NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 S 4.3942 8.3344 115.4141 58.1869 63.9419 173.0162 22 I 3.8821 7.5057 122.1024 61.1119 38.9388 174.1493 23 T 4.5293 8.8800 124.5081 60.8044 69.8932 172.5607 24 E 4.7790 8.5135 126.8811 55.3414 31.6413 175.4207 25 N 4.6380 9.2677 124.3022 51.2716 39.9042 174.6384 26 T 4.2368 8.2967 115.7105 63.5864 69.6952 176.9351 27 S 4.1269 8.2034 116.2879 61.3103 62.1760 175.9705 28 W 4.7227 8.5015 120.7560 59.2550 28.3655 178.0831 29 N 4.5655 8.4211 117.1389 56.0426 37.7984 177.1250 30 K 4.0128 8.1817 119.9243 59.8174 30.5919 179.0704 31 E 3.9600 8.2193 118.4895 59.1625 29.1806 179.4585 32 F 4.2952 8.3566 117.5915 60.4235 39.2796 177.8576 33 S 4.1813 8.6634 114.9383 61.6174 62.4230 176.4816 34 A 4.0194 8.2292 123.8038 54.6712 18.1567 177.8807 35 E 4.3641 7.4774 110.7166 55.2561 30.3674 175.5280 36 A 3.7392 7.7135 120.8072 53.4172 16.5517 177.4717 37 V 4.4362 8.1519 120.0021 62.1191 34.0114 174.7246 38 N 4.7673 8.5156 126.3786 52.9683 40.4078 173.6590 39 G 4.4917 7.9225 112.9440 46.2892 0.0000 171.8060 40 V 4.7775 7.8798 118.0425 60.1106 35.5880 174.1594 41 F 5.7069 9.9164 124.0111 56.8167 43.0630 173.2501 42 V 4.9840 8.7562 126.1653 60.9765 34.2881 173.8251 43 L 5.2251 9.0183 129.2411 53.4893 45.3079 174.3069 44 C 5.7326 9.6960 123.3081 55.1057 44.1951 172.6449 45 K 4.4824 8.6420 124.2622 55.9773 32.8203 175.8448 46 S 4.1057 9.4633 128.3648 59.0348 62.8320 170.5258 47 S 4.8917 7.2642 111.7070 57.2093 65.4431 174.2763 48 S 4.4786 8.8793 113.5266 59.1798 62.6677 175.0869 49 K 4.2950 7.9970 120.3985 57.6932 32.8642 177.1137 50 S 4.8331 7.7994 115.3358 56.5652 62.5748 172.2572 51 C 5.6896 8.1935 119.4611 55.0904 45.5731 172.9366 52 A 5.8520 8.8609 120.8688 50.4501 22.7646 174.9348 53 T 6.0832 8.3744 111.8115 62.1206 70.6090 173.6863 54 N 4.6242 9.2652 122.1497 53.5300 38.6308 175.5739 55 N 4.8386 8.2677 118.1929 50.8347 40.2365 173.6085 56 L 3.9654 8.5278 124.9141 57.8168 42.6159 178.0309 57 A 4.0887 7.8774 120.0963 55.2387 18.5966 179.5042 58 R 3.9629 8.1051 115.9531 59.0218 30.3069 178.2873 59 A 4.1404 8.2003 120.8332 54.4245 18.1010 178.5913 60 S 4.6860 7.6408 110.2307 58.1323 63.9000 174.2013 61 K 4.1231 7.8145 123.8338 56.2019 33.1689 175.3577 62 E 4.7552 8.4030 126.3594 55.6486 30.7920 175.0978 63 Y 4.9890 9.2338 121.3202 55.4701 42.7101 174.6347 64 L 4.9764 9.2884 123.1778 54.7265 42.2613 175.6709 65 P 4.2740 0.0000 0.0000 63.5131 32.9574 177.1304 66 A 3.8446 8.1183 122.6670 53.1805 17.6821 179.3463 67 S 4.3340 8.8429 109.3242 62.2373 63.3978 176.2417 68 T 3.9851 7.8824 111.2307 63.8214 68.4389 175.7604 69 F 4.0840 8.3408 123.4625 59.8659 39.3431 176.7029 70 K 3.3306 7.6408 117.8238 59.3388 31.6130 178.8508 71 I 3.7061 7.3498 120.8913 63.7046 37.0435 176.5259 72 P 4.3734 0.0000 0.0000 65.8203 31.0496 178.3506 73 S 3.7214 7.1042 112.7984 61.0018 62.2417 175.9787 74 A 4.0680 8.0721 123.5035 55.1455 18.0362 179.7001 75 I 3.6411 7.5798 117.8048 64.6829 37.1465 178.7965 76 I 3.3116 8.0700 121.0655 64.0145 36.7384 178.6885 77 G 3.5655 8.4165 107.0666 47.7577 0.0000 175.8218 78 L 4.2396 7.8788 122.6924 57.0015 41.4920 179.0887 79 E 3.9518 8.1787 118.6467 59.2413 29.6571 178.2706 80 T 4.2583 7.9162 107.5071 62.2289 69.4469 175.7114 81 G 3.9578 7.8645 110.3694 45.1351 0.0000 174.6715 82 V 3.5911 7.0684 118.7960 65.2262 31.3055 175.9005 83 I 4.2804 7.8290 122.0228 59.1526 37.9123 175.8970 84 K 3.7790 8.6871 128.2500 58.3140 32.2544 175.8159 85 N 4.3279 7.4501 112.5687 52.4822 39.6813 174.0337 86 E 3.8787 8.9953 115.3837 59.9297 29.2962 177.3153 87 H 4.6786 8.4001 114.5999 55.4406 28.9205 174.8995 88 Q 3.8297 7.9313 122.3955 56.6135 29.0716 175.8932 89 V 4.4559 7.9785 125.7175 61.2573 33.9649 174.5847 90 F 4.9207 9.2094 125.0989 55.5012 42.1549 174.7383 91 K 4.7262 8.8272 123.5322 55.6076 32.8827 176.8992 92 W 4.2048 9.0552 134.0792 60.4432 30.9848 175.7253 *105 D 4.8468 7.6753 115.3050 54.2201 41.7040 175.0429 106 L 5.0136 9.0355 120.9993 52.9719 45.9784 176.7869 107 S 4.7685 8.4826 116.7772 57.4556 65.3510 174.7604 108 L 4.0720 8.7562 120.2077 58.5061 41.8991 178.6699 109 R 4.0477 8.1012 118.3563 59.2384 29.9949 178.5882 110 G 3.5429 8.1643 105.5226 47.7562 0.0000 175.6800 111 A 3.8502 8.0715 122.5564 54.6713 18.3479 179.5266 