NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 I 4.0079 8.0244 121.4435 61.1581 38.4519 173.7169 5 N 4.6973 8.6247 120.6057 51.2741 39.5557 172.8041 6 T 4.6787 8.5322 117.7172 61.8721 70.8262 175.1360 7 N 4.4635 8.0793 122.8825 56.8034 39.2200 175.6976 8 H 4.6408 8.1165 112.8546 56.2418 29.2853 174.7281 9 L 4.6799 6.9974 118.7713 52.4413 43.8821 176.4146 10 D 4.3828 8.3517 119.9556 54.6577 42.7047 177.7309 11 K 3.9739 8.5721 125.9117 59.7474 32.0201 179.6545 12 Q 4.0110 8.0150 116.8480 59.0243 28.8610 178.3059 13 Q 4.0592 8.1362 118.7618 58.7716 28.6946 178.9579 14 V 3.5550 7.6749 119.4718 66.0255 31.4554 178.0486 15 Q 4.0360 8.1300 117.8116 58.9590 28.5365 178.6219 16 L 4.1660 7.6332 119.0915 56.5586 41.8035 178.7428 17 L 4.1842 7.9404 118.8321 56.4383 41.3475 178.0143 18 A 4.3907 7.5137 119.6948 54.0144 19.6276 180.1108 19 E 4.2300 8.2833 118.9161 55.8042 29.2622 175.9751 *21 C 4.5669 8.3996 122.0543 60.6958 30.6406 172.8607 22 I 4.3649 7.9929 121.0003 60.5366 38.2252 175.1315 23 L 4.9439 8.7498 128.5241 54.1275 42.7680 176.2168 24 I 5.1658 8.3928 116.8157 59.0205 41.2490 174.9279 25 D 4.7262 8.6778 123.2316 52.1158 40.9632 176.9256 26 E 4.0644 8.6499 117.4933 58.5770 28.8465 177.6086 27 N 4.7667 8.8390 116.6474 52.6343 38.8118 174.7320 28 D 4.6238 8.0755 115.7258 55.2400 40.2918 173.0805 29 N 4.7408 7.6784 115.2972 51.1499 39.5985 174.8492 30 K 4.4439 8.5854 124.4457 56.5525 32.7796 176.3307 31 I 4.5130 8.8273 117.9930 59.8578 39.4949 175.4182 32 G 3.9271 7.1546 106.7933 45.8685 0.0000 171.0413 33 A 5.1838 8.4136 119.9230 50.5023 22.1546 175.8244 34 E 4.7961 8.7791 121.3910 54.4728 33.3576 175.0610 35 T 4.1488 8.6041 115.5804 61.7982 69.5296 174.5786 36 K 3.7678 9.0632 126.1458 59.8887 32.4143 178.5284 37 K 4.3506 7.9378 118.8789 60.0419 31.7193 178.5014 38 N 4.3815 8.1389 116.2032 56.4938 38.2165 177.2419 39 C 4.2216 8.2258 117.1688 61.9361 28.3345 174.1414 40 H 5.0824 7.9710 115.5189 54.6422 29.2502 173.6712 41 L 4.4015 7.5726 121.3676 53.7402 42.4045 177.1518 42 N 4.2928 8.8515 122.7527 56.5200 38.3508 177.1730 43 E 3.9304 8.0152 117.4174 59.6507 29.7458 178.5277 44 N 4.4960 7.8595 116.6005 55.7200 38.9026 177.1425 45 I 3.9225 7.9433 120.1712 63.9015 37.8354 177.3638 46 E 4.1113 8.4185 119.4085 58.0129 29.4867 177.6700 47 K 4.4320 7.6260 117.1415 56.2884 32.3976 177.3582 48 G 3.9885 7.9575 108.3882 44.7197 0.0000 174.1014 49 L 4.0390 7.5718 121.9821 55.0358 42.7621 175.6730 50 L 4.8963 8.3771 127.1213 53.6999 45.7448 174.3229 51 H 5.5088 8.5742 120.3123 53.5195 32.3400 172.5746 52 R 4.5889 8.5700 119.6546 56.3190 30.9209 175.1289 53 A 4.9852 8.5696 125.8604 50.8843 23.7087 174.7300 54 F 5.5929 8.5782 113.2101 54.4681 42.0326 173.8978 55 S 5.0696 9.5172 116.5225 56.9210 66.4559 173.0626 56 V 4.8285 9.0619 125.3576 61.4370 33.7707 174.5172 57 F 4.5129 9.7142 126.4573 55.7188 41.7501 173.8041 58 L 5.1160 9.1149 127.8906 53.3781 44.0522 174.9529 59 F 5.4453 9.1973 125.8578 55.8642 41.7556 176.2100 60 N 5.1954 9.1069 121.1107 52.0827 39.0024 175.4928 61 T 4.1800 8.5284 107.3143 63.7558 69.0644 175.0776 62 E 4.3021 8.3366 120.5737 56.1356 29.5105 175.8260 63 N 4.5263 7.9829 115.1253 54.3454 36.8849 173.8981 64 K 5.1839 8.4711 117.0885 55.2180 34.3867 175.9850 65 L 4.0052 9.0849 127.3391 54.4548 43.4625 175.3334 66 L 4.2871 8.8216 129.5380 54.6166 42.9547 175.3852 67 L 4.9266 9.0844 127.0794 52.9802 44.6931 175.5985 68 Q 5.0318 8.4976 119.1062 54.4156 32.4261 173.8426 69 Q 4.4546 8.8899 122.0593 53.8697 31.3947 175.0282 70 R 4.4630 8.5443 126.6782 56.0332 30.9931 176.7962 71 S 4.5306 8.5468 118.2855 58.4133 64.0121 175.0199 72 D 4.4718 8.6669 119.0480 56.1204 40.8193 177.8260 73 A 4.0893 7.4998 122.0358 54.2673 18.6806 178.4960 74 K 4.0039 7.3036 114.3540 56.7379 32.5882 177.4527 75 I 3.5510 8.1504 124.2381 63.3019 37.3759 176.4431 76 T 4.1506 7.4434 109.1298 60.9314 70.5339 174.2136 77 F 3.9159 8.4007 123.4421 57.8349 37.2318 173.9480 78 P 4.4045 0.0000 0.0000 64.0212 31.9752 177.1870 79 G 3.8517 8.4391 108.1425 45.7494 0.0000 173.2862 80 C 4.6596 7.3428 117.0549 