NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 5.3689 8.0632 120.4237 55.5982 34.2400 173.7605 2 K 4.9373 8.9811 125.9580 54.6778 34.3953 173.7338 3 I 4.8534 9.9649 130.0538 59.5872 39.8323 174.4072 4 A 4.8793 9.0007 130.1728 50.5709 20.8979 175.5791 5 I 4.8456 8.8845 124.0466 59.5769 39.6089 174.5620 6 F 5.4502 10.5220 130.0669 55.2290 42.2325 174.3591 7 G 4.2686 7.9744 115.9421 46.0546 0.0000 171.7857 8 T 3.3736 6.7597 115.3508 60.4648 68.2162 173.4865 9 V 3.7427 8.0905 123.6260 64.4887 31.5029 175.8804 10 G 3.7597 8.8517 115.0543 45.2131 0.0000 173.8339 11 A 3.8882 7.4446 122.9779 53.5309 18.5890 179.0243 12 G 3.9906 8.2260 103.9204 45.8317 0.0000 175.7027 13 K 3.9352 8.3604 121.4205 59.3354 32.0539 179.0188 14 S 4.4216 7.8984 115.2037 60.8334 63.1820 176.4646 15 T 3.8301 7.8135 118.8411 66.5455 68.2371 176.2999 16 I 3.7035 7.9029 121.6798 64.5319 37.1102 178.3545 17 S 4.1407 8.4193 116.0529 61.8025 62.6743 176.7289 18 A 3.9915 8.0219 122.9168 55.4001 17.6161 179.5090 19 E 3.8977 8.2872 116.9548 59.6783 29.5130 179.7760 20 I 3.7393 8.1164 120.1650 64.1217 37.0882 178.3317 21 S 4.0512 8.4462 114.5118 61.4174 62.0136 176.2070 22 K 3.8269 7.9435 119.8902 59.6455 31.8751 178.9657 23 K 4.1307 7.5658 116.4090 58.1817 32.2472 178.3884 24 L 4.3278 7.8030 117.0899 53.4862 42.7162 177.6253 25 G 3.9083 8.3187 106.4735 46.0076 0.0000 173.2264 26 Y 4.6098 7.5430 116.0970 56.8871 39.0437 175.0231 27 E 4.0548 8.5778 123.6902 56.5415 31.1275 175.2715 28 I 4.7657 8.0325 126.6699 59.7313 39.1343 175.4706 29 F 4.4714 9.5620 127.8916 56.9900 39.1132 174.7858 30 K 4.8865 8.6884 122.7483 54.4318 35.1240 176.3351 31 E 4.4827 8.6142 123.5309 53.3996 29.9772 173.3014 32 P 4.3624 0.0000 0.0000 62.0377 32.0331 178.5001 33 V 3.4059 8.2795 122.8144 64.3430 31.5531 178.0784 34 E 4.0669 8.0059 118.8446 58.4537 29.5006 177.1074 35 E 4.2566 7.6935 116.4292 56.2256 30.2604 175.6490 36 N 4.5187 7.9849 119.2275 51.0908 38.4175 173.7323 37 P 4.2516 0.0000 0.0000 64.6956 31.9098 176.6915 38 Y 4.4681 7.7387 116.5022 59.0535 38.0259 177.5325 39 F 4.2137 8.1882 121.9026 61.3687 39.1768 176.3759 40 E 4.2019 8.4034 117.1809 58.9248 29.4067 177.7502 41 Q 4.4960 7.5842 115.9747 55.8298 29.4915 176.7299 42 Y 4.2562 7.6431 121.4388 61.2608 38.5405 177.9005 43 Y 3.4491 7.5253 114.8448 59.9242 38.5689 177.2912 44 K 3.9674 7.4903 117.9888 58.9901 32.4065 177.2397 45 D 4.3922 7.5623 119.1513 51.6038 42.8348 175.4621 46 L 3.6453 8.1444 127.2357 57.5226 41.6300 178.9662 47 K 4.1711 8.0213 117.8832 58.9527 32.0349 178.5582 48 K 4.1113 8.0968 117.6806 59.0542 32.5331 177.9879 49 T 4.3465 7.7180 114.9576 64.7259 69.2398 176.7616 50 V 3.8333 8.0334 120.9167 66.3273 31.4394 177.4075 51 F 3.9028 8.3291 119.2598 61.5092 39.1691 176.9932 52 K 3.7903 8.2210 117.1602 59.7308 31.7631 178.7342 53 M 3.6271 7.8166 118.1731 58.7830 32.2514 178.3594 54 Q 3.9809 8.4213 118.3084 58.5830 28.7808 178.7575 55 I 3.7946 7.6106 121.3300 64.3504 37.1117 177.4585 56 Y 4.1263 7.9809 120.4390 61.0968 38.5958 178.2386 57 M 4.0671 8.4026 119.5029 58.3858 32.1156 178.5933 58 L 4.0149 7.8286 118.6416 58.2106 41.8393 179.5735 59 T 3.7606 7.9946 115.1598 66.6619 68.3614 176.2420 60 A 3.7820 7.6690 122.3605 55.3685 18.1658 179.7240 61 R 3.8357 7.7015 115.5504 59.5564 30.3795 178.6299 62 S 4.2109 7.9073 115.1765 61.4198 62.3512 176.7384 63 K 4.0230 8.0246 