112 I 3.6981 7.6002 117.9582 64.5129 37.2351 178.2949 113 Q 4.1643 7.8523 117.8791 57.6095 28.8195 176.9424 114 V 4.2467 6.9603 112.1962 59.4566 33.5004 176.2774 115 S 4.1943 9.1051 114.8990 61.8722 62.8332 176.2325 116 A 3.5807 8.3495 122.7680 51.3822 16.4614 178.6660 117 V 3.7353 8.3551 120.9472 67.4642 31.6195 174.8512 118 P 4.3916 0.0000 0.0000 65.5360 31.1677 178.6487 119 V 3.5114 7.7994 116.8707 66.2524 31.5165 178.1055 120 F 3.8940 8.2323 116.0562 59.5645 38.9304 177.7997 121 Q 4.4433 8.2488 118.2000 59.0337 28.5378 178.1839 122 Q 4.0493 8.3048 120.6514 59.1322 29.1028 178.2051 123 I 3.6329 7.8718 120.6766 64.3196 37.0408 178.1922 124 A 4.1214 8.0902 121.5303 55.1906 18.0456 179.6096 125 R 3.9284 7.9951 115.9181 59.7782 30.2884 178.2254 126 E 4.1379 8.1651 117.0520 59.3099 29.4992 179.2999 127 V 3.7425 7.6978 117.3996 64.9838 32.2082 177.5335 128 G 4.1458 8.0746 103.1483 45.7150 0.0000 173.8718 129 E 3.9169 8.8476 119.1718 59.4479 29.4677 179.8850 130 V 3.5606 7.7591 117.2575 66.3473 31.6419 178.2045 131 R 3.9808 7.9547 117.1687 59.2221 29.9958 178.4996 132 M 4.0892 8.2633 118.1362 58.7201 32.3361 177.9278 133 Q 3.8686 8.2966 119.9664 59.0977 29.1911 178.1193 134 K 3.7136 7.9062 120.4802 59.9359 32.1460 178.3419 135 Y 3.5535 7.8171 116.7579 60.7673 37.6657 178.2716 136 L 4.2361 7.9510 119.8718 57.1792 41.6987 179.5775 137 K 4.7519 7.8209 121.2329 59.0761 31.9929 179.0167 138 K 4.0267 7.6627 117.4147 59.5155 32.1053 178.8159 139 F 4.8252 8.8130 115.7758 57.6369 39.5737 175.3731 140 S 3.6942 7.9380 113.8932 59.5986 60.9903 173.3464 141 Y 4.0797 8.4810 122.5798 56.9273 38.4654 175.1540 142 G 3.6790 8.0135 120.7422 46.6757 0.0000 172.5940 143 N 4.5208 9.1011 120.3082 52.9155 37.8940 175.4082 144 Q 3.4159 8.0311 116.9975 56.9350 27.2817 172.6380 145 N 4.8658 8.3758 117.7513 52.4083 38.3730 174.3663 146 I 3.9419 7.8504 118.5369 60.3072 38.0582 176.1109 147 S 4.1260 7.6423 115.8186 59.8292 62.6667 174.2678 148 G 3.8936 9.3599 112.1112 44.5111 0.0000 172.9052 149 G 3.8411 8.8602 108.8141 44.0324 0.0000 174.6858 150 I 4.0033 8.7827 126.7094 63.8050 38.0331 175.8756 151 D 5.2125 8.0466 117.2890 52.6372 39.5288 177.2663 152 K 3.2745 7.9482 114.8167 57.6050 35.4709 177.2920 153 F 4.0933 7.8601 116.9274 59.4620 38.0921 176.5959 154 W 4.4282 6.7403 116.5697 56.8210 28.6661 177.3527 155 L 4.3394 6.6259 118.1788 55.7568 42.7946 177.4503 156 E 4.6055 8.2269 114.6279 56.1959 30.5232 175.2089 157 G 4.3375 7.4646 110.8872 45.3968 0.0000 174.0461 158 Q 4.3170 8.3755 118.8608 56.1124 29.3230 175.9198 159 L 4.5495 7.6947 121.8378 54.9044 43.4005 175.8018 160 R 5.1356 8.8243 123.2824 55.0010 34.9951 173.6644 161 I 4.9096 9.3008 121.9923 59.7831 42.0717 174.1142 162 S 5.5953 8.8835 121.5852 56.3710 65.4327 174.9101 163 A 4.4616 8.9103 121.9705 55.4675 18.1636 180.1385 164 V 3.6068 7.8654 116.4536 66.1495 31.5624 177.8615 165 N 4.6699 8.2235 118.2780 56.0708 38.6731 176.8843 166 Q 3.9453 8.3611 119.7951 59.0207 28.8254 179.0439 167 V 3.5580 7.8208 119.1240 66.0498 31.3757 177.9572 168 E 3.7993 8.1184 118.2900 59.1076 29.2498 179.1915 169 F 4.1184 8.3732 120.8655 61.3251 39.4614 177.3773 170 L 3.5270 8.1668 118.9160 57.3463 41.2900 179.1874 171 E 2.9912 7.6406 119.4505 58.9282 29.4537 179.0144 172 S 3.9003 7.4760 114.9156 61.2411 62.8075 176.3912 173 L 3.4777 7.1592 122.9005 57.9499 41.5345 178.6264 174 F 3.7706 7.4953 119.3637 61.1166 39.3437 176.2990 175 L 3.9521 7.6340 114.8840 53.9671 41.7000 176.4338 176 N 4.0686 7.5770 115.2716 54.4091 36.3657 174.9629 177 K 4.2922 8.1547 115.9730 56.2913 32.6403 177.3659 178 L 4.2201 7.2639 118.9837 54.5857 42.3445 177.8418 179 S 4.5431 8.6237 117.7415 56.6065 61.1680 173.2338 180 A 4.8039 7.4116 124.0299 49.5755 22.3216 177.3152 181 S 4.3200 8.7809 115.4190 58.2447 64.9202 175.6888 182 K 3.8915 8.5464 124.1328 59.4012 32.0100 178.6534 183 E 3.8924 8.1617 119.3124 59.6417 29.6897 178.6171 184 N 4.3966 8.2389 116.2093 56.3100 38.5606 177.5769 185 Q 3.9684 8.0927 119.6728 58.7785 28.7620 178.6793 186 L 4.0202 8.3080 120.5367 57.6727 41.6328 179.4126 187 I 3.6987 7.8037 119.7985 64.6246 37.1880 178.7113 188 V 3.6747 7.7167 118.4457 65.7654 31.0962 178.1724 189 K 4.2978 7.9908 117.6258 59.6563 32.2487 178.6477 190 E 4.1543 8.5484 119.3499 