NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5467 8.2893 120.3250 55.3940 33.5663 174.3072 2 D 4.6805 8.7732 120.1900 50.7095 41.5255 175.7568 3 K 3.7301 9.4952 122.3612 60.3243 32.6616 179.7002 4 N 4.4666 8.6838 116.3066 55.7712 38.5073 177.4409 5 E 3.9960 8.4958 120.5023 59.2081 29.6713 178.9935 6 L 3.9555 7.8720 118.5434 57.9846 41.6546 179.6793 7 V 3.6227 7.6266 117.6099 66.0854 31.5652 177.9922 8 Q 4.0983 7.8425 117.7793 58.2823 28.6372 178.1952 9 K 4.0203 8.7421 120.8082 58.9173 31.7171 178.6048 10 A 4.1020 7.9548 121.2866 54.6203 17.9204 179.6478 11 K 4.0235 7.8187 116.9954 59.1944 32.1500 179.5385 12 L 3.9519 7.8511 118.9027 57.8231 41.6144 179.2895 13 A 3.9023 7.8962 120.6403 55.2312 18.0990 179.3408 14 E 3.8143 7.8585 117.1372 59.3840 29.4874 179.0649 15 Q 3.9851 7.6193 116.5898 58.5198 28.9121 177.7587 16 A 4.0379 7.7672 119.8306 52.0382 19.1479 176.7147 17 E 2.9415 7.3144 116.0388 57.6533 27.7688 176.6940 18 R 4.3184 7.6086 118.3481 54.5485 30.6843 176.5227 19 Y 4.2803 7.9252 120.6900 60.2701 38.3659 176.8531 20 D 4.2900 8.1062 119.5782 57.4096 41.0930 178.2172 21 D 4.3237 8.0259 118.7568 57.8113 40.7241 178.6230 22 M 4.0545 7.9266 117.5290 58.1846 32.0793 177.8953 23 A 3.8671 7.8225 120.8325 54.1950 18.7659 179.2705 24 A 3.9105 7.9564 119.4201 55.5523 18.4454 179.4451 25 C 4.0065 7.8512 114.7137 63.5670 28.3155 176.5734 26 M 4.2086 7.7871 119.7512 58.0278 31.5791 178.8255 27 K 4.0400 8.5352 120.6247 59.4613 32.1520 179.1378 28 S 4.0952 7.8766 114.8609 61.1779 62.9834 176.4831 29 V 3.6758 8.1475 121.4666 66.3954 31.4646 177.9939 30 T 3.7533 7.6557 115.3299 66.7561 68.1060 175.5961 31 E 2.9314 7.3276 116.0943 56.6924 29.7440 177.8583 32 Q 4.3022 7.9305 118.6743 55.3736 28.7528 177.7885 33 G 4.1203 7.8478 107.1639 45.8862 0.0000 174.1623 34 A 4.3306 7.6926 122.8460 50.8678 19.4538 177.1673 35 E 4.0956 8.6352 122.3406 56.4653 30.3365 176.3206 36 L 4.7031 8.2120 123.9699 53.5934 43.2970 177.4993 37 S 4.4350 8.5786 117.5167 57.5461 65.2251 174.8661 38 N 4.0324 8.6624 120.3169 57.0660 38.4443 176.3744 39 E 3.8804 8.0457 119.6806 59.4638 29.8856 178.4355 40 E 4.0161 7.8616 118.1576 59.2226 29.5444 179.4743 41 R 3.9190 8.2531 119.0956 59.6506 30.1432 178.3939 42 N 4.4824 8.2241 116.2553 56.2204 38.4264 177.4294 43 L 4.1063 7.7708 120.2280 57.4527 41.7814 179.0563 44 L 4.1131 8.2002 120.4500 58.1380 42.0522 179.0856 45 S 4.2757 8.2943 112.8686 61.5851 62.3489 176.1545 46 V 3.6411 8.3353 121.1571 65.9946 31.2115 177.5998 47 A 4.1525 8.1682 120.3988 55.7624 18.3253 179.3475 48 Y 4.1152 8.2859 114.6446 60.4545 37.9086 178.2909 49 K 3.9817 8.4031 121.1884 59.7723 32.3398 178.4796 50 N 4.1160 7.7228 116.5258 55.8756 38.1033 177.6428 51 V 3.6107 7.6515 119.9083 65.9728 31.6500 178.3555 52 V 4.0714 8.1737 118.8063 64.2971 31.6483 178.5877 53 G 3.6840 8.2546 106.0590 46.9923 0.0000 175.7128 54 A 3.9655 7.8420 123.0158 55.2641 18.4046 179.8389 55 R 3.8674 7.4181 116.7004 59.5345 30.3039 179.3204 56 R 3.8923 8.4176 118.1013 59.4931 29.9202 179.0741 57 S 4.1321 8.1181 112.5767 61.6362 62.5837 176.4246 58 S 4.1527 8.6395 118.2327 61.1822 62.4750 176.5631 59 W 3.9684 8.6636 131.7401 60.2415 30.5765 178.3886 60 R 4.0037 8.2110 117.7942 59.2762 29.7372 178.8847 61 V 3.5527 7.4197 118.0598 66.3944 31.4988 178.3310 62 V 3.6234 7.5800 117.1743 65.8375 31.2994 178.1618 63 S 3.7760 7.6357 115.1728 61.3062 62.4232 176.5533 64 S 4.0756 7.8245 115.5502 61.1007 61.9970 176.3493 65 I 3.6429 7.6051 122.2474 64.2150 36.6616 177.5779 66 E 3.8480 7.7501 118.9351 59.8527 29.2626 178.8936 67 Q 4.1203 7.9945 117.5569 58.8274 28.6241 178.6966 68 K 4.1215 8.0727 118.7032 58.6186 32.0094 178.3155 69 T 4.4570 7.8915 109.9528 60.3895 69.1877 173.8787 70 E 4.1717 6.6059 121.7687 57.8526 29.8734 177.3386 71 G 3.8861 9.1945 114.2738 45.3310 0.0000 173.7606 72 A 4.5470 7.7694 122.2190 49.6247 19.1224 176.1548 73 E 3.8515 8.3848 123.5793 59.7161 29.9634 178.5927 74 K 3.9807 7.9238 117.8775 59.2722 32.2858 179.2792 75 K 3.8886 