121.2483 59.4949 31.5451 179.3991 64 Q 3.9266 7.7479 117.0151 58.4028 28.6031 178.2901 65 L 4.1113 7.4788 120.1207 56.8605 41.8333 178.1314 66 K 3.6554 7.1877 118.4575 57.4946 32.7487 176.8301 *73 N 4.2254 7.9984 116.9126 54.1519 38.8361 173.3960 74 I 4.6469 8.4369 122.6070 59.4514 42.5703 173.7097 75 I 4.8175 8.4734 126.5570 59.7876 39.4656 174.7012 76 F 4.8458 9.7666 127.9988 56.4172 39.8618 174.9863 77 D 4.7170 9.3336 126.2143 53.5060 40.5703 172.8617 78 R 4.3605 8.8936 128.5468 55.5651 31.9345 175.2815 79 T 4.6538 8.3139 112.4983 59.1240 71.7342 174.7656 80 L 4.3633 8.1590 123.1258 57.2402 41.7488 178.4772 81 L 4.1264 7.4164 117.3716 57.5256 41.7400 178.5057 82 E 3.7728 7.9165 117.7890 58.1387 29.4631 178.3026 83 D 4.4157 7.5514 118.7824 57.1798 40.9437 177.1959 84 P 4.5509 0.0000 0.0000 64.6032 31.1933 178.6201 85 I 3.6051 7.4813 119.2177 64.4211 36.7877 178.3514 86 F 4.0926 8.3778 118.2464 60.5196 38.6878 177.5243 87 M 4.0096 8.0086 117.6577 58.3216 31.9927 177.9133 88 K 3.9592 8.3716 120.0062 59.6173 32.5030 178.9026 89 V 3.4878 7.8120 118.4310 66.1384 31.3598 177.8124 90 N 4.4973 8.1222 116.0274 56.1829 38.4702 176.9001 91 Y 4.3131 8.1161 122.6730 60.2250 38.5970 177.5707 92 D 4.1330 8.2159 119.2396 56.3593 40.8664 177.6841 93 L 4.4519 7.3435 116.5808 53.4983 41.9292 176.0323 94 N 4.1848 7.4408 114.0194 54.4839 36.5918 175.1273 95 N 4.6128 8.7689 116.8409 54.3555 38.9027 175.3595 96 V 4.5066 7.4124 117.9031 60.1409 34.8450 174.5289 97 D 4.7449 8.5339 126.5959 52.2650 42.1203 177.1045 98 Q 4.1300 8.7952 119.5740 59.9008 28.7585 178.5314 99 T 3.8841 7.9381 115.8013 66.9664 68.6706 176.2431 100 D 4.4538 8.8257 121.0807 57.4690 40.7369 178.4450 101 Y 4.1038 8.2018 120.0537 60.7539 38.7909 177.3648 102 N 4.2173 8.6186 117.8662 56.8717 38.6780 177.0568 103 T 3.9395 8.2560 117.0063 67.0682 68.4640 175.7029 104 Y 4.1296 8.2968 120.8242 60.9076 38.8361 178.3555 105 I 3.7443 8.0964 120.9303 64.4306 37.1466 177.9405 106 D 4.2890 8.4647 119.1736 57.4031 41.2348 177.9302 107 F 4.1127 8.6938 121.5874 61.4862 39.3179 176.4532 108 Y 3.5568 8.5128 120.1347 60.4143 38.6666 177.5154 109 N 4.2663 7.9594 116.6599 54.8277 38.7317 176.2031 110 N 4.9244 8.0961 115.3383 52.9248 39.7445 174.8085 111 V 4.0120 6.8829 117.9867 64.4400 33.3334 177.3175 112 V 3.3020 6.6182 117.7117 65.5484 31.7862 176.8956 113 L 3.7640 7.8459 121.5707 57.9593 41.9895 178.2888 114 E 3.9258 7.1454 116.4527 57.3223 30.6155 177.5837 115 N 4.5141 7.1077 114.0387 53.3620 37.3119 173.6136 *122 K 4.3472 8.0192 126.3433 57.0352 32.7843 177.0265 123 L 4.0332 8.2081 111.7894 54.9608 43.3368 174.2865 124 S 4.2013 7.6006 113.8480 57.4430 63.0863 173.2954 125 F 5.1739 8.2101 125.0655 55.7479 42.0907 175.0863 126 D 4.6872 9.1956 124.0741 57.0872 41.9643 176.1266 127 I 4.7680 7.6814 116.6058 59.9167 41.8208 173.3221 128 V 4.4436 8.7991 129.6162 61.1954 33.5512 174.7191 129 I 4.7640 9.2951 131.8972 60.7724 38.1315 175.1900 130 Y 5.4268 8.8729 130.9545 56.7560 39.2757 174.4111 131 L 4.4039 9.0129 129.2213 53.7968 40.5161 175.4645 132 R 3.6646 7.8956 123.3684 55.5560 31.2177 175.2284 133 V 4.8018 7.9049 124.8435 59.8595 34.7329 175.1147 134 S 4.3698 9.1858 117.8179 58.2578 64.0583 175.5273 135 T 3.8676 8.4839 118.7219 66.5816 68.1668 176.8457 136 K 3.8348 8.0929 120.0025 60.0576 32.0884 179.1457 137 T 3.7884 7.6157 115.4004 66.4956 68.3928 