59.0833 29.3381 178.6170 191 A 4.1251 7.9481 120.0672 54.4609 18.6579 178.5642 192 L 4.3371 7.6521 115.5566 53.9257 41.8938 176.7835 193 V 3.8185 7.1880 120.8915 63.1205 31.7277 175.5245 194 T 4.5661 8.9063 116.5057 61.3871 70.8409 173.8947 195 E 4.6031 7.8861 122.0610 54.2659 32.7669 173.2611 196 A 4.8202 8.5060 127.5210 50.2309 21.7645 174.9810 197 A 4.5273 8.2497 124.2116 49.3548 22.4749 175.1700 198 P 4.1583 0.0000 0.0000 65.3936 31.3011 177.6995 199 E 4.4531 7.8448 115.5568 56.9930 30.4751 174.5174 200 Y 5.0720 7.0237 116.4133 55.9245 42.1655 173.3264 201 L 5.0705 9.1746 121.6768 53.3776 45.5871 174.9258 202 V 4.4549 8.9734 126.8812 61.5728 33.7166 173.8223 203 H 5.0648 8.2470 125.3868 53.8953 30.7306 173.7502 204 S 4.8140 8.6110 116.7019 57.3948 66.6195 173.6214 205 K 4.7618 8.9022 121.8397 55.4750 35.5242 175.6033 206 T 5.2596 8.8709 117.8167 61.4369 70.9949 173.9233 207 G 4.5232 9.0694 107.1179 45.6807 0.0000 172.5224 208 F 5.8808 8.7477 124.8811 57.3692 41.5617 174.0500 209 S 4.1494 8.9253 122.5061 60.2430 63.8902 174.2653 210 G 3.3994 7.0194 106.3725 43.1017 0.0000 174.8266 211 V 3.7044 8.7066 122.6478 65.5415 32.4921 176.3633 212 G 3.9633 8.0696 107.7844 46.1910 0.0000 171.9415 213 T 4.7869 8.1418 111.5139 59.3574 72.2211 174.9637 214 E 4.0629 8.8278 119.8280 59.3520 29.4617 178.0444 215 S 4.4056 8.3542 112.0321 58.2978 63.9366 173.6894 216 N 4.6110 7.9765 116.9733 52.6302 41.1994 171.4601 217 P 4.7093 0.0000 0.0000 62.3921 33.0420 177.7883 218 G 4.6332 9.0132 109.5888 45.7840 0.0000 172.3341 219 V 5.0449 8.9584 118.6238 59.6459 34.6422 174.5122 220 A 5.6169 8.8808 125.3225 50.1401 21.8949 175.2849 221 W 5.8037 10.0899 121.7552 55.1270 33.8550 175.0976 222 W 5.6144 9.8263 131.9021 57.2464 33.1258 173.7607 223 V 4.8154 9.8521 120.4868 59.0760 35.8468 176.6424 224 G 3.5108 6.2802 107.4819 46.1778 0.0000 171.1770 225 W 5.4041 7.1657 115.4314 55.4946 32.1134 173.8078 226 V 4.6962 9.1955 121.6304 61.2840 33.9475 174.1339 227 E 4.8887 9.2895 128.3749 55.0945 30.9364 175.2596 228 K 4.8838 8.3965 127.6514 53.0985 34.4025 176.3877 229 G 3.9674 9.0272 120.2506 47.3188 0.0000 173.5953 230 T 4.3900 8.7017 114.8000 61.0425 69.3688 173.8286 231 E 4.5068 8.0180 124.1611 54.9905 31.5616 174.6250 232 V 4.8304 7.9664 121.3664 60.1086 35.2475 173.6876 233 Y 4.9883 8.6677 120.2856 56.2906 41.4961 174.3846 234 F 5.4395 9.0043 123.0130 55.9944 41.7620 174.8961 235 F 5.5578 9.0389 116.4880 55.6401 41.9087 173.3056 236 A 5.2586 9.0401 121.6017 50.9144 22.8158 174.9999 237 F 5.7734 10.1264 124.9221 56.6735 43.2612 173.2774 238 N 5.8632 8.4030 121.3378 51.4224 40.9693 172.9481 239 M 4.8800 7.7585 115.5883 53.9978 34.7624 173.4053 240 D 4.9439 8.5679 121.1781 54.4712 41.8296 175.9207 241 I 4.7225 8.4699 122.7496 59.4526 40.7915 174.3354 242 D 5.1670 8.9793 126.6866 52.8967 40.4829 175.1772 243 N 4.9282 7.7528 118.6340 52.4361 42.0403 174.8112 244 E 3.9660 9.0181 125.3061 58.7498 29.7373 178.0247 245 N 4.5637 8.0503 114.4846 53.8871 37.8464 176.0453 246 K 4.2932 7.9464 118.5764 56.4773 32.6364 177.6233 247 L 3.7153 7.4515 122.3805 57.6311 41.9501 176.9844 248 P 4.1786 0.0000 0.0000 65.2553 31.2029 178.2192 249 L 4.3894 7.7085 120.4606 56.8284 41.1989 178.9870 250 R 3.7142 7.5305 118.2896 58.5683 30.1378 177.7389 251 K 3.1313 7.1818 117.1164 57.4699 33.0097 178.5561 252 S 3.7710 7.3898 114.3829 61.4425 62.7613 176.5465 253 I 3.2734 7.1037 123.7458 63.3683 36.7243 176.7789 254 P 3.0833 0.0000 0.0000 65.2561 31.0153 178.8624 255 T 3.6754 7.5561 114.7395 66.3003 68.3018 176.8352 256 K 3.7702 7.9017 120.6158 59.4798 31.9708 179.4288 257 I 3.4418 7.1106 119.8939 64.6392 36.9302 178.4771 258 M 3.9366 7.9330 119.1514 57.7148 31.6975 178.7217 259 A 3.9947 8.0036 122.0967 54.9301 18.2854 179.7890 260 S 4.0977 7.8312 112.0214 61.5171 63.2183 175.9338 261 E 4.2978 7.7892 118.8306 55.9860 29.1339 177.2060 262 G 3.8927 7.5828 106.9365 46.5938 0.0000 175.4466 263 I 3.6724 7.6822 122.5055 62.8818 37.3445 177.3125 264 I 3.3413 6.9522 110.3936 58.7666 38.9825 175.9572 265 G 4.0680 8.3387 107.1520 45.8702 0.0000 173.1971 266 G 3.7592 7.5582 113.3694 45.5834 0.0000 174.0635 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 21 S 8.33 4.39 0.00 4.00 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 