NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3542 8.2493 123.5885 51.7583 19.9662 175.8363 3 E 3.9321 8.6344 114.5785 55.6878 29.9823 175.3008 4 K 4.0754 9.3957 123.1546 56.0044 33.7530 176.2531 5 P 4.7067 0.0000 0.0000 62.8468 32.8587 174.9686 6 K 5.0018 9.0303 124.6348 54.7151 35.0031 174.4786 7 L 4.9434 9.0075 128.3217 53.6454 43.7097 175.1872 8 H 5.2243 9.4341 122.4437 54.2063 30.5441 173.6894 9 Y 5.3510 8.3503 123.4618 56.8409 42.3957 172.9156 10 F 5.1485 8.1190 116.7978 55.5236 39.3359 176.2046 11 N 3.9581 8.5199 118.8077 51.0882 36.7785 173.1820 12 A 4.1616 6.9803 122.9041 50.7212 21.6402 176.2460 13 R 4.1914 7.2760 117.7652 55.4732 31.5529 181.1302 14 G 4.0285 7.5085 110.3036 47.4426 0.0000 174.4968 15 R 4.1789 9.2277 123.0404 56.7807 30.6085 177.0325 16 M 4.0180 6.8794 117.1083 56.2546 31.9942 177.1927 17 E 4.1443 8.0025 119.5658 59.5661 29.8758 178.5697 18 S 4.8171 7.9733 115.2227 61.1037 63.0294 176.5825 19 T 3.8253 7.7902 119.0737 66.4661 68.2826 176.6668 20 R 3.5187 7.8261 119.5726 58.9454 30.1103 179.0548 21 W 3.2147 8.3436 118.6231 59.4156 29.0448 178.4127 22 L 3.9020 7.8587 120.0735 58.0705 41.5883 178.8255 23 L 3.7616 7.8685 118.8438 57.7313 41.5589 179.3681 24 A 3.9250 7.8592 120.3415 55.1975 18.0048 179.5995 25 A 3.8851 7.6831 117.7978 54.8535 18.5252 178.8935 26 A 4.1802 7.6122 116.8908 52.0795 18.6865 178.1100 27 G 3.6869 7.6195 105.2256 45.8264 0.0000 173.5600 28 V 3.9573 7.4766 119.5920 60.7825 32.1509 175.7254 29 E 4.0700 8.6226 127.6823 56.3382 29.9520 175.8717 30 F 5.1936 7.7234 116.9044 55.6488 41.4963 173.0766 31 E 4.8412 9.4316 118.4324 54.6272 32.9229 175.0371 32 E 5.0328 8.5920 120.4359 54.4197 32.7039 175.7744 33 K 4.2238 8.5442 124.1153 54.4380 34.5679 174.9100 34 F 5.1529 8.3626 126.6840 57.3696 40.2544 175.4969 35 I 4.1887 9.0978 125.0784 61.0143 37.4461 176.7381 36 K 4.4887 9.3840 126.9789 56.7215 33.3857 176.6537 37 S 4.5825 7.5813 112.4920 55.5837 67.3875 174.4661 38 A 3.8332 8.3504 122.9830 55.1672 18.0056 179.7029 39 E 3.8930 8.0239 116.9176 59.3947 29.6306 179.0164 40 D 4.3286 7.8867 118.8215 57.2500 40.8563 178.5128 41 L 3.9724 7.5400 120.7697 58.3325 42.0271 178.8078 42 D 4.3304 8.3574 119.0917 56.9296 40.6866 178.6414 43 K 3.8565 8.1228 120.2489 59.4766 32.1169 178.7006 44 L 3.8822 7.6659 118.6879 57.8788 41.5529 179.7289 45 R 3.9716 8.1470 117.8328 59.4195 29.8675 178.4733 46 N 4.2736 8.2106 115.6251 56.8332 39.0310 175.7578 47 D 4.6092 7.9357 116.8433 54.2195 41.0432 177.1609 48 G 3.9699 7.8183 107.8636 46.1645 0.0000 174.3012 49 Y 4.2880 7.8366 116.5837 58.5039 38.4458 175.5773 50 L 4.6145 7.6173 119.9920 52.6576 42.9936 176.2877 51 M 3.6913 8.6972 124.3191 58.0218 30.7253 177.2296 52 F 4.8273 7.7850 114.5327 56.9817 39.4988 175.8910 53 Q 3.8661 8.1452 117.3114 56.8955 26.4865 173.3036 54 Q 4.8649 7.6383 114.7521 54.2575 32.1689 175.1439 55 V 4.6737 8.1707 112.3022 58.6603 34.7560 173.9927 56 P 4.9660 0.0000 0.0000 63.4468 32.5499 175.3143 57 M 5.1596 8.9389 121.5041 53.8748 36.1681 173.9861 58 V 4.8763 8.9270 124.9999 61.1406 35.0555 174.0493 59 E 4.7649 9.4159 128.5837 55.8712 30.6071 175.5600 60 I 4.6753 8.5575 124.7038 60.2583 42.0002 174.4428 61 D 4.5048 9.7468 129.0754 55.5262 38.2260 175.0318 62 G 3.9287 8.1710 104.4204 46.0541 0.0000 173.8071 63 M 4.2973 7.7303 119.7937 54.4726 33.1826 175.5486 64 K 4.4291 7.9465 121.8904 55.0238 31.5826 173.8471 65 L 4.3372 8.8210 123.6012 53.8802 43.0469 176.3362 66 V 4.7933 8.2573 116.2276 59.4975 35.5679 171.9751 67 Q 3.8695 8.8090 126.0251 56.5372 27.2430 174.4799 68 T 3.8795 8.7728 120.1753 67.1940 68.4246 176.6025 69 R 3.8976 7.9937 118.7295 58.8621 30.1073 178.7787 70 A 4.0336 7.9972 120.3053 55.1983 18.4847 179.5174 71 I 3.6713 7.8025 118.1558 64.7197 37.2326 178.8128 72 L 4.0431 8.1608 119.9169 57.7576 41.4401 179.3297 73 N 4.2307 8.4550 116.7550 56.2823 38.4344 176.8707 74 Y 4.0534 8.0863 120.8567 60.8567 38.9945 178.0499 75 I 3.6845 7.9853 120.4706 