176.4424 138 A 4.0058 7.9444 122.5731 55.3150 18.3595 179.7252 139 I 3.3548 8.1312 118.6719 64.5146 37.1344 178.9411 140 S 4.2582 8.0449 114.9650 61.3362 62.8304 176.7488 141 R 3.8526 8.1136 121.9777 58.9259 29.7439 179.0082 142 I 3.5830 7.5339 119.6534 64.2104 36.8547 178.5865 143 K 3.9326 8.0929 118.3218 59.2496 31.9760 178.8705 144 K 3.9999 7.9004 118.6393 59.6785 32.1901 178.2562 145 R 4.0579 7.7319 117.4728 57.9208 29.9559 177.3605 146 G 3.7856 7.9966 104.4173 46.4708 0.0000 173.7209 147 R 4.0016 8.0499 119.2458 56.1156 30.4743 176.7909 148 S 4.1493 8.8593 120.3604 61.9391 62.5481 176.1384 149 E 4.0541 8.1633 121.3214 59.2191 29.0610 179.0770 150 E 3.5660 8.0830 116.5372 58.7826 29.7296 178.8265 151 L 4.1891 7.5881 117.7921 57.0486 41.6073 179.2556 152 L 4.0967 7.2163 118.6110 56.7672 41.9783 177.8138 153 I 3.7293 6.6988 110.1303 60.3603 38.2162 175.6174 154 G 3.9758 7.9611 110.6946 44.3542 0.0000 174.4383 155 E 4.2850 8.6876 117.8312 59.1911 29.2469 179.1698 156 E 3.9598 8.2360 117.4741 59.6336 29.3896 178.4269 157 Y 3.8264 7.5086 118.8610 60.2725 38.7861 178.1846 158 W 4.6717 7.8571 119.1854 60.0281 29.3071 178.0370 159 E 4.0053 8.7672 119.6022 59.4441 29.0518 179.0739 160 T 3.8112 8.0171 115.9566 66.3689 68.4590 176.4284 161 L 3.7465 7.7507 122.2389 58.0589 42.0964 178.4579 162 N 4.3588 8.3662 117.0010 56.8173 38.9322 176.8558 163 K 4.0243 8.0156 119.6253 59.7330 32.1376 179.1066 164 N 4.4511 8.2949 116.6811 56.3131 38.4211 177.1717 165 Y 3.7904 8.5080 118.8216 60.9341 37.9491 178.1628 166 E 4.2267 8.6331 120.3858 59.3395 29.8128 178.5062 167 E 3.9826 8.4423 119.5316 59.0164 29.7615 178.4214 168 F 4.0154 8.4147 120.8426 61.4263 39.3276 176.3197 169 Y 3.6118 8.1100 118.9884 60.7461 38.3052 178.4676 170 K 3.4460 7.8064 117.7661 59.2747 32.1585 179.1063 171 Q 4.0891 7.8459 117.4325 57.5730 28.9313 176.5913 172 N 5.0576 7.3908 115.3387 52.5316 39.5019 176.5056 173 V 3.1997 6.9342 119.8827 64.7484 31.0331 177.0074 174 Y 4.5116 7.4734 115.0950 58.8636 38.1757 175.4338 175 D 4.7096 8.0525 118.2897 53.9978 41.8349 176.1615 176 F 4.9076 7.7260 116.8374 55.1736 43.4456 173.2498 177 P 4.8241 0.0000 0.0000 62.1016 29.2605 175.2615 178 F 4.8799 8.2458 122.0797 58.4633 40.6129 175.6365 179 F 5.0221 9.4122 124.4337 56.5389 42.2733 173.6281 180 V 4.1453 8.2902 126.9427 62.2702 32.5873 175.0880 181 V 4.0067 8.2444 128.0314 60.6055 34.2366 173.8030 182 D 4.3044 8.5561 127.1950 54.3988 41.4782 175.5843 183 A 4.4999 8.6813 127.7594 52.5082 18.3912 178.0255 184 E 4.0075 8.4695 117.1439 58.9950 29.8743 177.9543 185 L 4.1036 7.2290 117.9126 54.6584 42.4628 177.2699 186 D 4.5978 8.3025 120.6438 52.8967 41.6223 177.4706 187 V 3.5673 8.2980 119.9330 66.4014 31.4467 178.2876 188 K 3.9234 8.0887 117.4667 59.8178 31.7796 179.3226 189 T 3.8453 7.6917 114.9469 66.6925 68.4015 176.5251 190 Q 4.0125 8.0339 119.9692 59.4482 28.8077 179.6709 191 I 3.7202 8.1125 120.7076 64.2525 37.1217 178.1315 192 E 3.9334 8.2281 120.1604 59.4145 29.5597 178.9363 193 L 4.1240 8.3464 119.3440 57.7629 41.5830 179.7147 194 I 3.9453 8.1673 119.9819 64.7458 37.0493 178.3900 195 M 4.0522 8.4886 119.9498 58.3690 31.6961 178.3934 196 N 4.2663 8.2431 116.6466 56.2964 38.5308 177.3309 197 K 3.6810 7.5878 119.2903 59.3303 32.6092 178.4821 198 L 4.0909 8.1140 119.6115 58.0511 41.3633 179.3807 199 N 4.4033 8.2431 115.5766 56.0956 