22 I 7.51 3.88 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.02 0.93 0.00 0.00 23 T 8.88 4.53 4.22 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 1.27 0.00 0.00 24 E 8.51 4.78 0.00 1.99 1.76 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 2.18 2.47 0.00 25 N 9.27 4.64 0.00 1.82 1.51 0.00 0.00 7.08 5.68 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 26 T 8.30 4.24 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 27 S 8.20 4.13 0.00 3.87 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 28 W 8.50 4.72 0.00 3.76 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.42 4.57 0.00 3.10 2.94 0.00 0.00 6.82 6.88 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 30 K 8.18 4.01 0.00 1.99 1.94 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.70 7.81 31 E 8.22 3.96 0.00 2.06 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 32 F 8.36 4.30 0.00 3.32 3.41 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 0.00 33 S 8.66 4.18 0.00 4.06 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 34 A 8.23 4.02 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 35 E 7.48 4.36 0.00 1.92 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 36 A 7.71 3.74 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 37 V 8.15 4.44 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 0.94 0.00 0.00 1.01 0.00 0.00 38 N 8.52 4.77 0.00 2.90 2.69 0.00 0.00 6.94 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 39 G 7.92 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 V 7.88 4.78 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 0.66 0.00 0.00 1.01 0.00 0.00 41 F 9.92 5.71 0.00 3.66 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.76 4.98 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 0.95 0.00 0.00 1.03 0.00 0.00 43 L 9.02 5.23 0.00 1.20 1.57 1.11 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 44 C 9.70 5.73 0.00 3.09 3.33 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 45 K 8.64 4.48 0.00 1.89 1.71 0.00 2.09 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.16 0.66 7.81 46 S 9.46 4.11 0.00 4.00 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 47 S 7.26 4.89 0.00 4.16 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 48 S 8.88 4.48 0.00 3.94 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 49 K 8.00 4.30 0.00 1.77 1.90 0.00 1.51 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.44 7.81 50 S 7.80 4.83 0.00 3.94 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 51 C 8.19 5.69 0.00 2.90 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 52 A 8.86 5.85 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.37 6.08 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 54 N 9.27 4.62 0.00 2.80 3.31 0.00 0.00 6.11 8.04 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 55 N 8.27 4.84 0.00 2.57 2.59 0.00 0.00 6.66 7.88 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 56 L 8.53 3.97 0.00 1.80 1.71 0.97 1.02 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 57 A 7.88 4.09 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 58 R 8.11 3.96 0.00 1.98 1.97 0.00 3.21 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.88 0.00 59 A 8.20 4.14 1.48 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 60 S 7.64 4.69 0.00 3.90 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 61 K 7.81 4.12 0.00 1.81 1.72 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.71 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.65 1.17 7.81 62 E 8.40 4.76 0.00 1.82 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 63 Y 9.23 4.99 0.00 2.97 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 9.29 4.98 0.00 1.79 1.82 1.04 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 65 P 0.00 4.27 0.00 2.44 2.41 0.00 4.18 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 66 A 8.12 3.84 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 S 8.84 4.33 0.00 4.17 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 68 T 7.88 3.99 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 1.06 0.00 0.00 69 F 8.34 4.08 0.00 3.15 2.68 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 70 K 7.64 3.33 0.00 1.54 1.06 0.00 1.33 0.00 0.00 0.77 0.00 0.00 2.46 