7.9640 118.2301 59.7064 31.9724 178.9698 76 Q 4.0806 8.2369 121.1639 58.5744 28.8945 178.2190 77 Q 3.9483 7.9806 120.2620 59.2300 29.1753 177.7138 78 M 3.9970 7.8901 118.6578 58.7508 32.2228 178.1341 79 A 4.0779 8.1132 120.8656 54.9451 18.4177 179.6617 80 R 3.9025 8.0686 117.3541 59.7217 30.2228 178.6697 81 E 3.9997 8.3001 118.4419 59.5499 29.3469 178.7840 82 Y 4.3145 8.0213 119.2333 60.4427 38.7947 177.4718 83 R 3.7104 8.1867 119.8834 59.7463 30.2869 178.3144 84 E 4.0258 8.4901 118.3088 59.1700 29.2337 179.5359 85 K 3.9619 7.9586 119.7550 59.6681 32.3735 178.9454 86 I 3.6719 7.8385 120.3934 64.4228 36.8804 178.3340 87 E 4.0507 8.5918 119.6155 59.5918 29.3386 179.3334 88 T 3.8699 7.8055 115.2782 66.7890 68.6962 176.1235 89 E 3.9825 7.9096 120.1589 59.7287 29.5433 179.4906 90 L 4.0319 7.8851 119.9816 58.0302 42.0647 179.2885 91 R 3.9061 8.2387 118.2323 59.3501 30.0574 178.4221 92 D 4.4374 8.1660 118.6589 57.6566 40.7767 179.3170 93 I 3.8469 7.7388 119.5698 64.5836 37.1479 178.2347 94 C 4.2979 8.1106 117.5992 63.0178 28.1069 175.9032 95 N 4.2849 8.5929 117.8640 55.3631 38.0246 177.1621 96 D 4.1627 7.6449 119.8580 57.2765 41.3795 178.2305 97 V 2.9299 7.1456 118.6582 65.8229 31.3526 178.0139 98 L 3.7791 7.7583 118.7796 57.4964 41.3467 179.5514 99 S 3.9909 7.8596 112.9843 61.2152 62.3487 175.8182 100 L 4.1596 7.7057 121.7763 58.0715 41.4136 179.6256 101 L 3.8007 7.8608 118.4735 57.7003 41.3588 179.2811 102 E 3.8279 7.7820 117.6101 59.1883 29.7036 178.8000 103 K 3.8289 8.1791 117.2903 58.9917 31.9453 178.3374 104 F 4.5861 8.0495 116.4617 59.4706 39.8429 178.4363 105 L 3.5806 7.6234 116.4606 57.5236 41.7122 179.2010 106 I 3.9618 8.0810 120.1210 63.7181 36.8936 176.7227 107 P 4.2998 0.0000 0.0000 65.8275 31.2205 177.3243 108 N 4.4469 7.6473 110.9941 53.7387 38.6065 175.0596 109 A 4.1758 7.5254 120.9536 52.7253 17.7699 177.5639 110 S 4.6212 8.6298 116.2894 59.5582 64.1015 175.1069 111 Q 4.5932 7.5734 119.5898 53.1405 33.8062 175.1388 112 A 3.9992 8.6845 125.0359 55.4678 18.4325 179.7065 113 E 3.8401 8.1843 116.9899 59.6414 29.6114 179.1035 114 S 3.8315 7.9615 114.3485 61.3835 63.0272 176.2359 115 K 3.9795 8.1320 122.2254 59.8642 31.9246 178.8611 116 V 3.6416 7.9997 118.3288 65.7761 31.3328 177.8644 117 F 3.9802 7.8949 119.9728 61.6027 39.0858 176.9406 118 Y 4.4869 7.9703 115.2710 61.0890 38.0859 178.0232 119 L 4.1374 8.1918 120.1461 57.5452 41.3587 179.4242 120 K 4.0002 8.1026 119.8023 59.5633 31.8439 178.5237 121 M 4.3201 7.9651 118.2435 57.7730 31.9511 178.1615 122 K 4.0500 7.7871 120.0075 59.0020 32.3903 178.0456 123 G 3.3595 7.2364 103.1789 44.6938 0.0000 174.9951 124 D 4.1917 7.0439 122.4975 56.6418 40.6791 178.0699 125 Y 3.9192 7.4427 115.6515 59.9313 37.9534 177.3292 126 Y 4.2032 7.3940 118.3328 60.4180 38.1397 177.6288 127 R 4.1318 7.6401 119.5995 59.6856 29.9291 178.2339 128 Y 4.4071 7.3400 115.8269 60.9209 37.9696 178.1310 129 L 4.0946 7.6565 118.6684 57.5905 41.8918 179.0528 130 A 3.9887 8.4226 121.1885 55.5130 18.0994 179.3395 131 E 3.9028 8.0214 115.5741 58.7015 29.5626 178.2108 132 V 3.9870 7.5613 114.7513 61.8878 34.4050 174.8733 133 A 4.0771 7.9704 121.9156 53.4033 16.9510 179.7616 *139 K 4.0517 8.9779 123.5089 55.9859 33.5203 175.5831 140 G 3.6356 8.6772 105.6223 46.6995 0.0000 174.6133 141 I 4.1530 7.5279 112.7091 60.7743 38.2961 177.2158 142 V 3.7581 7.8047 121.4109 66.5496 31.2565 177.2434 143 D 4.3829 8.0136 117.2315 57.0913 41.0063 177.6104 144 Q 3.7196 7.5469 119.2040 58.3230 29.0163 177.7282 145 S 3.7377 7.6430 114.0341 61.0177 62.3963 175.7810 146 Q 3.5931 7.5637 121.8554 59.0238 28.7609 178.1107 147 Q 3.8716 8.0223 118.8800 58.7069 28.6775 178.0979 148 A 3.8628 7.4135 121.5994 55.7658 18.2257 179.3717 149 Y 3.8469 7.2217 114.1339 60.8494 37.6166 178.7403 150 Q 3.9548 8.3209 120.7892 59.3126 29.1541 178.0511 151 E 4.0942 8.4589 120.2194 59.0171 29.4033 178.6210 152 A 4.0231 8.2119 121.3916 54.9557 18.6174 179.3442 153 F 4.2250 8.3235 119.1884 61.3293 39.5381 177.0005 154 E 3.9562 