38.5313 177.1589 200 S 4.3286 7.8108 114.0521 59.6966 63.3201 174.2495 201 I 4.0728 7.3303 120.7730 60.9658 37.4005 175.1512 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 8.06 5.37 0.00 2.35 2.14 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.64 0.00 2 K 8.98 4.94 0.00 2.06 2.25 0.00 1.97 0.00 0.00 1.93 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.59 7.81 3 I 9.96 4.85 2.05 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.24 1.04 0.00 0.00 4 A 9.00 4.88 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 I 8.88 4.85 1.96 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 1.35 1.01 0.99 0.00 0.00 6 F 10.52 5.45 0.00 3.06 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 7.97 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 T 6.76 3.37 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 1.08 0.00 0.00 9 V 8.09 3.74 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 0.61 0.00 0.00 1.50 0.00 0.00 10 G 8.85 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.44 3.89 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 12 G 8.23 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 13 K 8.36 3.94 0.00 1.82 2.04 0.00 1.88 0.00 0.00 2.07 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.49 7.81 14 S 7.90 4.42 0.00 4.08 4.16 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 15 T 7.81 3.83 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 1.20 0.00 0.00 16 I 7.90 3.70 1.95 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 1.74 0.97 0.96 0.00 0.00 17 S 8.42 4.14 0.00 4.02 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 18 A 8.02 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 19 E 8.29 3.90 0.00 2.15 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 2.53 2.50 0.00 20 I 8.12 3.74 1.99 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 1.42 1.05 0.87 0.00 0.00 21 S 8.45 4.05 0.00 3.91 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 K 7.94 3.83 0.00 1.94 1.85 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.64 7.81 23 K 7.57 4.13 0.00 1.69 1.78 0.00 1.64 0.00 0.00 1.67 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.44 7.81 24 L 7.80 4.33 0.00 0.89 0.33 0.56 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.32 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 7.54 4.61 0.00 2.90 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 27 E 8.58 4.05 0.00 1.90 1.66 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 1.96 1.98 0.00 28 I 8.03 4.77 1.84 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 1.36 0.73 0.94 0.00 0.00 29 F 9.56 4.47 0.00 2.92 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 30 K 8.69 4.89 0.00 1.64 1.73 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.42 7.81 31 E 8.61 4.48 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 2.16 2.37 0.00 32 P 0.00 4.36 0.00 2.30 1.96 0.00 3.74 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.09 0.00 33 V 8.28 3.41 1.77 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 0.30 0.00 0.00 -0.06 0.00 0.00 34 E 8.01 4.07 0.00 1.95 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 2.32 2.40 0.00 35 E 7.69 4.26 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 36 N 7.98 4.52 0.00 2.69 2.83 0.00 0.00 7.16 8.85 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 37 P 0.00 4.25 0.00 1.63 1.88 0.00 2.