58.8191 29.9892 173.3033 81 F 4.5559 9.3937 122.4604 57.9383 40.1678 174.4392 82 T 3.7151 7.9988 115.5021 60.6712 71.4876 171.8629 83 N 4.1466 7.9181 122.4652 52.6552 37.7492 175.0135 84 T 3.9005 7.8085 114.9744 65.2151 68.7869 174.4246 85 C 4.5644 7.3289 116.2599 58.7521 35.5987 172.0847 86 C 4.8693 8.3341 123.1429 58.4142 31.3323 174.0159 87 S 3.9153 6.0817 114.3081 58.5211 67.6966 173.4372 88 H 5.1652 8.4676 114.8385 52.9747 31.9893 171.4613 89 P 4.5632 0.0000 0.0000 62.8296 31.7736 176.1464 90 L 4.3307 9.1953 122.1432 54.2293 43.0572 177.5771 91 S 4.4671 8.3028 116.6196 57.7763 61.0771 172.9250 92 N 5.1609 7.3531 120.6489 49.7308 42.0272 173.3921 93 P 4.2524 0.0000 0.0000 65.7080 31.2637 178.2412 94 A 4.1003 8.0399 119.7937 54.5677 18.5699 178.3290 95 E 4.5283 8.5905 114.6577 56.4579 29.9683 177.4914 96 L 4.3963 7.8495 119.0112 54.4195 42.2803 176.4512 97 E 3.8860 7.7372 120.8278 56.8347 29.9390 176.6698 98 E 4.2891 8.6282 124.6419 56.5766 31.0588 175.8618 99 S 4.1727 8.0886 115.9664 59.8813 62.8573 174.0164 100 D 4.1642 9.3734 124.2928 54.9736 38.4202 173.3199 101 A 3.7449 7.9753 118.6525 52.8367 16.9915 180.4514 102 L 4.0468 7.9414 123.2781 59.6371 42.0594 178.4177 103 G 3.5748 8.1567 107.4588 47.1914 0.0000 176.1934 104 V 3.3791 7.3136 114.1821 64.1221 31.7702 178.7487 105 R 3.6941 7.5688 117.2864 59.1316 29.8163 179.3927 106 R 3.8465 8.0719 117.9439 58.8561 29.9268 178.8636 107 A 4.0994 7.7225 121.3660 54.3970 18.3680 179.4096 108 A 3.2373 7.1584 119.4604 55.0871 18.2507 179.5580 109 Q 3.8014 7.5904 117.4448 59.2630 29.1165 178.4354 110 R 3.8319 7.9033 119.5530 59.7529 30.0684 178.7856 111 R 4.0290 8.3243 117.8849 58.9839 30.0435 178.9307 112 L 3.7598 8.4236 119.5285 57.5276 41.5832 179.5287 113 K 4.2744 8.1393 120.5727 58.8166 31.9779 178.9120 114 A 3.9369 7.8244 119.8004 55.1642 18.5729 179.2808 115 E 4.0196 8.9175 117.8540 59.0585 29.7186 178.7189 116 L 4.4323 7.9221 116.6491 53.5305 42.4240 178.1081 117 G 4.2318 7.7200 106.0949 46.2249 0.0000 173.6716 118 I 3.9111 7.3875 121.2764 60.1438 37.3826 173.8965 119 P 4.4103 0.0000 0.0000 62.5934 31.5162 177.2516 120 L 3.9029 8.7951 122.5364 58.4396 41.2324 179.7918 121 E 4.0461 8.0444 116.7748 59.1224 29.5250 178.6606 122 E 4.2765 8.2512 118.4837 57.6692 30.6947 177.2701 123 V 4.3276 7.1202 117.3542 59.9925 31.5378 172.9452 124 P 4.5555 0.0000 0.0000 60.8851 32.6253 176.6152 125 P 4.1791 0.0000 0.0000 65.5846 31.3898 178.8807 126 E 3.9953 8.1075 116.6062 58.9980 29.4596 177.3954 127 E 4.2362 8.3403 116.4589 56.6188 29.8114 176.0934 128 I 4.1938 7.2978 121.2902 59.7064 38.1733 175.0833 129 N 4.7286 9.0786 125.0998 51.8685 39.4222 174.1296 130 Y 4.6639 8.5856 126.5102 57.9043 39.0093 174.6828 131 L 4.0727 9.3065 128.4266 56.2903 42.6569 177.5203 132 T 5.0596 7.0083 110.1041 62.2675 71.2036 171.1988 133 R 5.3146 8.7042 119.3896 54.4894 34.2008 174.9633 134 I 5.3130 8.8507 122.6536 59.9362 40.9235 173.8351 135 H 5.4541 9.7329 127.9738 55.4129 30.7967 173.7936 136 Y 5.1112 8.7097 122.6484 55.6853 41.8978 173.5464 137 K 5.1379 8.7413 120.6636 54.8620 35.4386 175.1334 138 A 4.9125 9.1130 127.2569 51.1110 23.1256 174.9507 139 Q 4.7061 8.8783 120.7441 55.2438 29.9414 176.0222 140 S 3.9798 8.9250 119.3655 60.2924 63.0454 173.2200 141 D 4.6667 7.5115 117.7708 52.3130 41.1697 174.7295 142 G 3.7079 8.9171 105.9598 48.7175 0.0000 174.3692 143 I 3.9864 8.0997 119.7072 62.1598 39.0937 176.0368 144 W 5.2070 8.9568 121.5590 55.4281 32.1298 176.0828 145 G 4.6383 8.5205 107.8790 46.9976 0.0000 171.6812 146 E 5.2302 9.5006 118.4043 55.0989 34.2300 175.6763 147 H 4.9124 8.5035 122.4480 55.6810 32.5149 171.8079 148 E 5.2893 8.4228 124.5550 54.1480 34.6447 174.7427 149 I 4.5329 8.1970 122.6802 60.0742 39.3851 174.0284 150 D 5.1444 9.3785 128.6840 52.7955 43.0627 174.9478 151 Y 4.2692 9.4728 125.3226 57.9677 39.1946 174.8118 152 I 4.8667 9.1582 127.0068 60.4696 38.8294 174.8737 153 L 5.3344 9.7183 127.9486 52.8401 44.8501 175.5196 154 L 5.3664 8.9738 123.5588 52.9475 44.7681 175.6555 155 V 4.7670 8.8744 122.5327 61.0978 35.0957 174.3181 156 