64.2996 37.1752 178.2353 76 A 3.9711 8.3698 121.9727 55.2738 18.2304 179.9419 77 S 4.0762 8.1296 113.5260 61.7015 62.7495 176.5827 78 K 3.4494 7.5987 121.2209 58.8807 31.6423 177.4007 79 Y 4.6705 7.2753 114.3378 56.9066 39.3378 175.2265 80 N 4.2202 7.9891 114.4645 55.1579 36.8195 174.8643 81 L 4.7820 8.4442 113.8962 54.7185 42.6118 177.0470 82 Y 4.9911 7.7672 118.6505 57.2534 39.2402 176.5282 83 G 3.9750 8.2945 107.3704 44.4644 0.0000 173.9030 84 K 4.2902 8.5143 116.5982 57.5959 33.6258 176.1139 85 D 4.5023 7.4320 118.3474 51.2947 43.1794 175.3985 86 I 3.5289 8.2443 118.3441 64.3339 37.7681 177.6972 87 K 3.9793 7.9742 118.7317 59.3846 31.9814 179.0705 88 E 3.9758 8.7245 119.1117 59.3946 29.3435 179.6003 89 R 3.8449 8.1681 118.0747 58.9664 30.0342 178.8748 90 A 3.9511 7.8727 120.5663 55.1927 18.3678 179.7363 91 L 3.6482 7.6273 116.9079 57.7685 41.5435 179.8004 92 I 3.5709 7.8007 119.9228 64.4683 37.0678 178.2262 93 D 4.4368 8.7031 120.0162 57.5444 40.7039 178.5528 94 M 4.1061 8.0804 118.6322 58.8837 32.2704 177.9046 95 Y 4.6410 8.1627 117.1755 61.3437 38.0862 178.5341 96 I 4.0318 8.3676 113.8448 63.5004 37.9122 177.9494 97 E 4.1212 8.6311 121.0113 58.8808 29.3655 179.3568 98 G 3.8200 8.2220 105.6326 48.0259 0.0000 175.6043 99 I 3.6699 8.0561 122.6682 64.1198 37.0173 178.3725 100 A 3.9168 8.2417 121.6050 55.1452 18.0900 179.3323 101 D 4.2574 8.0638 117.4331 57.5015 41.0513 178.9550 102 L 3.7743 7.4584 120.4269 57.8805 41.9489 179.0710 103 G 3.6298 8.1329 105.9411 47.8248 0.0000 175.2881 104 E 3.9122 8.4236 121.8775 59.0897 29.4250 178.5856 105 M 4.0060 7.5080 117.6932 58.6641 32.4028 178.6041 106 I 3.8363 7.6017 119.3402 64.2113 37.0738 177.9333 107 L 3.8653 7.8962 120.4839 57.9396 42.1170 178.2543 108 L 4.4134 7.5839 116.2049 54.4288 41.8442 177.9635 109 L 3.9483 7.3648 121.0726 57.8292 42.1238 176.8852 110 P 4.4804 0.0000 0.0000 64.0671 32.6959 177.0665 111 V 3.8643 7.3257 120.7044 60.9898 30.0147 172.7536 *113 P 4.2276 0.0000 0.0000 61.1917 33.3959 176.0416 114 P 4.2005 0.0000 0.0000 65.8723 31.3437 177.6622 115 E 4.3949 8.0621 114.0601 57.2564 30.0949 177.1436 116 E 4.4211 8.2038 118.3007 56.6305 30.1047 177.9038 117 K 3.8927 7.5725 119.4930 59.5952 32.3146 178.2525 118 D 4.3499 8.1004 118.3430 57.5264 40.9684 178.6546 119 A 4.0602 7.9433 120.5971 54.7095 18.4114 179.4901 120 K 3.8943 8.0793 118.5640 59.4904 32.2247 178.7217 121 L 3.9229 8.0205 120.4354 58.2745 42.0689 178.9060 122 A 3.9746 7.8763 120.1737 55.0009 18.2587 179.4026 123 L 3.9547 7.9028 118.6098 58.1883 42.0829 179.2591 124 I 3.7311 7.8418 119.9455 64.3174 37.0646 178.5531 125 K 3.9199 8.2810 119.5396 59.3937 31.7559 179.0812 126 E 3.9788 8.1871 119.5493 59.0827 29.4422 179.0544 127 K 3.9487 8.1278 118.7496 59.2730 32.0627 179.4072 128 I 3.4830 7.8809 120.1498 64.3697 36.8106 178.6896 129 K 4.1393 7.8537 117.7377 58.9981 31.9814 178.3165 130 N 4.8326 8.3737 114.6962 53.3828 39.9112 175.3657 131 R 4.2008 7.9787 117.7575 57.9684 31.8232 177.3828 132 Y 3.9564 7.3147 115.3719 61.1209 38.2081 178.0617 133 F 4.3730 8.2410 118.7518 60.0911 38.8395 175.9274 134 P 4.4241 0.0000 0.0000 65.5183 31.2628 178.3772 135 A 3.8010 7.5933 119.2474 55.2846 18.2557 179.7541 136 F 4.2117 7.8411 116.1369 60.3719 39.0373 177.7188 137 E 3.9835 8.6455 119.5723 59.0960 29.3745 178.8930 138 K 3.9587 8.0191 119.8898 59.1893 31.7961 178.9672 139 V 3.4939 7.5180 118.0923 66.1563 31.5156 178.1212 140 L 3.7013 7.8143 118.5366 57.5055 41.1752 179.3201 141 K 4.0681 7.9551 119.0274 58.7002 32.1591 178.7605 142 S 4.2605 7.7107 114.6410 61.2101 62.9485 174.8299 143 H 4.6543 7.5895 116.4279 53.9744 29.7419 175.9824 144 G 4.0208 7.9603 107.2226 46.2419 0.0000 173.4193 145 Q 4.4952 7.5924 118.5681 54.1685 30.3371 175.7016 146 D 4.2984 8.3200 117.9305 56.1723 41.0971 176.4818 147 Y 5.0510 7.2617 115.0991 55.6304 41.3772 175.5728 148 L 4.3290 9.8297 123.3493 57.2806 42.0570 178.3644 149 V 4.4146 7.4480 117.2733 62.0285 34.1875 