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.30 0.97 7.81 71 I 7.35 3.71 1.96 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.00 1.09 0.00 0.00 72 P 0.00 4.37 0.00 1.71 1.78 0.00 3.35 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.44 0.00 73 S 7.10 3.72 0.00 3.22 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 74 A 8.07 4.07 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.58 3.64 2.10 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.82 0.94 0.00 0.00 76 I 8.07 3.31 1.81 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.76 0.58 0.00 0.00 77 G 8.42 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 7.88 4.24 0.00 1.86 1.88 0.93 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 79 E 8.18 3.95 0.00 1.99 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 2.46 2.49 0.00 80 T 7.92 4.26 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 1.21 0.00 0.00 81 G 7.86 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 82 V 7.07 3.59 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 0.87 0.00 0.00 0.93 0.00 0.00 83 I 7.83 4.28 1.89 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 1.39 1.08 1.03 0.00 0.00 84 K 8.69 3.78 0.00 1.68 1.86 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.42 7.81 85 N 7.45 4.33 0.00 2.89 2.87 0.00 0.00 5.91 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 86 E 9.00 3.88 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.80 0.00 87 H 8.40 4.68 0.00 3.25 3.32 0.00 5.67 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 7.93 3.83 0.00 1.93 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.66 0.00 0.00 0.00 0.00 0.00 1.70 1.16 0.00 89 V 7.98 4.46 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 0.95 0.00 0.00 0.95 0.00 0.00 90 F 9.21 4.92 0.00 2.87 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 91 K 8.83 4.73 0.00 1.84 1.85 0.00 1.80 0.00 0.00 1.68 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.65 1.46 7.81 92 W 9.06 4.20 0.00 3.48 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 *105 D 7.68 4.85 0.00 2.67 2.68 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 0.00 106 L 9.04 5.01 0.00 1.48 1.44 -0.01 0.71 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 0.00 107 S 8.48 4.77 0.00 3.96 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 0.00 108 L 8.76 4.07 0.00 2.02 1.81 0.99 0.84 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 R 8.10 4.05 0.00 1.94 1.93 0.00 3.24 0.00 0.00 3.35 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.83 0.00 110 G 8.16 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.07 3.85 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 0.00 112 I 7.60 3.70 2.05 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 1.46 0.80 0.85 0.00 0.00 113 Q 7.85 4.16 0.00 2.06 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.41 2.67 0.00 114 V 6.96 4.25 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 0.73 0.00 0.00 0.54 0.00 0.00 115 S 9.11 4.19 0.00 4.13 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 0.00 116 A 8.35 3.58 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.36 3.74 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 1.15 0.00 0.00 1.06 0.00 0.00 118 P 0.00 4.39 0.00 2.54 2.24 0.00 3.94 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.31 0.00 119 V 7.80 3.51 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 0.26 0.00 0.00 0.76 0.00 0.00 120 F 8.23 3.89 0.00 3.27 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 0.00 121 Q 8.25 4.44 0.00 2.41 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.81 0.00 0.00 0.00 0.00 0.00 2.69 2.81 0.00 122 Q 8.30 4.05 0.00 2.36 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.74 0.00 123 I 7.87 3.63 1.72 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.43 0.79 0.00 0.00 124 A 8.09 4.12 1.75 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 0.00 0.00 125 R 8.00 3.93 0.00 2.12 2.18 0.00 3.33 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 126 E 8.17 4.14 0.00 2.16 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 127 V 7.70 3.74 2.32 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 0.87 0.00 0.00 1.00 0.00 0.00 128 G 8.07 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.85 3.92 0.00 2.00 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 