R 5.5418 8.4268 125.0754 53.5152 32.7625 174.9119 *158 N 4.4724 8.7404 121.0013 53.2285 39.4481 174.3001 159 V 4.6672 8.2823 115.5944 59.6948 35.0548 175.0167 160 T 4.5063 8.9368 119.0751 62.1972 69.5962 174.6066 161 L 4.7715 8.3140 125.6665 53.1440 43.9341 176.7511 162 N 4.8550 8.5915 121.2023 51.7639 39.7098 171.8094 163 P 4.5465 0.0000 0.0000 61.3398 32.6727 175.7410 164 D 4.5354 8.8375 121.6101 52.8508 41.1531 175.7208 165 P 4.7973 0.0000 0.0000 64.8812 31.4760 177.1610 166 N 4.4238 8.3572 117.1865 55.6385 39.3532 175.2819 167 E 4.3545 8.3220 117.4003 57.0386 30.9559 176.0212 168 I 4.9115 7.2579 118.9606 59.2243 40.4007 175.7069 169 K 4.1009 9.2617 128.4602 59.3119 32.6289 176.6206 170 S 4.8193 7.6594 112.1813 57.9328 66.1696 172.6858 171 Y 5.3860 7.6852 117.4441 56.2665 41.0204 173.7332 172 C 4.7047 8.8787 112.5413 57.7228 33.3388 172.2813 173 Y 5.0707 8.8206 119.1493 57.4510 38.8995 175.2731 174 V 5.0330 9.1322 117.5201 59.4828 35.7382 176.0342 175 S 4.8955 9.6964 119.4663 57.4011 64.4111 175.3131 176 K 2.9726 8.2177 119.6379 59.6513 31.5045 179.3681 177 E 3.9740 7.9394 118.0317 59.2616 29.4970 179.0105 178 E 4.0468 8.0595 118.9190 59.1359 29.4807 179.1743 179 L 4.1413 8.2811 120.6053 58.0846 42.2255 178.9163 180 K 3.9952 8.1875 118.5148 59.6143 31.8348 178.8385 181 E 3.9111 8.2679 119.3959 59.2209 29.5835 178.6588 182 L 3.9044 8.0538 120.4381 58.1048 42.1570 178.9066 183 L 4.1586 8.6084 119.1276 57.2798 41.3684 179.4575 184 K 4.0813 7.8348 118.4878 59.0481 31.9816 179.4695 185 K 4.0016 7.9302 118.8263 59.0737 31.9178 179.3432 186 A 4.2853 8.2844 122.3337 54.7357 18.1775 179.6295 187 A 4.0793 7.9567 118.0598 54.3234 18.3771 178.9297 188 S 4.6817 7.5634 110.9281 57.7633 63.4489 174.8519 189 G 3.9482 7.7175 108.6592 46.7836 0.0000 175.1283 190 E 4.1368 8.6384 121.9582 58.0472 29.6965 176.1929 191 I 4.8835 7.4409 110.2465 59.0768 42.0286 174.1409 192 K 4.8957 8.7443 120.0348 54.5442 35.3216 175.6369 193 I 5.5945 8.4069 115.8139 57.9205 40.7726 175.2943 194 T 3.4321 7.9252 113.8233 60.6813 69.4636 173.5907 195 P 4.1031 0.0000 0.0000 65.6445 31.3422 178.8040 196 W 3.8044 7.2832 116.1273 59.0883 28.0475 178.0902 197 F 4.2884 6.9228 120.3590 60.6258 38.7476 177.0457 198 K 3.7153 7.8475 119.4114 59.5159 31.4852 178.4079 199 I 3.6492 7.6056 119.8896 64.9130 37.0270 178.5136 200 I 3.8214 7.9960 119.9585 64.2360 36.7248 178.4554 201 A 3.6528 7.7564 120.9380 54.9828 18.2213 179.3159 202 A 4.0718 7.9534 118.1424 54.3396 18.4452 178.3380 203 T 4.0325 7.0393 110.2093 64.8923 70.6475 175.7924 204 F 3.9941 7.1725 117.6392 58.1903 40.2597 177.7226 205 L 3.4597 7.4171 120.1373 58.2141 41.8454 179.2387 206 F 4.3832 7.9109 116.8298 60.0623 38.6682 177.9013 207 K 4.0359 7.8079 117.3598 59.2821 32.2776 178.8235 208 W 3.8495 7.4023 119.1501 59.3329 28.6810 178.3499 209 W 4.0713 8.3078 127.4757 60.6880 30.2459 177.5806 210 D 4.6395 8.3314 117.5906 56.0153 40.8532 176.2808 211 N 5.2590 8.0873 117.5003 52.5931 39.4507 176.5940 212 L 3.9392 8.0786 119.4184 57.8169 42.2771 179.0712 213 N 4.4442 8.1259 115.1652 55.5897 39.0908 175.0991 214 H 5.0367 7.5097 114.5454 54.3685 28.5500 173.9102 215 L 4.5119 7.7052 120.1462 56.3585 43.0114 179.4671 216 N 4.2743 8.4239 117.1244 56.3614 38.5050 176.9891 217 Q 4.1069 8.0458 113.8044 58.3169 28.3617 177.2432 218 F 4.7013 7.7586 115.8197 57.8154 39.9772 176.0027 219 V 3.5634 8.0429 121.3449 62.8505 30.6995 175.1311 220 D 4.5434 8.8755 127.5393 53.1654 42.0566 174.5821 221 H 4.8723 8.5714 121.6919 55.5329 29.1396 175.7483 222 E 4.4544 8.3715 119.9790 56.9927 31.3006 176.2785 223 K 4.1768 8.5028 119.8142 55.0403 33.0667 175.4838 224 I 4.5168 8.0086 127.1903 59.8995 38.3048 174.9971 225 Y 4.2276 8.9656 126.7168 57.9698 38.9505 176.6474 226 R 4.4121 8.7469 122.2923 56.3764 30.1127 176.4321 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 4 I 8.02 4.01 1.78 0.00 0.00 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 1.23 1.03 0.78 0.00 0.00 5 N 8.62 4.70 0.00 2.73 2.73 0.00 0.00 6.80 6.82 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 6 T 8.53 