175.4467 150 G 4.0039 9.2626 113.6779 45.5625 0.0000 172.5027 151 N 4.3242 8.3418 114.6761 53.4857 37.4851 173.6993 152 K 4.2303 7.8261 114.8001 53.5617 35.5639 175.1513 153 L 3.5636 7.1880 126.7553 55.7345 42.3700 176.1161 154 S 4.7880 8.9720 119.1476 55.2376 66.4915 174.7492 155 R 3.7482 8.7581 117.3621 59.5800 28.5436 178.6958 156 A 4.0189 7.8167 121.3021 55.1453 18.3278 179.3551 157 D 4.3331 8.0994 117.2118 57.4681 40.9053 179.1321 158 I 3.7695 7.5872 119.7959 64.8115 37.3231 178.0800 159 H 4.1049 8.2748 117.4427 58.5449 28.3916 177.7508 160 L 3.6218 7.8323 122.1468 58.0233 41.9372 179.1606 161 V 3.4084 7.7168 118.2551 65.7454 31.3090 177.1533 162 E 2.5400 7.3692 119.0520 59.0210 29.1091 178.7881 163 L 3.7584 7.3037 119.6465 58.0145 41.9919 178.8999 164 L 4.0301 7.8294 119.1488 57.8054 41.5584 178.8489 165 Y 3.9099 7.6877 116.7162 61.4808 37.9134 178.6052 166 Y 4.5019 7.1911 117.2822 61.0092 37.8896 178.4421 167 V 3.6448 8.3557 119.7833 65.9224 31.4183 177.4675 168 E 3.9509 8.2117 118.1556 59.6363 29.4880 178.4456 169 E 4.1777 8.0371 117.0227 59.2183 29.5616 178.9207 170 L 4.3253 7.7023 119.4086 56.6123 42.4867 176.7226 171 D 4.3077 8.0862 117.1289 53.4525 43.6002 176.1822 172 S 4.3265 8.9259 122.8776 60.4774 63.3910 175.2564 173 S 4.4984 8.3556 115.6034 59.4021 63.5866 176.2761 174 L 4.0742 7.7101 121.2322 57.9678 41.5205 178.1086 175 I 4.3822 8.0113 116.9830 62.2402 38.3840 177.3881 176 S 4.1291 8.2079 114.8480 61.7164 62.7657 175.2341 177 S 4.3757 7.9424 112.6980 57.9907 63.3975 174.5115 178 F 4.7279 7.9648 122.1218 54.7649 38.7303 173.8784 179 P 4.3040 0.0000 0.0000 65.6097 31.3751 178.6404 180 L 4.0160 8.8195 119.2994 57.4429 41.4636 179.3963 181 L 3.8486 8.2352 119.0940 57.6494 41.5160 179.6190 182 K 3.8604 7.8941 117.7425 59.4280 31.9612 179.3112 183 A 3.9745 8.0587 121.0598 54.7896 18.2027 179.3044 184 L 3.8060 8.1270 119.2889 58.1513 42.1085 179.1218 185 K 3.8672 8.0535 119.4049 59.8142 31.8926 178.8106 186 T 3.8683 7.5362 114.4827 66.7437 68.7394 176.6089 187 R 4.0774 8.0591 119.7871 59.4607 30.2189 179.2755 188 I 3.8563 8.0375 119.7654 64.5430 36.8754 178.7189 189 S 4.3992 8.1690 114.9960 60.9044 62.7331 175.3820 190 N 4.7568 7.7306 116.8451 51.9886 39.2370 175.3459 191 L 4.1033 7.4447 122.3085 54.3920 42.6571 175.9752 192 P 4.2574 0.0000 0.0000 66.1893 31.3001 178.9320 193 T 3.8388 7.8089 107.6811 64.9257 68.8551 176.6553 194 V 3.5289 7.7063 120.9224 65.1844 31.5558 177.6743 195 K 3.9909 8.4487 119.9953 59.4260 31.8237 178.7078 196 K 3.9175 7.8302 118.7738 59.4387 32.1819 178.1954 197 F 4.2050 7.8122 120.0081 61.1635 39.3085 176.6912 198 L 3.8391 7.5687 117.1756 55.7660 41.6139 177.5035 199 Q 4.2104 6.9609 117.8045 54.3175 29.5107 173.9162 200 P 4.3867 0.0000 0.0000 64.0724 31.7819 177.3228 201 G 3.8519 8.7174 108.2270 45.5254 0.0000 173.7943 202 S 4.4728 6.9142 114.0687 56.3823 64.2919 172.6273 203 P 4.5206 0.0000 0.0000 63.3851 31.1507 177.2256 204 R 3.9516 7.1440 119.6741 56.2307 30.3442 175.6781 205 K 4.6346 8.7646 123.7008 53.7851 34.5651 174.5484 206 P 4.6150 0.0000 0.0000 61.1246 32.4273 174.1794 207 P 4.2763 0.0000 0.0000 62.9531 31.6763 176.1587 208 M 4.1632 8.5193 121.9164 55.3731 32.9631 175.7973 209 D 4.9945 8.3647 125.5263 51.1627 43.6805 176.6711 210 E 3.9894 8.7260 117.6271 59.8295 28.6505 179.2784 211 K 4.0833 8.0685 118.6987 59.3363 33.1195 178.8338 212 S 4.3299 8.3750 114.2505 60.6377 62.3225 175.8115 213 L 4.1262 7.9889 123.5925 58.0770 41.9588 178.4689 214 E 3.9236 8.2152 119.0923 58.8984 29.3472 178.7712 215 E 3.8530 7.9446 117.5272 59.1584 29.5377 178.6109 216 A 3.6212 7.8125 120.5655 55.4921 18.4766 179.7682 217 R 2.8432 7.4447 116.1977 58.8566 29.9262 178.9233 218 K 4.1193 7.5077 115.1808 58.0745 33.0193 178.3421 219 I 3.8425 6.8912 120.5319 63.3582 37.8938 177.1594 220 F 4.6174 7.7009 114.8511 56.1178 40.4447 176.1869 221 R 4.2173 8.0464 115.2306 55.5856 26.8788 176.0041 222 F 4.5656 7.3563 114.1693 56.8023 38.0709 