2.44 2.34 0.00 130 V 7.76 3.56 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 1.05 0.00 0.00 0.93 0.00 0.00 131 R 7.95 3.98 0.00 2.15 2.16 0.00 3.30 0.00 0.00 3.32 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.73 0.00 132 M 8.26 4.09 0.00 2.24 2.28 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.78 0.00 133 Q 8.30 3.87 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.54 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 134 K 7.91 3.71 0.00 1.81 1.75 0.00 1.41 0.00 0.00 1.46 0.00 0.00 2.62 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 1.25 7.81 135 Y 7.82 3.55 0.00 2.80 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 L 7.95 4.24 0.00 1.74 1.86 1.08 0.83 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 0.00 137 K 7.82 4.75 0.00 1.82 1.92 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.33 7.81 138 K 7.66 4.03 0.00 1.85 1.98 0.00 1.38 0.00 0.00 1.64 0.00 0.00 2.68 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.41 1.50 7.81 139 F 8.81 4.83 0.00 3.11 3.34 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 0.00 140 S 7.94 3.69 0.00 4.16 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 0.00 141 Y 8.48 4.08 0.00 3.16 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.01 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 0.00 143 N 9.10 4.52 0.00 2.84 3.14 0.00 0.00 6.98 6.96 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 0.00 144 Q 8.03 3.42 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.82 0.00 0.00 0.00 0.00 0.00 2.57 2.58 0.00 145 N 8.38 4.87 0.00 2.77 2.82 0.00 0.00 6.93 7.75 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 0.00 146 I 7.85 3.94 0.56 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.48 0.33 0.00 0.00 147 S 7.64 4.13 0.00 3.86 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 9.36 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 0.00 149 G 8.86 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 0.00 150 I 8.78 4.00 1.99 0.00 0.00 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 1.61 1.03 1.02 0.00 0.00 151 D 8.05 5.21 0.00 3.05 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 0.00 152 K 7.95 3.27 0.00 1.54 1.69 0.00 1.38 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.21 1.28 7.81 153 F 7.86 4.09 0.00 3.26 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 0.00 154 W 6.74 4.43 0.00 3.26 2.32 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 0.00 155 L 6.63 4.34 0.00 1.08 1.46 0.65 0.87 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 0.00 156 E 8.23 4.61 0.00 1.93 1.83 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 2.15 2.15 0.00 157 G 7.46 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 Q 8.38 4.32 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.08 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 159 L 7.69 4.55 0.00 2.14 1.84 1.19 1.20 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 0.00 160 R 8.82 5.14 0.00 1.75 1.68 0.00 3.37 0.00 0.00 3.44 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.59 0.00 161 I 9.30 4.91 1.61 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.14 0.84 0.00 0.00 162 S 8.88 5.60 0.00 4.22 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 0.00 163 A 8.91 4.46 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 0.00 164 V 7.87 3.61 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 1.05 0.00 0.00 165 N 8.22 4.67 0.00 2.80 2.83 0.00 0.00 6.84 7.48 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 0.00 166 Q 8.36 3.95 0.00 2.38 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 167 V 7.82 3.56 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.01 0.00 0.00 168 E 8.12 3.80 0.00 2.20 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 2.27 2.57 0.00 169 F 8.37 4.12 0.00 3.11 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 0.00 170 L 8.17 3.53 0.00 1.60 1.58 1.02 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 171 E 7.64 2.99 0.00 1.16 1.63 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 2.01 1.87 0.00 172 S 7.48 3.90 0.00 3.76 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 0.00 173 L 7.16 3.48 0.00 0.97 1.19 0.71 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 174 F 7.50 3.77 0.00 