4.68 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 1.44 0.00 0.00 7 N 8.08 4.46 0.00 2.74 3.02 0.00 0.00 7.25 7.86 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 8 H 8.12 4.64 0.00 3.20 3.34 0.00 5.92 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 L 7.00 4.68 0.00 1.69 1.47 0.98 0.90 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 10 D 8.35 4.38 0.00 2.73 2.48 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 11 K 8.57 3.97 0.00 1.82 1.82 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.51 7.81 12 Q 8.02 4.01 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.08 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 13 Q 8.14 4.06 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.82 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 14 V 7.67 3.55 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.93 0.00 0.00 15 Q 8.13 4.04 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.61 0.00 0.00 0.00 0.00 0.00 2.37 2.68 0.00 16 L 7.63 4.17 0.00 1.78 1.67 0.88 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 17 L 7.94 4.18 0.00 1.85 1.76 0.96 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 18 A 7.51 4.39 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 19 E 8.28 4.23 0.00 2.22 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 2.33 2.28 0.00 *21 C 8.40 4.57 0.00 2.93 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 22 I 7.99 4.36 1.86 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.89 0.90 0.00 0.00 23 L 8.75 4.94 0.00 1.74 1.58 0.91 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 24 I 8.39 5.17 1.87 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 1.40 0.62 0.98 0.00 0.00 25 D 8.68 4.73 0.00 2.92 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 26 E 8.65 4.06 0.00 1.99 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 0.00 2.32 2.35 0.00 27 N 8.84 4.77 0.00 2.98 2.80 0.00 0.00 6.52 7.62 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 28 D 8.08 4.62 0.00 2.84 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 N 7.68 4.74 0.00 3.31 2.72 0.00 0.00 6.68 7.99 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 30 K 8.59 4.44 0.00 1.71 1.71 0.00 1.75 0.00 0.00 2.01 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.41 1.36 7.81 31 I 8.83 4.51 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.85 0.98 0.00 0.00 32 G 7.15 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 A 8.41 5.18 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 34 E 8.78 4.80 0.00 1.93 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.29 0.00 35 T 8.60 4.15 4.46 0.00 0.00 0.00 0.00 0.00 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 36 K 9.06 3.77 0.00 1.72 2.10 0.00 1.81 0.00 0.00 1.76 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.45 7.81 37 K 7.94 4.35 0.00 2.03 1.89 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.83 7.81 38 N 8.14 4.38 0.00 2.93 2.84 0.00 0.00 7.14 7.15 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 39 C 8.23 4.22 0.00 2.97 2.53 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 40 H 7.97 5.08 0.00 3.57 3.70 0.00 5.81 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 L 7.57 4.40 0.00 1.58 1.37 0.80 -0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 42 N 8.85 4.29 0.00 2.64 2.86 0.00 0.00 6.34 8.31 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 43 E 8.02 3.93 0.00 2.05 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 2.18 2.35 0.00 44 N 7.86 4.50 0.00 2.97 2.87 0.00 0.00 6.78 7.47 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 45 I 7.94 3.92 1.89 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 1.70 1.66 0.99 0.00 0.00 46 E 8.42 4.11 0.00 2.07 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 2.31 2.34 0.00 47 K 7.63 4.43 0.00 1.90 1.81 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.41 1.70 7.81 48 G 7.96 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 49 L 7.57 4.04 0.00 1.81 1.62 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.38 4.90 0.00 1.59 1.35 0.47 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 