175.6607 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 2 A 8.25 4.35 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 3 E 8.63 3.93 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 2.31 2.44 0.00 4 K 9.40 4.08 0.00 1.80 1.86 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.66 1.50 7.81 5 P 0.00 4.71 0.00 2.16 2.05 0.00 3.84 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 6 K 9.03 5.00 0.00 1.86 1.71 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.28 1.36 7.81 7 L 9.01 4.94 0.00 1.73 1.63 0.79 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 8 H 9.43 5.22 0.00 3.28 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Y 8.35 5.35 0.00 3.18 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 10 F 8.12 5.15 0.00 3.16 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 11 N 8.52 3.96 0.00 1.44 2.39 0.00 0.00 6.78 7.96 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 12 A 6.98 4.16 0.28 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 13 R 7.28 4.19 0.00 1.85 1.85 0.00 3.48 0.00 0.00 3.13 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.74 0.00 14 G 7.51 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 0.00 0.00 0.00 15 R 9.23 4.18 0.00 1.75 1.90 0.00 3.16 0.00 0.00 3.13 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 16 M 6.88 4.02 0.00 1.60 1.04 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.58 0.00 17 E 8.00 4.14 0.00 2.25 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 2.76 3.06 0.00 18 S 7.97 4.82 0.00 4.04 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 19 T 7.79 3.83 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 1.06 0.00 0.00 20 R 7.83 3.52 0.00 2.28 2.29 0.00 3.58 0.00 0.00 3.61 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.94 0.00 21 W 8.34 3.21 0.00 3.57 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.86 3.90 0.00 1.89 1.61 0.84 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 23 L 7.87 3.76 0.00 1.32 1.61 0.36 0.72 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 24 A 7.86 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 A 7.68 3.89 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 26 A 7.61 4.18 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 27 G 7.62 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 0.00 0.00 0.00 28 V 7.48 3.96 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 0.74 0.00 0.00 -0.17 0.00 0.00 29 E 8.62 4.07 0.00 1.98 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 30 F 7.72 5.19 0.00 3.10 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 31 E 9.43 4.84 0.00 1.92 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 2.17 2.24 0.00 32 E 8.59 5.03 0.00 1.29 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 2.39 2.39 0.00 33 K 8.54 4.22 0.00 1.65 1.39 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.35 7.81 34 F 8.36 5.15 0.00 3.05 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 9.10 4.19 1.94 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.31 0.81 0.00 0.00 36 K 9.38 4.49 0.00 1.73 1.86 0.00 1.73 0.00 0.00 1.82 0.00 0.00 3.24 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.59 1.53 7.81 37 S 7.58 4.58 0.00 4.07 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 38 A 8.35 3.83 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 39 E 8.02 3.89 0.00 2.03 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 2.37 2.43 0.00 40 D 7.89 4.33 0.00 2.80 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 41 L 7.54 3.97 0.00 1.57 1.76 1.02 1.21 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 42 D 8.36 4.33 0.00 2.75 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 43 K 8.12 3.86 0.00 1.89 1.92 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.41 7.81 44 L 7.67 3.88 0.00 1.96 1.77 1.04 1.09 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 45 R 8.15 3.97 0.00 2.03 2.08 0.00 3.28 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.79 0.00 46 N 