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.56 0.00 38 Y 7.74 4.47 0.00 3.09 2.90 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 39 F 8.19 4.21 0.00 3.10 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 40 E 8.40 4.20 0.00 2.06 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 2.45 0.00 41 Q 7.58 4.50 0.00 2.33 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.50 0.00 0.00 0.00 0.00 0.00 2.30 2.50 0.00 42 Y 7.64 4.26 0.00 3.08 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 43 Y 7.53 3.45 0.00 2.88 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 44 K 7.49 3.97 0.00 1.88 1.84 0.00 1.88 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.36 7.81 45 D 7.56 4.39 0.00 2.52 2.45 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 46 L 8.14 3.65 0.00 1.58 1.54 0.64 -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 0.00 0.00 0.00 0.00 47 K 8.02 4.17 0.00 1.86 1.89 0.00 1.76 0.00 0.00 0.61 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.36 7.81 48 K 8.10 4.11 0.00 1.93 1.82 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.52 7.81 49 T 7.72 4.35 4.36 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 1.32 0.00 0.00 50 V 8.03 3.83 2.17 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 1.06 0.00 0.00 1.08 0.00 0.00 51 F 8.33 3.90 0.00 3.20 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 52 K 8.22 3.79 0.00 1.69 1.11 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.56 1.58 7.81 53 M 7.82 3.63 0.00 2.06 1.71 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 2.22 1.25 0.00 54 Q 8.42 3.98 0.00 1.83 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.60 0.00 0.00 0.00 0.00 0.00 2.55 2.40 0.00 55 I 7.61 3.79 1.65 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 -0.05 0.89 0.00 0.00 56 Y 7.98 4.13 0.00 3.38 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 57 M 8.40 4.07 0.00 2.02 2.25 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.94 0.00 58 L 7.83 4.01 0.00 2.03 1.77 0.89 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 59 T 7.99 3.76 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 1.18 0.00 0.00 60 A 7.67 3.78 1.05 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 0.00 0.00 61 R 7.70 3.84 0.00 1.93 1.94 0.00 3.33 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 62 S 7.91 4.21 0.00 4.03 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 63 K 8.02 4.02 0.00 1.94 1.86 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.68 7.81 64 Q 7.75 3.93 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.99 0.00 0.00 0.00 0.00 0.00 2.56 2.74 0.00 65 L 7.48 4.11 0.00 1.79 1.64 0.80 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 66 K 7.19 3.66 0.00 1.69 1.94 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.18 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.79 1.48 7.81 *73 N 8.00 4.23 0.00 2.29 1.82 0.00 0.00 6.91 7.45 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 74 I 8.44 4.65 1.53 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.87 0.56 0.00 0.00 75 I 8.47 4.82 1.92 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.26 0.99 0.00 0.00 76 F 9.77 4.85 0.00 2.99 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 77 D 9.33 4.72 0.00 2.79 2.83 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 78 R 8.89 4.36 0.00 2.05 1.97 0.00 3.35 0.00 0.00 3.58 