34.3937 173.9996 198 A 5.0222 8.6631 129.2264 50.4257 22.2147 174.2707 199 H 4.7713 8.9053 122.6182 53.3675 30.7533 172.3139 200 P 4.0966 0.0000 0.0000 65.3271 31.3894 178.7397 201 A 4.1020 7.8324 118.6695 54.3805 18.1644 177.9110 202 S 4.5709 7.5660 107.5952 57.3128 63.7414 174.4435 203 S 3.7887 8.3553 115.6279 60.0117 60.7831 171.5555 204 T 4.3554 7.3133 116.0523 63.4545 69.6763 174.3423 205 K 5.0077 8.2512 123.9163 55.3424 36.4158 175.7106 206 V 4.4907 9.2214 124.5310 60.0502 35.0582 173.8009 207 D 5.2604 8.6919 122.9680 52.4702 43.2819 175.7731 208 K 4.3958 8.9284 124.1999 54.1540 34.7481 175.0491 209 K 4.5476 8.7285 129.0873 56.5254 33.2139 176.2697 210 I 4.4195 8.7407 128.4960 60.2065 37.7320 175.5340 211 V 4.4357 8.1846 120.4432 58.4909 33.7066 174.5986 212 P 4.3762 0.0000 0.0000 62.4953 31.7998 176.5483 213 R 3.9593 8.4590 124.2577 58.0619 30.6206 177.1376 *214 D 4.9178 8.8630 120.7761 53.3443 39.6359 171.4009 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 D 8.22 4.46 0.00 2.85 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 2 V 7.31 3.71 0.80 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 -0.41 0.00 0.00 0.39 0.00 0.00 3 Q 10.40 4.66 0.00 2.07 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.52 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 4 L 8.64 5.21 0.00 1.54 1.55 nan 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.92 4.34 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.95 0.00 0.00 6 E 8.91 5.07 0.00 2.02 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 0.00 2.55 2.37 0.00 7 S 9.28 4.51 0.00 3.88 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 8 G 9.27 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 9 G 7.71 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 7.57 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 11 L 7.87 4.82 0.00 1.72 1.65 1.21 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 12 V 9.29 4.52 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 0.89 0.00 0.00 13 Q 8.63 4.69 0.00 2.19 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.25 0.00 14 P 0.00 4.50 0.00 2.09 2.01 0.00 3.75 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 2.04 2.13 0.00 15 G 9.65 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 16 G 8.15 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 17 S 8.14 5.31 0.00 3.69 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 18 R 8.80 4.40 0.00 1.71 1.48 0.00 3.02 0.00 0.00 3.02 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.43 0.00 19 K 8.59 4.85 0.00 1.86 1.56 0.00 1.65 0.00 0.00 1.53 0.00 0.00 2.17 0.00 0.00 2.17 0.00 0.00 0.00 0.00 1.29 1.54 7.81 20 L 8.67 4.92 0.00 1.00 1.51 0.17 0.36 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 21 S 9.14 5.54 0.00 3.85 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 22 C 9.04 5.18 0.00 2.65 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 23 A 9.04 4.49 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.01 5.31 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 S 9.11 4.30 0.00 3.85 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 26 G 10.98 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 F 7.21 4.83 0.00 2.95 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 28 T 8.49 4.24 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 1.27 0.00 0.00 29 F 8.33 3.82 0.00 2.53 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 30 M 8.08 4.18 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.58 0.00 31 R 8.09 4.16 0.00 2.00 1.60 0.00 3.12 0.00 0.00 3.32 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 32 F 8.10 4.89 0.00 3.12 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 33 G 8.71 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 M 8.81 5.38 0.00 1.72 1.76 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.67 0.00 35 H 9.17 5.68 0.00 2.94 3.33 0.00 5.55 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 W 9.21 5.25 0.00 3.34 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 37 V 9.74 5.08 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 1.46 0.00 0.00 0.86 0.00 0.00 38 R 9.14 5.06 0.00 1.11 0.94 0.00 2.58 0.00 0.00 3.06 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.44 0.00 39 Q 9.17 4.95 0.00 2.36 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.98 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 40 A 8.67 4.50 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 41 P 0.00 4.04 0.00 2.11 2.10 0.00 3.89 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 42 E 8.87 3.76 0.00 2.13 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 2.25 2.31 0.00 43 K 7.36 4.48 0.00 1.77 1.75 0.00 1.83 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.36 1.42 7.81 44 G 8.30 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.25 4.71 0.00 1.63 1.80 0.97 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 46 E 9.28 4.76 0.00 2.06 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 2.29 2.33 0.00 47 W 9.28 4.52 0.00 3.39 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.46 4.00 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 1.22 0.00 0.00 1.07 0.00 0.00 49 A 6.98 4.59 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Y 9.28 5.38 0.00 3.48 