8.21 4.27 0.00 2.70 2.96 0.00 0.00 7.38 8.02 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 47 D 7.94 4.61 0.00 2.44 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 7.82 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 49 Y 7.84 4.29 0.00 2.98 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 50 L 7.62 4.61 0.00 1.71 1.77 1.06 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 51 M 8.70 3.69 0.00 1.23 1.79 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 2.16 1.39 0.00 52 F 7.78 4.83 0.00 3.16 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 53 Q 8.15 3.87 0.00 2.31 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.24 6.69 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 54 Q 7.64 4.86 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.03 6.71 0.00 0.00 0.00 0.00 0.00 2.36 2.63 0.00 55 V 8.17 4.67 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.33 0.00 0.00 56 P 0.00 4.97 0.00 2.08 1.90 0.00 3.60 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.68 0.00 57 M 8.94 5.16 0.00 2.06 1.93 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.78 0.00 58 V 8.93 4.88 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 1.08 0.00 0.00 0.93 0.00 0.00 59 E 9.42 4.76 0.00 1.97 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 2.22 2.33 0.00 60 I 8.56 4.68 1.95 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.39 0.89 0.00 0.00 61 D 9.75 4.50 0.00 2.84 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.17 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 63 M 7.73 4.30 0.00 1.92 1.90 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 64 K 7.95 4.43 0.00 1.43 1.66 0.00 1.09 0.00 0.00 1.38 0.00 0.00 2.40 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.00 0.70 7.81 65 L 8.82 4.34 0.00 1.69 1.57 0.83 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.26 4.79 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.03 0.00 0.00 67 Q 8.81 3.87 0.00 2.35 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.81 0.00 0.00 0.00 0.00 0.00 2.52 2.41 0.00 68 T 8.77 3.88 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 69 R 7.99 3.90 0.00 1.86 1.99 0.00 3.13 0.00 0.00 3.35 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 70 A 8.00 4.03 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 71 I 7.80 3.67 2.04 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 0.92 0.00 0.00 72 L 8.16 4.04 0.00 1.64 1.66 0.81 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 73 N 8.45 4.23 0.00 2.88 3.08 0.00 0.00 6.65 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 74 Y 8.09 4.05 0.00 3.18 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 75 I 7.99 3.68 1.92 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 1.65 0.77 1.04 0.00 0.00 76 A 8.37 3.97 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 8.13 4.08 0.00 3.93 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 78 K 7.60 3.45 0.00 0.85 1.08 0.00 1.48 0.00 0.00 1.10 0.00 0.00 3.06 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.30 0.93 7.81 79 Y 7.28 4.67 0.00 2.99 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 80 N 7.99 4.22 0.00 2.89 2.87 0.00 0.00 6.65 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 81 L 8.44 4.78 0.00 1.63 1.66 0.91 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 82 Y 7.77 4.99 0.00 2.85 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 83 G 8.29 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 K 8.51 4.29 0.00 1.86 1.92 0.00 1.64 0.00 0.00 1.74 0.00 0.00 3.24 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.73 1.34 7.81 85 D 7.43 4.50 0.00 2.88 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 86 I 8.24 3.53 1.81 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 1.59 1.25 0.87 0.00 0.00 87 K 7.97 3.98 0.00 1.94 1.81 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.50 7.81 88 E 8.72 3.98 0.00 2.08 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 2.33 0.00 