8.7696 118.9693 59.5207 28.8172 179.2276 155 I 3.7793 7.8038 120.1232 63.9130 37.1885 178.5564 156 S 4.2187 7.6543 115.1858 60.9218 63.2484 176.6786 157 K 3.8232 7.4495 120.8029 58.5334 31.7056 179.1021 158 K 4.0417 7.6545 118.8957 59.3283 32.3550 178.1963 159 E 4.3270 7.6532 115.4035 56.2590 30.2780 176.1252 160 M 4.8119 7.2161 117.5421 52.9135 35.1794 175.7411 161 Q 4.1938 8.3861 120.5271 55.0979 29.4939 175.9183 162 P 4.3231 0.0000 0.0000 65.3344 31.2606 176.9709 163 T 4.3539 7.6667 107.4011 61.6141 69.4474 174.5289 164 H 4.3056 8.2407 123.7442 55.7963 31.1057 174.1681 165 P 4.5092 0.0000 0.0000 65.7621 31.3398 178.8712 166 I 3.9102 8.0475 118.4490 64.0945 37.0341 178.2810 167 R 3.9314 7.9242 119.2114 59.4520 30.0020 178.3594 168 L 4.1512 8.6125 119.2889 57.6207 41.4398 179.8238 169 G 3.6552 8.2176 105.9421 47.4708 0.0000 175.7147 170 L 3.9826 7.9993 122.3877 57.8837 42.1195 178.6185 171 A 4.2334 8.4260 120.9991 55.3303 18.2640 179.4744 172 L 3.9905 7.7351 118.4632 58.2608 42.2425 178.8156 173 N 4.3425 8.3928 116.5464 56.3824 38.5702 176.8713 174 F 3.6946 7.9045 121.9855 61.4819 39.1948 177.0959 175 S 4.1484 8.0261 111.9891 61.5936 62.2471 176.3590 176 V 3.9009 8.0262 120.7685 65.9578 31.2278 177.6756 177 F 4.1859 8.7363 120.8949 61.4510 39.1806 176.7124 178 Y 3.7623 8.2442 116.2568 61.2362 37.5811 177.9585 179 Y 3.5227 8.2274 120.5576 60.0445 38.5223 177.3269 180 E 4.2062 8.3816 117.7268 57.8031 30.8469 177.2608 181 I 3.8606 7.3251 117.9845 62.2920 37.7291 176.3342 182 L 3.9632 7.1871 118.8229 53.9000 42.4691 175.7342 183 N 3.8241 7.6261 108.1534 54.4325 36.6771 172.4535 184 S 4.5984 7.1938 113.5142 55.6329 65.1472 174.7454 185 P 4.2365 0.0000 0.0000 64.3773 31.5493 177.8660 186 E 3.8594 7.8940 116.5524 59.5275 28.8696 179.1107 187 K 3.8304 7.7961 118.5877 57.2211 32.2337 178.9981 188 A 4.0001 7.4550 121.3800 55.0888 18.8051 179.4030 189 C 4.4602 8.5059 115.9431 62.8953 28.1400 176.4584 190 S 4.1235 7.9317 115.5790 61.5074 62.5049 176.3187 191 L 3.8744 7.4206 120.6661 57.1293 41.8344 178.1568 192 A 4.5290 7.5526 118.6819 53.1433 19.8228 179.0184 193 K 3.9621 8.6219 118.9399 59.9683 32.1995 179.2650 194 T 3.9239 8.3989 116.1747 66.5402 68.3480 176.4762 195 A 4.0783 7.9243 122.3670 55.2342 18.4233 179.5327 196 F 3.9864 8.2296 118.4790 61.7146 39.4622 177.1269 197 D 4.4919 8.8065 118.9797 57.5706 40.3835 178.7832 198 E 4.0013 8.4778 118.4010 59.1458 29.5905 178.8707 199 A 4.0838 7.8181 120.7289 54.7385 18.2504 179.2331 200 I 3.6083 7.4726 115.8223 63.0938 38.1642 176.9986 201 A 4.3477 7.4891 119.5174 52.7834 18.9969 176.8228 202 E 4.8413 7.9346 117.9439 55.7996 30.5477 177.4969 203 L 4.1237 8.0253 119.4291 56.7153 42.0512 178.9271 204 D 4.4497 7.9418 117.5459 55.2453 39.7789 176.9338 205 T 4.3035 7.7616 109.3475 61.6526 69.1461 174.8732 206 L 4.2920 7.3928 122.6422 54.6550 42.4756 176.3934 207 S 4.8301 8.2533 115.9318 55.9619 65.6437 174.5530 208 E 4.0093 8.9155 123.0688 59.3981 29.3942 178.2163 209 E 4.2066 8.2612 115.7432 58.2502 30.0448 177.2526 210 S 4.6896 8.4319 111.9547 56.9696 64.6420 175.2711 211 Y 4.2106 8.1982 120.7068 60.1755 37.5007 178.4649 212 K 3.5129 7.2633 119.9210 58.9769 32.2960 178.2006 213 D 4.2800 7.9754 117.7857 57.6989 41.0597 178.5222 214 S 4.0973 8.3728 115.4774 62.1072 63.0455 176.9651 215 T 3.9069 7.7415 117.8588 66.3947 68.1959 176.3233 216 L 4.0528 7.8785 122.3103 58.4548 42.0839 179.2106 217 I 3.8055 7.8310 119.4966 64.4739 36.9822 178.4834 218 M 4.2997 8.2057 119.9459 58.4272 31.7409 178.5887 219 Q 4.1235 8.1043 117.7991 59.0233 28.4196 178.8219 220 L 3.9946 7.8727 119.2337 56.8444 41.7776 179.5278 221 L 3.9262 7.5764 119.6299 57.6278 41.6521 179.1655 222 R 3.4407 7.7573 118.5058 59.3004 29.9714 177.7875 223 D 4.2320 7.9772 118.9097 57.6944 40.8653 178.7587 224 N 3.3139 7.2582 115.5855 56.2233 38.2111 177.3132 225 L 4.0185 6.9435 118.0309 58.1324 41.7949 179.6926 226 T 3.9327 7.9317 115.8452 66.3715 68.3437 176.5151 227 L 3.9572 7.5909 122.1633 57.9463 41.7985 