51 H 8.57 5.51 0.00 3.26 3.27 0.00 5.31 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 R 8.57 4.59 0.00 1.87 1.84 0.00 3.05 0.00 0.00 2.69 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 53 A 8.57 4.99 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 54 F 8.58 5.59 0.00 3.09 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 55 S 9.52 5.07 0.00 3.93 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 56 V 9.06 4.83 2.18 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 0.98 0.00 0.00 1.08 0.00 0.00 57 F 9.71 4.51 0.00 2.88 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 58 L 9.11 5.12 0.00 1.62 1.43 0.93 0.57 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 59 F 9.20 5.45 0.00 2.93 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 60 N 9.11 5.20 0.00 3.09 2.93 0.00 0.00 6.55 7.71 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 61 T 8.53 4.18 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 1.28 0.00 0.00 62 E 8.34 4.30 0.00 2.20 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 2.32 2.32 0.00 63 N 7.98 4.53 0.00 3.10 3.23 0.00 0.00 6.86 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.47 5.18 0.00 2.06 2.05 0.00 1.75 0.00 0.00 1.77 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.54 7.81 65 L 9.08 4.01 0.00 0.78 1.41 0.32 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.82 4.29 0.00 1.38 1.40 0.18 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 67 L 9.08 4.93 0.00 1.67 1.48 0.97 0.61 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 68 Q 8.50 5.03 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.11 0.00 69 Q 8.89 4.45 0.00 0.93 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.02 0.00 0.00 0.00 0.00 0.00 1.74 1.16 0.00 70 R 8.54 4.46 0.00 1.73 1.80 0.00 3.25 0.00 0.00 3.41 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.61 0.00 71 S 8.55 4.53 0.00 3.87 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.67 4.47 0.00 2.66 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 73 A 7.50 4.09 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 74 K 7.30 4.00 0.00 1.77 1.73 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.54 7.81 75 I 8.15 3.55 1.28 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.16 -0.82 0.00 0.00 76 T 7.44 4.15 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 1.20 0.00 0.00 77 F 8.40 3.92 0.00 3.21 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 78 P 0.00 4.40 0.00 2.14 2.17 0.00 3.78 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 1.96 1.90 0.00 79 G 8.44 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 80 C 7.34 4.66 0.00 3.00 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 81 F 9.39 4.56 0.00 2.95 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 82 T 8.00 3.72 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 1.07 0.00 0.00 83 N 7.92 4.15 0.00 1.77 2.16 0.00 0.00 6.00 7.71 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 84 T 7.81 3.90 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 85 C 7.33 4.56 0.00 2.98 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 86 C 8.33 4.87 0.00 2.54 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 6.08 3.92 0.00 3.62 3.27 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 88 H 8.47 5.17 0.00 3.10 3.26 0.00 5.95 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.56 0.00 2.22 1.98 0.00 3.97 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 1.96 1.86 0.00 90 L 9.20 4.33 0.00 1.67 1.63 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 91 S 8.30 4.47 0.00 3.97 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 92 N 7.35 5.16 0.00 2.96 2.84 0.00 0.00 5.85 7.76 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 93 P 0.00 4.25 0.00 2.22 2.22 0.00 3.75 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 1.97 2.02 0.00 94 A 8.04 4.10 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.59 4.53 0.00 2.11 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.27 0.00 96 L 7.85 4.40 0.00 1.64 1.68 0.90 