89 R 8.17 3.84 0.00 1.85 1.68 0.00 2.21 0.00 0.00 2.47 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.54 0.00 90 A 7.87 3.95 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 91 L 7.63 3.65 0.00 1.63 1.08 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 92 I 7.80 3.57 2.13 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.75 1.02 0.00 0.00 93 D 8.70 4.44 0.00 2.86 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 94 M 8.08 4.11 0.00 2.27 2.10 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.84 0.00 95 Y 8.16 4.64 0.00 3.21 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 I 8.37 4.03 1.90 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.97 1.05 0.00 0.00 97 E 8.63 4.12 0.00 2.17 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 2.50 2.51 0.00 98 G 8.22 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 8.06 3.67 2.02 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.61 0.84 0.00 0.00 100 A 8.24 3.92 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 0.00 101 D 8.06 4.26 0.00 2.97 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 0.00 102 L 7.46 3.77 0.00 0.62 1.23 0.77 0.64 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 2.01 2.03 0.00 111 V 7.33 3.86 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.87 0.00 0.00 *113 P 0.00 4.23 0.00 2.40 2.00 0.00 3.69 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.12 0.00 114 P 0.00 4.20 0.00 2.18 2.15 0.00 3.60 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.17 0.00 115 E 8.06 4.39 0.00 1.96 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 2.29 2.33 0.00 116 E 8.20 4.42 0.00 2.12 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 2.26 2.29 0.00 117 K 7.57 3.89 0.00 1.87 1.91 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.64 7.81 118 D 8.10 4.35 0.00 2.73 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 0.00 119 A 7.94 4.06 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 0.00 120 K 8.08 3.89 0.00 1.98 1.98 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.48 7.81 121 L 8.02 3.92 0.00 1.81 1.83 0.92 0.80 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 0.00 122 A 7.88 3.97 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 0.00 123 L 7.90 3.95 0.00 1.96 1.67 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.84 3.73 2.02 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 1.52 0.55 0.88 0.00 0.00 125 K 8.28 3.92 0.00 1.93 1.85 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.64 7.81 126 E 8.19 3.98 0.00 2.14 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 2.30 2.49 0.00 127 K 8.13 3.95 0.00 2.09 2.05 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.59 7.81 128 I 7.88 3.48 1.74 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.58 -0.38 0.00 0.00 129 K 7.85 4.14 0.00 1.86 1.97 0.00 2.01 0.00 0.00 1.89 0.00 0.00 3.09 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.68 7.81 130 N 8.37 4.83 0.00 2.80 2.83 0.00 0.00 6.81 8.22 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 0.00 131 R 7.98 4.20 0.00 1.55 1.59 0.00 2.62 0.00 0.00 2.69 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.15 0.00 132 Y 7.31 3.96 0.00 3.05 3.16 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 0.00 0.00 0.00 0.00 133 F 8.24 4.37 0.00 2.47 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 0.00 134 P 0.00 4.42 0.00 2.15 2.21 0.00 3.62 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.51 0.00 135 A 7.59 3.80 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 F 7.84 4.21 0.00 3.03 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 E 8.65 3.98 0.00 2.30 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 0.00 2.50 2.44 0.00 138 K 8.02 3.96 0.00 1.93 1.98 0.00 1.67 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.42 7.81 139 V 7.52 3.49 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 0.94 0.00 0.00 0.58 0.00 0.00 140 L 7.81 3.70 0.00 1.87 1.69 0.91 0.64 