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 79 T 8.31 4.65 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 0.73 0.00 0.00 80 L 8.16 4.36 0.00 1.78 1.75 1.02 0.79 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 81 L 7.42 4.13 0.00 1.71 1.73 0.55 1.07 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 82 E 7.92 3.77 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 1.53 2.12 0.00 83 D 7.55 4.42 0.00 2.84 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 84 P 0.00 4.55 0.00 2.02 1.94 0.00 3.73 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 1.27 0.86 0.00 85 I 7.48 3.61 1.60 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.24 0.37 0.00 0.00 86 F 8.38 4.09 0.00 3.34 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 M 8.01 4.01 0.00 1.93 1.27 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 1.72 0.00 88 K 8.37 3.96 0.00 2.12 2.12 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.64 7.81 89 V 7.81 3.49 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 0.60 0.00 0.00 0.80 0.00 0.00 90 N 8.12 4.50 0.00 2.84 2.93 0.00 0.00 6.67 8.69 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 91 Y 8.12 4.31 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 92 D 8.22 4.13 0.00 2.77 2.60 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 0.00 0.00 0.00 0.00 93 L 7.34 4.45 0.00 1.64 1.66 0.93 0.78 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 94 N 7.44 4.18 0.00 2.84 2.84 0.00 0.00 6.90 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.77 4.61 0.00 2.95 2.85 0.00 0.00 6.42 8.32 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 96 V 7.41 4.51 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 1.27 0.00 0.00 1.05 0.00 0.00 97 D 8.53 4.74 0.00 3.06 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 98 Q 8.80 4.13 0.00 2.38 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.95 0.00 0.00 0.00 0.00 0.00 2.53 2.77 0.00 99 T 7.94 3.88 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 100 D 8.83 4.45 0.00 2.87 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 0.00 101 Y 8.20 4.10 0.00 2.97 2.81 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 0.00 102 N 8.62 4.22 0.00 2.99 2.90 0.00 0.00 7.08 6.97 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 0.00 103 T 8.26 3.94 4.71 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 1.39 0.00 0.00 104 Y 8.30 4.13 0.00 2.99 3.02 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 0.00 105 I 8.10 3.74 1.70 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 0.66 0.29 0.86 0.00 0.00 106 D 8.46 4.29 0.00 2.88 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 0.00 107 F 8.69 4.11 0.00 3.13 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 Y 8.51 3.56 0.00 2.40 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 0.00 109 N 7.96 4.27 0.00 2.69 2.73 0.00 0.00 6.92 7.95 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 0.00 110 N 8.10 4.92 0.00 2.72 2.78 0.00 0.00 6.72 7.24 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 0.00 111 V 6.88 4.01 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 0.94 0.00 0.00 0.96 0.00 0.00 112 V 6.62 3.30 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.23 0.00 0.00 113 L 7.85 3.76 0.00 1.21 1.49 0.77 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 0.00 114 E 7.15 3.93 0.00 2.08 1.84 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 