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 97 E 7.74 3.89 0.00 2.00 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 2.35 2.37 0.00 98 E 8.63 4.29 0.00 2.06 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 2.28 2.43 0.00 99 S 8.09 4.17 0.00 3.93 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 0.00 100 D 9.37 4.16 0.00 2.83 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 0.00 101 A 7.98 3.74 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 0.00 102 L 7.94 4.05 0.00 1.91 1.64 0.88 1.08 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 0.00 103 G 8.16 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 0.00 104 V 7.31 3.38 1.68 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 0.07 0.00 0.00 0.42 0.00 0.00 105 R 7.57 3.69 0.00 1.87 1.88 0.00 3.37 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.78 0.00 106 R 8.07 3.85 0.00 1.95 1.88 0.00 3.22 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 107 A 7.72 4.10 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 7.16 3.24 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 0.00 109 Q 7.59 3.80 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.43 0.00 110 R 7.90 3.83 0.00 1.88 2.05 0.00 3.14 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 111 R 8.32 4.03 0.00 2.10 2.05 0.00 3.37 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.97 0.00 112 L 8.42 3.76 0.00 1.79 1.68 0.91 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 113 K 8.14 4.27 0.00 1.89 1.96 0.00 1.63 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.33 7.81 114 A 7.82 3.94 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 E 8.92 4.02 0.00 1.99 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 2.28 2.46 0.00 116 L 7.92 4.43 0.00 1.74 1.49 0.85 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 117 G 7.72 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 7.39 3.91 1.95 0.00 0.00 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 1.38 1.33 0.95 0.00 0.00 119 P 0.00 4.41 0.00 2.16 1.97 0.00 3.82 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 120 L 8.80 3.90 0.00 1.66 1.72 0.90 0.95 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 0.00 121 E 8.04 4.05 0.00 1.93 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 2.31 2.38 0.00 122 E 8.25 4.28 0.00 2.05 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 123 V 7.12 4.33 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.92 0.00 0.00 124 P 0.00 4.56 0.00 2.69 2.14 0.00 3.75 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.97 0.00 125 P 0.00 4.18 0.00 2.16 2.09 0.00 3.56 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 126 E 8.11 4.00 0.00 1.93 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 2.31 2.38 0.00 127 E 8.34 4.24 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 128 I 7.30 4.19 1.93 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.68 0.88 0.00 0.00 129 N 9.08 4.73 0.00 2.66 2.73 0.00 0.00 6.22 7.50 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 0.00 130 Y 8.59 4.66 0.00 2.88 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 L 9.31 4.07 0.00 1.30 1.15 0.63 -1.32 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 0.00 132 T 7.01 5.06 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 1.01 0.00 0.00 133 R 8.70 5.31 0.00 1.75 1.71 0.00 2.80 0.00 0.00 2.35 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.36 0.00 134 I 8.85 5.31 2.11 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 1.43 1.11 1.20 0.00 0.00 135 H 9.73 5.45 0.00 3.16 3.29 0.00 5.76 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 Y 8.71 5.11 0.00 3.27 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 0.00 137 K 8.74 5.14 0.00 1.74 1.72 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.48 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.32 7.81 138 A 9.11 4.91 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 Q 8.88 4.71 0.00 2.05 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.98 0.00 0.00 0.00 0.00 0.00 2.56 2.43 0.00 140 S 8.92 3.98 0.00 2.95 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 