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 0.00 141 K 7.96 4.07 0.00 1.87 1.94 0.00 1.81 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.43 7.81 142 S 7.71 4.26 0.00 4.08 4.09 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 0.00 143 H 7.59 4.65 0.00 3.30 3.63 0.00 5.58 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 0.00 144 G 7.96 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 Q 7.59 4.50 0.00 1.86 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.42 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 146 D 8.32 4.30 0.00 2.08 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 0.00 0.00 0.00 147 Y 7.26 5.05 0.00 2.98 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 0.00 148 L 9.83 4.33 0.00 1.83 2.07 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 149 V 7.45 4.41 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.05 0.00 0.00 150 G 9.26 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 N 8.34 4.32 0.00 2.94 2.89 0.00 0.00 6.83 6.68 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 0.00 152 K 7.83 4.23 0.00 1.58 1.52 0.00 1.84 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.19 1.21 7.81 153 L 7.19 3.56 0.00 0.99 1.28 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 154 S 8.97 4.79 0.00 4.15 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 0.00 155 R 8.76 3.75 0.00 1.74 2.15 0.00 2.21 0.00 0.00 2.49 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 156 A 7.82 4.02 1.46 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 0.00 0.00 0.00 157 D 8.10 4.33 0.00 2.94 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 0.00 158 I 7.59 3.77 1.88 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.02 1.07 0.00 0.00 159 H 8.27 4.10 0.00 3.05 3.20 0.00 5.62 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 L 7.83 3.62 0.00 1.48 1.65 0.32 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 161 V 7.72 3.41 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 1.17 0.00 0.00 0.94 0.00 0.00 162 E 7.37 2.54 0.00 1.16 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 1.47 1.47 0.00 163 L 7.30 3.76 0.00 1.78 1.67 0.99 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 164 L 7.83 4.03 0.00 1.62 1.49 0.69 0.48 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 0.00 165 Y 7.69 3.91 0.00 2.91 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 Y 7.19 4.50 0.00 3.07 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 0.00 167 V 8.36 3.64 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.00 0.00 0.00 168 E 8.21 3.95 0.00 2.04 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 0.00 2.36 2.36 0.00 169 E 8.04 4.18 0.00 2.34 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 2.47 2.62 0.00 170 L 7.70 4.33 0.00 1.85 1.93 0.93 1.12 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 0.00 171 D 8.09 4.31 0.00 2.66 2.49 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 0.00 172 S 8.93 4.33 0.00 4.04 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 0.00 173 S 8.36 4.50 0.00 4.08 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 0.00 174 L 7.71 4.07 0.00 1.75 1.80 0.89 1.29 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 0.00 175 I 8.01 4.38 2.01 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.24 0.95 0.00 0.00 176 S 8.21 4.13 0.00 4.03 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 0.00 177 S 7.94 4.38 0.00 3.62 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 0.00 178 F 7.96 4.73 0.00 3.11 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 P 0.00 4.30 0.00 2.24 2.28 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 2.16 2.02 0.00 180 L 8.82 4.02 0.00 1.89 1.74 0.92 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 181 L 8.24 3.85 0.00 1.68 1.34 0.17 0.57 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 0.00 182 K 7.89 3.86 0.00 1.95 1.82 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.56 7.81 183 A 8.06 3.97 