179.0195 228 W 5.0068 7.8604 115.5842 57.2788 28.9847 176.9332 229 T 4.6833 7.6230 114.3865 63.9769 70.6421 175.0029 230 S 4.3427 8.4216 124.5505 58.4318 62.1992 178.2833 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 M 8.29 4.55 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.53 0.00 2 D 8.77 4.68 0.00 2.81 2.77 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 3 K 9.50 3.73 0.00 1.91 1.88 0.00 1.71 0.00 0.00 1.98 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.51 1.71 7.81 4 N 8.68 4.47 0.00 2.90 2.84 0.00 0.00 7.00 7.17 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 5 E 8.50 4.00 0.00 2.14 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 2.32 2.50 0.00 6 L 7.87 3.96 0.00 1.82 1.71 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 7 V 7.63 3.62 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 1.04 0.00 0.00 1.07 0.00 0.00 8 Q 7.84 4.10 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.58 0.00 0.00 0.00 0.00 0.00 2.63 2.50 0.00 9 K 8.74 4.02 0.00 1.94 1.88 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.44 7.81 10 A 7.95 4.10 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 K 7.82 4.02 0.00 1.92 1.87 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.79 7.81 12 L 7.85 3.95 0.00 1.90 1.68 0.90 0.66 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 13 A 7.90 3.90 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 7.86 3.81 0.00 2.13 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 2.37 2.53 0.00 15 Q 7.62 3.99 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.72 0.00 0.00 0.00 0.00 0.00 2.57 2.51 0.00 16 A 7.77 4.04 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 17 E 7.31 2.94 0.00 1.98 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 2.20 0.00 18 R 7.61 4.32 0.00 1.72 1.72 0.00 3.06 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.61 0.00 19 Y 7.93 4.28 0.00 3.05 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.11 4.29 0.00 2.67 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 21 D 8.03 4.32 0.00 2.89 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 22 M 7.93 4.05 0.00 2.27 2.04 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.60 0.00 23 A 7.82 3.87 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.96 3.91 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 C 7.85 4.01 0.00 3.01 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 M 7.79 4.21 0.00 2.08 2.25 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.86 0.00 27 K 8.54 4.04 0.00 2.07 2.11 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.27 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.58 1.48 7.81 28 S 7.88 4.10 0.00 4.09 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 29 V 8.15 3.68 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.98 0.00 0.00 30 T 7.66 3.75 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 0.94 0.00 0.00 31 E 7.33 2.93 0.00 1.76 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 1.71 2.21 0.00 32 Q 7.93 4.30 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.88 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 33 G 7.85 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.69 4.33 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.64 4.10 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 2.35 2.44 0.00 36 L 8.21 4.70 0.00 1.77 1.61 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 37 S 8.58 4.44 0.00 4.06 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 38 N 8.66 4.03 0.00 2.71 2.83 0.00 0.00 6.51 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 39 E 8.05 3.88 0.00 2.06 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 2.38 2.40 0.00 40 E 7.86 4.02 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 41 R 8.25 3.92 0.00 1.92 1.70 0.00 2.21 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.54 0.00 42 N 8.22 4.48 0.00 2.77 2.90 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 43 L 7.77 4.11 0.00 1.93 1.76 0.94 0.77 