2.41 3.09 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 0.00 175 L 7.63 3.95 0.00 1.53 1.56 0.89 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 176 N 7.58 4.07 0.00 2.74 2.80 0.00 0.00 6.88 7.19 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 0.00 177 K 8.15 4.29 0.00 1.67 1.76 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.45 7.81 178 L 7.26 4.22 0.00 1.41 1.27 0.06 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 179 S 8.62 4.54 0.00 4.10 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 0.00 180 A 7.41 4.80 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 0.00 181 S 8.78 4.32 0.00 4.08 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 0.00 182 K 8.55 3.89 0.00 1.80 1.81 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.58 7.81 183 E 8.16 3.89 0.00 2.06 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 2.37 2.40 0.00 184 N 8.24 4.40 0.00 2.90 2.84 0.00 0.00 7.12 6.60 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 0.00 185 Q 8.09 3.97 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.22 2.44 0.00 186 L 8.31 4.02 0.00 1.82 1.72 0.90 0.68 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 0.00 187 I 7.80 3.70 2.04 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 1.39 0.74 0.92 0.00 0.00 188 V 7.72 3.67 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 1.07 0.00 0.00 0.96 0.00 0.00 189 K 7.99 4.30 0.00 2.06 2.14 0.00 1.90 0.00 0.00 1.54 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.74 1.69 7.81 190 E 8.55 4.15 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 191 A 7.95 4.13 1.41 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 0.00 0.00 0.00 192 L 7.65 4.34 0.00 1.87 1.58 1.13 0.73 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 0.00 193 V 7.19 3.82 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 0.67 0.00 0.00 0.82 0.00 0.00 194 T 8.91 4.57 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 195 E 7.89 4.60 0.00 2.04 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 2.33 0.00 196 A 8.51 4.82 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 A 8.25 4.53 0.23 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 0.00 198 P 0.00 4.16 0.00 2.00 2.10 0.00 3.52 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.05 0.00 199 E 7.84 4.45 0.00 2.12 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 0.00 2.35 2.28 0.00 200 Y 7.02 5.07 0.00 3.11 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 0.00 201 L 9.17 5.07 0.00 1.78 1.52 0.87 1.13 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 0.00 202 V 8.97 4.45 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 0.73 0.00 0.00 1.11 0.00 0.00 203 H 8.25 5.06 0.00 1.40 1.86 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 S 8.61 4.81 0.00 3.35 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 0.00 205 K 8.90 4.76 0.00 1.84 1.65 0.00 1.52 0.00 0.00 1.64 0.00 0.00 3.11 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.30 1.47 7.81 206 T 8.87 5.26 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 1.41 0.00 0.00 207 G 9.07 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 F 8.75 5.88 0.00 2.98 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 0.00 209 S 8.93 4.15 0.00 3.90 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 0.00 210 G 7.02 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 V 8.71 3.70 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 1.07 0.00 0.00 1.11 0.00 0.00 212 G 8.07 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 0.00 213 T 8.14 4.79 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 1.22 0.00 0.00 214 E 8.83 4.06 0.00 2.09 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 0.00 2.29 2.38 0.00 215 S 8.35 4.41 0.00 3.98 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 0.00 216 N 7.98 4.61 0.00 2.75 2.70 0.00 0.00 6.91 7.41 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 0.00 217 P 0.00 4.71 0.00 2.14 2.07 0.00 3.86 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 218 G 9.01 4.63 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 0.00 0.00 0.00 219 V 8.96 5.04 1.86 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 0.85 0.00 0.00 0.14 0.00 0.00 220 A 8.88 5.62 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 