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 I 7.34 4.62 1.70 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 1.06 0.68 0.79 0.00 0.00 52 S 8.55 4.29 0.00 3.77 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 52A S 8.12 4.04 0.00 4.17 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 53 G 7.81 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 S 7.99 4.02 0.00 4.02 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 55 S 7.58 4.18 0.00 3.62 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 56 T 8.24 4.46 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 0.55 0.00 0.00 57 I 8.12 4.86 1.83 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.50 0.62 0.00 0.00 58 Y 8.83 5.32 0.00 3.38 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.93 5.19 0.00 2.92 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 60 A 8.45 4.43 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 61 D 9.20 4.35 0.00 2.77 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 T 7.81 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 1.20 0.00 0.00 63 V 7.50 3.67 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 0.92 0.00 0.00 0.21 0.00 0.00 64 K 7.26 3.79 0.00 1.83 1.79 0.00 1.92 0.00 0.00 1.83 0.00 0.00 3.10 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.45 7.81 65 G 7.77 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 66 R 7.70 4.24 0.00 1.87 2.30 0.00 3.23 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 1.65 1.54 0.00 67 F 7.89 5.50 0.00 2.68 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 68 T 9.08 4.74 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 69 I 9.13 5.09 2.09 0.00 0.00 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 1.45 1.38 0.83 0.00 0.00 70 S 8.85 4.96 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 71 R 8.50 5.03 0.00 2.08 1.95 0.00 2.84 0.00 0.00 3.10 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.65 0.00 72 D 9.30 4.81 0.00 3.01 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 73 N 9.08 4.67 0.00 2.83 2.95 0.00 0.00 7.02 8.03 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 74 P 0.00 4.27 0.00 2.14 2.14 0.00 3.98 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.21 0.00 75 K 7.94 4.28 0.00 1.76 1.82 0.00 2.08 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.49 7.81 76 N 8.27 3.36 0.00 2.56 2.46 0.00 0.00 6.73 7.90 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 77 T 6.95 4.59 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 0.69 0.00 0.00 78 L 8.30 4.88 0.00 1.85 1.37 1.05 -0.04 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 79 F 9.38 5.83 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 80 L 8.79 4.60 0.00 0.27 0.38 0.65 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 9.37 4.56 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.53 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 82 M 8.85 4.72 0.00 1.23 1.54 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.81 0.00 82A T 8.24 4.98 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 1.17 0.00 0.00 82B S 8.62 3.70 0.00 4.00 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 82C L 8.27 4.33 0.00 1.77 1.65 1.10 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 83 R 9.17 4.93 0.00 1.94 1.98 0.00 3.31 0.00 0.00 3.31 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 84 S 8.80 4.41 0.00 3.91 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 85 E 8.21 4.31 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 86 D 8.33 4.82 0.00 2.94 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.14 4.31 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 88 A 8.84 4.36 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 89 L 8.08 4.80 0.00 1.75 1.59 0.77 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 90 Y 9.68 5.08 0.00 2.96 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 91 Y 9.94 5.60 0.00 3.21 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 92 C 9.68 4.88 0.00 2.09 1.50 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 93 A 8.38 5.00 0.14 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 94 R 8.83 4.29 0.00 1.63 1.84 0.00 3.35 0.00 0.00 2.74 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.14 0.00 95 S 8.98 5.05 0.00 4.13 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 96 G 8.72 4.90 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 97 G 8.97 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 I 8.28 4.66 1.89 0.00 0.00 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 1.25 1.07 0.89 0.00 0.00 99 E 8.84 4.73 0.00 1.86 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 2.28 0.00 100 R 9.13 4.79 0.00 2.00 1.89 0.00 3.17 0.00 0.00 3.26 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 100A Y 8.88 4.39 0.00 3.10 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 100B D 7.65 4.49 0.00 2.39 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 0.00 0.00 0.00 100C G 6.49 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100D T 8.33 4.92 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 1.21 0.00 0.00 100E Y 8.71 4.39 0.00 3.03 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 100F Y 8.00 5.30 0.00 2.75 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 