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 44 L 8.20 4.11 0.00 1.88 2.00 1.17 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.29 4.28 0.00 4.46 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 V 8.34 3.64 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.04 0.00 0.00 47 A 8.17 4.15 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 8.29 4.12 0.00 3.19 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 49 K 8.40 3.98 0.00 2.11 1.99 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.68 7.81 50 N 7.72 4.12 0.00 2.02 1.77 0.00 0.00 6.68 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 51 V 7.65 3.61 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.98 0.00 0.00 52 V 8.17 4.07 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 0.73 0.00 0.00 1.00 0.00 0.00 53 G 8.25 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 54 A 7.84 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 55 R 7.42 3.87 0.00 2.14 2.01 0.00 3.21 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 56 R 8.42 3.89 0.00 1.71 1.89 0.00 2.21 0.00 0.00 2.46 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.50 0.00 57 S 8.12 4.13 0.00 4.10 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 58 S 8.64 4.15 0.00 3.97 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 59 W 8.66 3.97 0.00 3.49 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 60 R 8.21 4.00 0.00 2.19 2.05 0.00 3.30 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.06 0.00 61 V 7.42 3.55 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 1.00 0.00 0.00 1.00 0.00 0.00 62 V 7.58 3.62 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.00 0.00 0.00 63 S 7.64 3.78 0.00 3.39 3.30 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 64 S 7.82 4.08 0.00 3.96 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 65 I 7.61 3.64 1.97 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 1.39 0.74 0.89 0.00 0.00 66 E 7.75 3.85 0.00 2.04 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 2.26 2.42 0.00 67 Q 7.99 4.12 0.00 2.27 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.34 2.56 0.00 68 K 8.07 4.12 0.00 1.93 1.86 0.00 1.56 0.00 0.00 1.92 0.00 0.00 3.16 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.48 7.81 69 T 7.89 4.46 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 1.23 0.00 0.00 70 E 6.61 4.17 0.00 1.98 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 2.32 2.27 0.00 71 G 9.19 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 72 A 7.77 4.55 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 73 E 8.38 3.85 0.00 2.04 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 2.37 2.40 0.00 74 K 7.92 3.98 0.00 1.83 1.83 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.52 7.81 75 K 7.96 3.89 0.00 1.93 1.85 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.49 7.81 76 Q 8.24 4.08 0.00 2.40 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.81 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 77 Q 7.98 3.95 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 78 M 7.89 4.00 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.55 0.00 79 A 8.11 4.08 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 80 R 8.07 3.90 0.00 2.06 2.09 0.00 3.11 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 81 E 8.30 4.00 0.00 2.24 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 2.37 2.35 0.00 82 Y 8.02 4.31 0.00 3.11 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 R 8.19 3.71 0.00 1.74 2.05 0.00 3.03 0.00 0.00 2.59 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.21 0.00 84 E 8.49 4.03 0.00 2.25 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 85 K 7.96 3.96 0.00 1.93 1.96 0.00 1.76 0.00 0.00 1.90 0.00 0.00 3.14 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.42 1.52 7.81 86 I 7.84 3.67 1.94 0.00 0.00 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 1.29 -0.05 1.00 0.00 0.00 87 E 8.59 4.05 0.00 2.38 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 2.45 3.04 