0.00 221 W 10.09 5.80 0.00 3.30 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 0.00 222 W 9.83 5.61 0.00 3.56 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 0.00 223 V 9.85 4.82 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 0.91 0.00 0.00 0.90 0.00 0.00 224 G 6.28 3.51 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 0.00 225 W 7.17 5.40 0.00 3.04 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 V 9.20 4.70 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 0.90 0.00 0.00 0.94 0.00 0.00 227 E 9.29 4.89 0.00 2.10 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 2.57 2.51 0.00 228 K 8.40 4.88 0.00 1.91 1.87 0.00 1.84 0.00 0.00 1.79 0.00 0.00 2.92 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.44 1.51 7.81 229 G 9.03 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 0.00 230 T 8.70 4.39 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 1.24 0.00 0.00 231 E 8.02 4.51 0.00 2.06 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.55 0.00 232 V 7.97 4.83 1.57 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 0.28 0.00 0.00 -0.31 0.00 0.00 233 Y 8.67 4.99 0.00 2.87 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 0.00 234 F 9.00 5.44 0.00 2.98 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 F 9.04 5.56 0.00 2.97 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 0.00 236 A 9.04 5.26 1.48 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 0.00 237 F 10.13 5.77 0.00 3.83 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 N 8.40 5.86 0.00 1.66 1.42 0.00 0.00 6.39 7.58 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 0.00 239 M 7.76 4.88 0.00 1.89 2.16 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.71 0.00 240 D 8.57 4.94 0.00 2.58 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 0.00 241 I 8.47 4.72 1.87 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.91 1.22 0.00 0.00 242 D 8.98 5.17 0.00 2.81 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 0.00 243 N 7.75 4.93 0.00 2.74 2.65 0.00 0.00 7.15 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 0.00 244 E 9.02 3.97 0.00 2.09 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 2.61 2.45 0.00 245 N 8.05 4.56 0.00 2.77 2.91 0.00 0.00 6.00 7.13 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 0.00 246 K 7.95 4.29 0.00 1.82 1.82 0.00 1.66 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.35 1.55 7.81 247 L 7.45 3.72 0.00 1.82 1.50 -0.01 0.61 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 0.00 248 P 0.00 4.18 0.00 2.15 2.16 0.00 3.59 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 1.95 1.95 0.00 249 L 7.71 4.39 0.00 1.73 1.62 0.87 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 250 R 7.53 3.71 0.00 1.86 2.04 0.00 3.84 0.00 0.00 3.31 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.00 0.00 251 K 7.18 3.13 0.00 1.21 0.83 0.00 1.31 0.00 0.00 1.28 0.00 0.00 2.77 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.30 0.69 7.81 252 S 7.39 3.77 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 0.00 253 I 7.10 3.27 1.26 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.37 0.21 0.00 0.00 254 P 0.00 3.08 0.00 2.14 1.74 0.00 3.03 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.88 0.00 255 T 7.56 3.68 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 1.06 0.00 0.00 256 K 7.90 3.77 0.00 1.69 1.68 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.53 7.81 257 I 7.11 3.44 1.11 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.16 -0.19 0.00 0.00 258 M 7.93 3.94 0.00 1.77 1.84 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 2.59 2.47 0.00 259 A 8.00 3.99 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 0.00 260 S 7.83 4.10 0.00 4.07 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 0.00 261 E 7.79 4.30 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.53 0.00 262 G 7.58 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 0.00 263 I 7.68 3.67 1.56 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.11 0.33 0.00 0.00 264 I 6.95 3.34 1.52 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 1.05 1.12 0.24 0.00 0.00 265 G 8.34 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 0.00 266 G 7.56 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.