100G V 8.28 4.44 2.34 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 0.77 0.00 0.00 1.06 0.00 0.00 100H M 8.94 5.52 0.00 1.44 2.16 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.12 0.00 101 D 8.58 4.57 0.00 2.58 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 0.00 102 Y 7.88 5.16 0.00 2.72 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 0.00 103 W 9.23 5.27 0.00 2.93 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 0.00 104 G 8.80 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 Q 8.85 4.30 0.00 2.13 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.49 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 106 G 9.38 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 0.00 107 T 8.81 4.82 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 1.27 0.00 0.00 108 S 8.59 5.10 0.00 3.92 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 0.00 109 V 9.26 4.75 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 0.93 0.00 0.00 0.63 0.00 0.00 110 T 9.06 4.81 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 1.34 0.00 0.00 111 V 9.09 5.03 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 0.67 0.00 0.00 1.09 0.00 0.00 112 S 8.39 4.82 0.00 4.11 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 0.00 113 S 8.58 4.66 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 0.00 114 A 7.55 3.86 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 K 8.08 4.20 0.00 1.69 1.70 0.00 1.87 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.37 7.81 116 T 8.70 4.36 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 117 T 9.18 4.81 4.38 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 1.28 0.00 0.00 118 P 0.00 4.94 0.00 1.97 2.02 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 119 P 0.00 4.81 0.00 1.96 1.86 0.00 3.74 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.82 0.00 120 S 8.79 4.51 0.00 3.79 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 0.00 121 V 7.92 4.47 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.77 0.00 0.00 122 Y 8.84 5.18 0.00 2.93 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 0.00 123 P 0.00 4.95 0.00 2.17 2.26 0.00 3.93 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.08 0.00 124 L 9.54 4.74 0.00 1.86 1.71 1.11 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 125 A 8.29 4.96 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 0.00 126 P 0.00 4.24 0.00 2.06 2.02 0.00 3.69 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 2.03 2.24 0.00 127 G 8.41 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 0.00 128 S 8.79 4.15 0.00 3.87 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 0.00 129 A 7.85 4.46 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 0.00 130 A 7.92 4.27 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 0.00 131 Q 7.72 4.26 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.68 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 132 T 7.77 4.43 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 133 N 8.40 5.06 0.00 2.75 2.41 0.00 0.00 7.01 7.57 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 0.00 134 S 8.85 4.32 0.00 3.89 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 0.00 135 M 7.97 5.16 0.00 1.86 1.97 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 136 V 9.08 4.54 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 0.75 0.00 0.00 0.93 0.00 0.00 137 T 8.50 4.98 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 138 L 8.42 4.96 0.00 1.30 1.49 0.90 0.54 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 0.00 139 G 7.98 4.51 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 0.00 0.00 0.00 140 C 9.40 5.72 0.00 2.77 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 0.00 141 L 9.26 5.08 0.00 1.86 1.76 1.08 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 142 V 9.33 4.72 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 0.90 0.00 0.00 143 K 9.02 4.68 0.00 2.00 1.80 0.00 1.98 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.50 7.81 144 G 8.04 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 0.00 145 Y 7.34 5.18 0.00 2.91 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 0.00 146 F 9.39 4.90 0.00 3.10 3.17 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 0.00 147 P 0.00 3.81 0.00 1.75 1.24 0.00 3.88 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 1.84 1.92 0.00 148 E 8.39 4.11 0.00 1.73 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 1.47 1.58 0.00 149 P 0.00 5.02 0.00 2.08 2.00 0.00 3.69 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.87 0.00 150 V 7.84 4.57 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.15 0.00 0.00 151 T 8.75 4.64 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 1.16 0.00 0.00 152 V 8.25 4.89 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 0.58 0.00 0.00 0.83 0.00 0.00 153 T 8.64 4.84 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 154 W 8.34 5.07 0.00 3.43 3.08 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 0.00 155 N 9.88 4.27 0.00 3.03 2.92 0.00 0.00 6.69 7.42 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 0.00 156 S 9.49 3.73 0.00 4.00 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 0.00 157 G 8.08 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 