0.00 88 T 7.81 3.87 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 1.29 0.00 0.00 89 E 7.91 3.98 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.55 0.00 90 L 7.89 4.03 0.00 1.97 1.80 0.73 1.00 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 91 R 8.24 3.91 0.00 2.14 1.96 0.00 3.21 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 92 D 8.17 4.44 0.00 2.91 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 93 I 7.74 3.85 2.12 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 1.63 0.82 1.15 0.00 0.00 94 C 8.11 4.30 0.00 3.15 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.59 4.28 0.00 2.70 2.81 0.00 0.00 6.68 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 96 D 7.64 4.16 0.00 2.98 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 0.00 97 V 7.15 2.93 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.02 0.00 0.00 -0.11 0.00 0.00 98 L 7.76 3.78 0.00 1.54 1.46 0.04 0.42 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 99 S 7.86 3.99 0.00 4.02 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 L 7.71 4.16 0.00 1.90 1.60 0.89 0.58 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 0.00 101 L 7.86 3.80 0.00 1.76 1.64 0.79 0.74 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 0.00 102 E 7.78 3.83 0.00 2.15 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 2.30 2.35 0.00 103 K 8.18 3.83 0.00 1.33 1.05 0.00 1.68 0.00 0.00 1.51 0.00 0.00 2.92 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.52 7.81 104 F 8.05 4.59 0.00 3.10 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 7.62 3.58 0.00 1.11 0.13 0.79 0.54 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 0.00 106 I 8.08 3.96 1.84 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 1.59 1.21 0.94 0.00 0.00 107 P 0.00 4.30 0.00 1.99 2.06 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.04 0.00 108 N 7.65 4.45 0.00 2.95 2.89 0.00 0.00 7.09 7.23 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 0.00 109 A 7.53 4.18 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 S 8.63 4.62 0.00 3.97 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 0.00 111 Q 7.57 4.59 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 112 A 8.68 4.00 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 0.00 113 E 8.18 3.84 0.00 2.05 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 2.32 2.44 0.00 114 S 7.96 3.83 0.00 4.12 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 0.00 115 K 8.13 3.98 0.00 2.12 1.95 0.00 1.62 0.00 0.00 1.76 0.00 0.00 3.17 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.56 7.81 116 V 8.00 3.64 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 0.95 0.00 0.00 1.01 0.00 0.00 117 F 7.89 3.98 0.00 3.06 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Y 7.97 4.49 0.00 3.10 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 0.00 119 L 8.19 4.14 0.00 1.78 1.84 0.96 0.40 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 0.00 120 K 8.10 4.00 0.00 1.90 1.92 0.00 1.65 0.00 0.00 1.47 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.62 1.59 7.81 121 M 7.97 4.32 0.00 2.31 1.96 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.59 0.00 122 K 7.79 4.05 0.00 2.01 1.86 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.61 1.48 7.81 123 G 7.24 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 0.00 0.00 0.00 124 D 7.04 4.19 0.00 2.79 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 0.00 125 Y 7.44 3.92 0.00 2.88 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 0.00 126 Y 7.39 4.20 0.00 2.78 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 0.00 127 R 7.64 4.13 0.00 2.15 1.91 0.00 3.31 0.00 0.00 3.60 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.90 0.00 128 Y 7.34 4.41 0.00 2.87 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 0.00 129 L 7.66 4.09 0.00 2.00 1.75 0.80 0.81 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 0.00 130 A 8.42 3.99 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 0.00 131 E 8.02 3.90 