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 0.00 184 L 8.13 3.81 0.00 1.77 1.77 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 185 K 8.05 3.87 0.00 1.71 1.85 0.00 1.30 0.00 0.00 1.39 0.00 0.00 2.29 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.23 7.81 186 T 7.54 3.87 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 1.22 0.00 0.00 187 R 8.06 4.08 0.00 1.80 1.92 0.00 3.00 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.79 0.00 188 I 8.04 3.86 2.04 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.39 1.08 0.00 0.00 189 S 8.17 4.40 0.00 4.18 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 0.00 190 N 7.73 4.76 0.00 2.86 2.88 0.00 0.00 7.01 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 0.00 191 L 7.44 4.10 0.00 1.88 1.65 1.04 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 192 P 0.00 4.26 0.00 2.15 2.13 0.00 3.62 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 2.13 2.19 0.00 193 T 7.81 3.84 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 194 V 7.71 3.53 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.98 0.00 0.00 195 K 8.45 3.99 0.00 2.04 1.94 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.46 7.81 196 K 7.83 3.92 0.00 1.79 1.98 0.00 1.83 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.41 7.81 197 F 7.81 4.21 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 0.00 198 L 7.57 3.84 0.00 1.72 1.58 0.96 0.28 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 0.00 199 Q 6.96 4.21 0.00 2.20 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.89 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 200 P 0.00 4.39 0.00 1.99 1.95 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.05 0.00 201 G 8.72 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 0.00 202 S 6.91 4.47 0.00 3.71 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 P 0.00 4.52 0.00 2.52 2.59 0.00 3.87 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.94 0.00 204 R 7.14 3.95 0.00 0.67 1.22 0.00 3.07 0.00 0.00 2.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.51 0.00 205 K 8.76 4.63 0.00 1.94 1.68 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.22 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.68 1.71 7.81 206 P 0.00 4.62 0.00 2.18 2.05 0.00 3.75 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 207 P 0.00 4.28 0.00 2.08 2.07 0.00 3.71 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.32 0.00 208 M 8.52 4.16 0.00 2.02 1.99 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.62 0.00 209 D 8.36 4.99 0.00 2.97 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 0.00 210 E 8.73 3.99 0.00 2.22 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 0.00 2.38 2.40 0.00 211 K 8.07 4.08 0.00 2.01 2.11 0.00 1.50 0.00 0.00 1.74 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.67 1.50 7.81 212 S 8.38 4.33 0.00 3.97 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 0.00 213 L 7.99 4.13 0.00 1.98 1.90 1.11 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 214 E 8.22 3.92 0.00 2.30 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 2.26 2.32 0.00 215 E 7.94 3.85 0.00 2.32 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 2.32 2.32 0.00 216 A 7.81 3.62 1.52 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 0.00 217 R 7.44 2.84 0.00 1.86 1.66 0.00 3.07 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 1.42 0.00 218 K 7.51 4.12 0.00 1.83 1.81 0.00 1.53 0.00 0.00 1.63 0.00 0.00 3.14 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.36 7.81 219 I 6.89 3.84 1.02 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.40 -0.14 0.00 0.00 220 F 7.70 4.62 0.00 3.25 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 0.00 221 R 8.05 4.22 0.00 1.95 1.94 0.00 3.19 0.00 0.00 3.90 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.51 0.00 222 F 7.36 4.57 0.00 3.05 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 * Residues marked with a * may have inaccurate shift predictions.