S 8.32 4.13 0.00 3.92 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 0.00 159 L 7.87 4.31 0.00 1.90 1.72 0.93 0.79 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 0.00 160 S 8.45 4.64 0.00 3.93 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 0.00 161 S 8.02 4.38 0.00 3.83 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 0.00 162 G 8.49 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 V 7.66 4.71 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 1.06 0.00 0.00 0.94 0.00 0.00 164 H 9.13 4.55 0.00 3.00 2.31 0.00 5.83 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 T 8.26 4.87 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 166 F 8.77 4.47 0.00 3.01 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 P 0.00 4.37 0.00 2.13 2.05 0.00 3.86 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 2.10 2.14 0.00 168 A 8.43 4.63 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 0.00 169 V 8.92 4.42 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 0.97 0.00 0.00 1.00 0.00 0.00 170 L 8.69 4.27 0.00 1.19 1.49 0.31 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 171 Q 8.58 4.34 0.00 2.07 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.34 6.06 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 172 S 8.61 3.63 0.00 3.95 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 0.00 173 D 7.83 4.16 0.00 2.28 2.62 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 0.00 174 L 7.12 4.58 0.00 1.77 1.51 0.93 0.85 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 0.00 175 Y 8.75 4.80 0.00 1.60 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 T 8.54 5.34 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 177 L 9.41 5.26 0.00 1.87 1.71 1.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 178 S 8.77 5.39 0.00 4.01 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 0.00 179 S 9.58 5.54 0.00 4.04 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 0.00 180 S 9.54 5.47 0.00 3.94 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 0.00 181 V 7.98 5.00 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 0.00 0.00 0.35 0.00 0.00 -0.88 0.00 0.00 182 T 8.32 4.98 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 1.21 0.00 0.00 183 V 8.59 4.53 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 0.68 0.00 0.00 0.88 0.00 0.00 184 P 0.00 4.70 0.00 2.02 1.97 0.00 3.67 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.09 0.00 185 S 9.50 4.28 0.00 3.82 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 0.00 186 S 8.23 4.13 0.00 3.97 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 0.00 187 P 0.00 4.48 0.00 2.32 2.12 0.00 3.99 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 2.09 2.02 0.00 188 R 7.78 4.85 0.00 1.72 1.74 0.00 3.43 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 189 P 0.00 4.73 0.00 2.23 2.13 0.00 3.85 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 190 S 8.28 4.25 0.00 4.03 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 E 8.09 4.65 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 192 T 8.19 4.34 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 0.00 193 V 8.30 4.91 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 1.24 0.00 0.00 0.94 0.00 0.00 194 T 9.80 5.38 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 195 C 8.77 4.48 0.00 1.51 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 0.00 196 N 8.70 5.34 0.00 2.48 2.73 0.00 0.00 6.22 7.40 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 0.00 197 V 8.91 4.70 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 0.64 0.00 0.00 0.70 0.00 0.00 198 A 8.66 5.02 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 H 8.91 4.77 0.00 3.02 3.11 0.00 5.82 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 P 0.00 4.10 0.00 2.14 2.06 0.00 3.74 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 201 A 7.83 4.10 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 0.00 202 S 7.57 4.57 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 S 8.36 3.79 0.00 3.99 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 0.00 204 T 7.31 4.36 4.38 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 1.17 0.00 0.00 205 K 8.25 5.01 0.00 1.55 1.63 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.29 1.39 7.81 206 V 9.22 4.49 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 0.77 0.00 0.00 0.85 0.00 0.00 207 D 8.69 5.26 0.00 2.52 2.57 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 0.00 208 K 8.93 4.40 0.00 1.72 1.54 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.31 1.42 7.81 209 K 8.73 4.55 0.00 1.84 1.73 0.00 1.84 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.52 7.81 210 I 8.74 4.42 1.98 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.29 1.02 0.00 0.00 211 V 8.18 4.44 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 0.77 0.00 0.00 0.97 0.00 0.00 212 P 0.00 4.38 0.00 2.05 2.00 0.00 3.70 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 2.04 2.12 0.00 213 R 8.46 3.96 0.00 1.81 1.89 0.00 3.49 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 *214 D 8.86 4.92 0.00 2.76 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 * Residues marked with a * may have inaccurate shift predictions.