0.00 2.03 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 2.36 2.61 0.00 132 V 7.56 3.99 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 0.65 0.00 0.00 -0.38 0.00 0.00 133 A 7.97 4.08 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 *139 K 8.98 4.05 0.00 1.84 1.76 0.00 1.76 0.00 0.00 1.91 0.00 0.00 2.89 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.46 7.81 140 G 8.68 3.64 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 0.00 141 I 7.53 4.15 1.96 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.92 0.96 0.00 0.00 142 V 7.80 3.76 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 0.92 0.00 0.00 143 D 8.01 4.38 0.00 2.72 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 Q 7.55 3.72 0.00 1.67 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.57 0.00 0.00 0.00 0.00 0.00 1.85 2.05 0.00 145 S 7.64 3.74 0.00 3.96 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 0.00 146 Q 7.56 3.59 0.00 2.44 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.59 0.00 0.00 0.00 0.00 0.00 2.48 2.52 0.00 147 Q 8.02 3.87 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 148 A 7.41 3.86 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 0.00 149 Y 7.22 3.85 0.00 2.30 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 Q 8.32 3.95 0.00 2.32 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.72 0.00 151 E 8.46 4.09 0.00 2.04 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 2.31 2.33 0.00 152 A 8.21 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 153 F 8.32 4.22 0.00 3.18 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 E 8.77 3.96 0.00 2.17 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 2.39 2.48 0.00 155 I 7.80 3.78 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.25 0.91 0.00 0.00 156 S 7.65 4.22 0.00 3.96 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 K 7.45 3.82 0.00 1.59 1.72 0.00 0.61 0.00 0.00 1.26 0.00 0.00 2.79 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.78 1.07 7.81 158 K 7.65 4.04 0.00 1.75 1.80 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.46 7.81 159 E 7.65 4.33 0.00 1.97 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 2.42 2.47 0.00 160 M 7.22 4.81 0.00 1.91 2.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.35 0.00 161 Q 8.39 4.19 0.00 2.10 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.88 0.00 0.00 0.00 0.00 0.00 2.46 2.30 0.00 162 P 0.00 4.32 0.00 2.26 2.18 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.04 0.00 163 T 7.67 4.35 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 1.25 0.00 0.00 164 H 8.24 4.31 0.00 3.32 3.26 0.00 5.61 0.00 0.00 0.00 0.00 6.80 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 4.51 0.00 2.25 2.12 0.00 3.53 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 166 I 8.05 3.91 1.89 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.34 1.02 0.00 0.00 167 R 7.92 3.93 0.00 1.84 2.10 0.00 3.28 0.00 0.00 3.54 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 168 L 8.61 4.15 0.00 1.73 1.77 1.03 0.98 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 0.00 169 G 8.22 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 L 8.00 3.98 0.00 1.95 2.02 0.95 0.98 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 0.00 171 A 8.43 4.23 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 0.00 0.00 0.00 0.00 0.00 172 L 7.74 3.99 0.00 1.88 1.93 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 173 N 8.39 4.34 0.00 2.86 2.90 0.00 0.00 6.69 8.91 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 0.00 174 F 7.90 3.69 0.00 2.74 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 0.00 175 S 8.03 4.15 0.00 4.16 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 0.00 176 V 8.03 3.90 2.38 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 1.10 0.00 0.00 1.26 0.00 0.00 177 F 8.74 4.19 0.00 3.33 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 Y 8.24 3.76 0.00 3.06 2.78 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 187 K 