0.00 141 D 7.51 4.67 0.00 2.78 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 0.00 142 G 8.92 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 0.00 143 I 8.10 3.99 1.73 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 1.17 0.67 -0.07 0.00 0.00 144 W 8.96 5.21 0.00 3.16 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 0.00 145 G 8.52 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 E 9.50 5.23 0.00 2.30 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 2.78 3.06 0.00 147 H 8.50 4.91 0.00 3.14 3.10 0.00 5.65 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 0.00 148 E 8.42 5.29 0.00 1.58 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 0.00 1.76 1.82 0.00 149 I 8.20 4.53 1.90 0.00 0.00 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 1.17 0.73 0.94 0.00 0.00 150 D 9.38 5.14 0.00 3.06 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 0.00 151 Y 9.47 4.27 0.00 2.98 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 0.00 152 I 9.16 4.87 1.74 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.06 0.87 0.00 0.00 153 L 9.72 5.33 0.00 1.64 1.59 0.84 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 154 L 8.97 5.37 0.00 1.43 1.54 0.31 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 155 V 8.87 4.77 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 1.10 0.00 0.00 0.95 0.00 0.00 156 R 8.43 5.54 0.00 1.72 1.86 0.00 3.28 0.00 0.00 3.87 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.49 0.00 *158 N 8.74 4.47 0.00 2.75 2.83 0.00 0.00 6.97 7.68 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 0.00 159 V 8.28 4.67 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 0.78 0.00 0.00 1.00 0.00 0.00 160 T 8.94 4.51 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 1.22 0.00 0.00 161 L 8.31 4.77 0.00 1.50 1.21 0.68 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 0.00 162 N 8.59 4.85 0.00 2.67 2.59 0.00 0.00 6.96 7.25 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 0.00 163 P 0.00 4.55 0.00 2.00 1.76 0.00 3.68 0.00 0.00 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.46 0.00 164 D 8.84 4.54 0.00 2.61 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 0.00 165 P 0.00 4.80 0.00 2.20 2.17 0.00 3.41 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 166 N 8.36 4.42 0.00 2.70 2.98 0.00 0.00 7.11 7.08 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 0.00 167 E 8.32 4.35 0.00 2.13 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 2.21 2.36 0.00 168 I 7.26 4.91 1.95 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.07 0.97 0.00 0.00 169 K 9.26 4.10 0.00 1.75 1.73 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.33 7.81 170 S 7.66 4.82 0.00 3.82 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 0.00 171 Y 7.69 5.39 0.00 2.91 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 C 8.88 4.70 0.00 2.99 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 0.00 173 Y 8.82 5.07 0.00 2.96 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 0.00 174 V 9.13 5.03 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.30 0.00 0.00 175 S 9.70 4.90 0.00 3.97 4.10 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 0.00 176 K 8.22 2.97 0.00 1.46 1.61 0.00 1.37 0.00 0.00 1.60 0.00 0.00 2.98 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.30 0.41 7.81 177 E 7.94 3.97 0.00 1.94 1.95 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 2.30 2.28 0.00 178 E 8.06 4.05 0.00 2.27 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 179 L 8.28 4.14 0.00 2.18 2.20 1.30 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 180 K 8.19 4.00 0.00 1.98 1.77 0.00 1.45 0.00 0.00 1.28 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.12 1.47 7.81 181 E 8.27 3.91 0.00 2.25 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 2.29 2.30 0.00 182 L 8.05 3.90 0.00 1.85 1.85 0.52 0.51 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 0.00 183 L 8.61 4.16 0.00 1.90 1.74 1.12 0.81 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 0.00 184 K 7.83 4.08 0.00 1.95 1.83 