7.80 3.83 0.00 1.55 0.81 0.00 1.64 0.00 0.00 1.84 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.17 1.31 7.81 188 A 7.46 4.00 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 0.00 189 C 8.51 4.46 0.00 2.99 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 7.93 4.12 0.00 4.06 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 0.00 191 L 7.42 3.87 0.00 1.67 1.79 0.60 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 192 A 7.55 4.53 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 0.00 0.00 193 K 8.62 3.96 0.00 1.99 1.86 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.62 1.48 7.81 194 T 8.40 3.92 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 1.28 0.00 0.00 195 A 7.92 4.08 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 0.00 0.00 196 F 8.23 3.99 0.00 3.22 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 0.00 197 D 8.81 4.49 0.00 2.89 2.77 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 0.00 198 E 8.48 4.00 0.00 2.03 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 2.36 2.48 0.00 199 A 7.82 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 200 I 7.47 3.61 1.34 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 1.37 0.70 0.90 0.00 0.00 201 A 7.49 4.35 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 0.00 202 E 7.93 4.84 0.00 1.90 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 0.00 2.20 2.23 0.00 203 L 8.03 4.12 0.00 1.68 1.69 0.88 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 204 D 7.94 4.45 0.00 2.76 2.77 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 0.00 205 T 7.76 4.30 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 1.24 0.00 0.00 206 L 7.39 4.29 0.00 1.77 1.70 1.03 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 207 S 8.25 4.83 0.00 3.96 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 0.00 208 E 8.92 4.01 0.00 1.89 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 2.35 2.45 0.00 209 E 8.26 4.21 0.00 2.13 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 0.00 210 S 8.43 4.69 0.00 3.94 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 0.00 211 Y 8.20 4.21 0.00 3.27 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 0.00 212 K 7.26 3.51 0.00 1.51 1.65 0.00 1.49 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.02 0.22 7.81 213 D 7.98 4.28 0.00 2.68 2.77 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 0.00 214 S 8.37 4.10 0.00 3.90 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 0.00 215 T 7.74 3.91 4.55 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 1.25 0.00 0.00 216 L 7.88 4.05 0.00 1.82 1.88 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 217 I 7.83 3.81 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.07 0.98 0.00 0.00 218 M 8.21 4.30 0.00 2.10 2.26 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.44 0.00 219 Q 8.10 4.12 0.00 2.37 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 220 L 7.87 3.99 0.00 1.91 1.67 0.92 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 221 L 7.58 3.93 0.00 2.04 1.78 1.07 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 222 R 7.76 3.44 0.00 1.28 1.66 0.00 2.61 0.00 0.00 2.55 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.01 0.00 223 D 7.98 4.23 0.00 2.55 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 N 7.26 3.31 0.00 2.20 1.42 0.00 0.00 7.12 6.62 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 0.00 225 L 6.94 4.02 0.00 1.60 1.59 0.99 0.59 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 0.00 226 T 7.93 3.93 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 1.14 0.00 0.00 227 L 7.59 3.96 0.00 1.63 1.44 0.87 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 228 W 7.86 5.01 0.00 3.26 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 7.62 4.68 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 1.23 0.00 0.00 230 S 8.42 4.34 0.00 3.61 3.64 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 * Residues marked with a * may have inaccurate shift predictions.