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.56 7.81 185 K 7.93 4.00 0.00 1.85 1.81 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.62 1.59 7.81 186 A 8.28 4.29 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 0.00 187 A 7.96 4.08 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 S 7.56 4.68 0.00 3.97 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 0.00 189 G 7.72 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 0.00 190 E 8.64 4.14 0.00 2.02 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 2.34 2.24 0.00 191 I 7.44 4.88 2.04 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.95 0.96 0.00 0.00 192 K 8.74 4.90 0.00 1.75 1.74 0.00 1.64 0.00 0.00 1.91 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.45 1.44 7.81 193 I 8.41 5.59 2.09 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 1.06 1.66 1.04 0.00 0.00 194 T 7.93 3.43 2.69 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 0.52 0.00 0.00 195 P 0.00 4.10 0.00 2.28 2.30 0.00 2.20 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.85 0.00 196 W 7.28 3.80 0.00 3.13 2.54 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 0.00 197 F 6.92 4.29 0.00 2.79 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 K 7.85 3.72 0.00 1.80 1.87 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.44 7.81 199 I 7.61 3.65 2.01 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 1.54 1.02 0.98 0.00 0.00 200 I 8.00 3.82 2.09 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.94 0.80 0.00 0.00 201 A 7.76 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 A 7.95 4.07 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 0.00 203 T 7.04 4.03 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 0.17 0.00 0.00 204 F 7.17 3.99 0.00 1.71 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 L 7.42 3.46 0.00 1.47 1.27 0.86 1.14 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 0.00 206 F 7.91 4.38 0.00 3.10 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 0.00 207 K 7.81 4.04 0.00 1.60 2.01 0.00 1.67 0.00 0.00 1.80 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.44 7.81 208 W 7.40 3.85 0.00 3.36 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 0.00 209 W 8.31 4.07 0.00 3.62 3.24 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 0.00 210 D 8.33 4.64 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 0.00 211 N 8.09 5.26 0.00 3.23 3.09 0.00 0.00 6.85 6.77 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 0.00 212 L 8.08 3.94 0.00 1.57 1.60 0.44 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 213 N 8.13 4.44 0.00 2.41 2.72 0.00 0.00 6.71 8.16 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 0.00 214 H 7.51 5.04 0.00 3.15 3.23 0.00 5.65 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 0.00 215 L 7.71 4.51 0.00 1.70 1.67 0.79 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 216 N 8.42 4.27 0.00 2.75 2.84 0.00 0.00 6.86 7.74 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 0.00 217 Q 8.05 4.11 0.00 1.69 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.88 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 218 F 7.76 4.70 0.00 3.23 3.24 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 0.00 219 V 8.04 3.56 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 0.32 0.00 0.00 0.83 0.00 0.00 220 D 8.88 4.54 0.00 2.76 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 H 8.57 4.87 0.00 3.11 3.30 0.00 5.73 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 222 E 8.37 4.45 0.00 1.92 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 2.21 2.19 0.00 223 K 8.50 4.18 0.00 1.58 1.63 0.00 1.56 0.00 0.00 1.03 0.00 0.00 2.75 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.78 1.15 7.81 224 I 8.01 4.52 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 1.35 0.73 0.99 0.00 0.00 225 Y 8.97 4.23 0.00 3.26 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 0.00 226 R 8.75 4.41 0.00 1.75 1.90 0.00 3.52 0.00 0.00 3.32 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 * Residues marked with a * may have inaccurate shift predictions.