2.24 2.20 0.00 115 N 7.11 4.51 0.00 2.88 2.53 0.00 0.00 6.92 6.89 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 *122 K 8.02 4.35 0.00 1.66 0.74 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.69 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.39 7.81 123 L 8.21 4.03 0.00 1.47 1.38 0.85 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 124 S 7.60 4.20 0.00 3.70 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 8.21 5.17 0.00 3.07 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 0.00 126 D 9.20 4.69 0.00 2.85 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 0.00 127 I 7.68 4.77 1.95 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.64 1.03 0.00 0.00 128 V 8.80 4.44 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 0.37 0.00 0.00 0.60 0.00 0.00 129 I 9.30 4.76 2.10 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.58 1.04 0.00 0.00 130 Y 8.87 5.43 0.00 3.13 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 0.00 131 L 9.01 4.40 0.00 1.57 1.56 0.94 1.18 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 0.00 132 R 7.90 3.66 0.00 0.67 1.22 0.00 2.80 0.00 0.00 3.08 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.37 0.00 133 V 7.90 4.80 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 0.68 0.00 0.00 0.84 0.00 0.00 134 S 9.19 4.37 0.00 3.99 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 0.00 135 T 8.48 3.87 4.29 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 1.33 0.00 0.00 136 K 8.09 3.83 0.00 1.78 1.85 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.55 7.81 137 T 7.62 3.79 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 1.15 0.00 0.00 138 A 7.94 4.01 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 0.00 139 I 8.13 3.35 1.97 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.55 0.92 0.00 0.00 140 S 8.04 4.26 0.00 4.03 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 0.00 141 R 8.11 3.85 0.00 1.92 1.93 0.00 3.33 0.00 0.00 3.06 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 142 I 7.53 3.58 1.72 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.52 0.86 0.00 0.00 143 K 8.09 3.93 0.00 1.80 1.86 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.54 7.81 144 K 7.90 4.00 0.00 1.81 1.96 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.44 7.81 145 R 7.73 4.06 0.00 1.92 2.10 0.00 3.39 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 146 G 8.00 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 0.00 0.00 0.00 147 R 8.05 4.00 0.00 2.04 2.11 0.00 3.30 0.00 0.00 3.47 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.93 0.00 148 S 8.86 4.15 0.00 4.03 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 0.00 149 E 8.16 4.05 0.00 1.84 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 2.29 2.39 0.00 150 E 8.08 3.57 0.00 2.15 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 0.00 2.56 2.68 0.00 151 L 7.59 4.19 0.00 1.84 1.74 1.03 1.02 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 0.00 152 L 7.22 4.10 0.00 1.61 1.65 0.89 0.72 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 0.00 153 I 6.70 3.73 1.39 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 -0.30 0.63 0.00 0.00 154 G 7.96 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 0.00 155 E 8.69 4.28 0.00 2.05 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 2.45 2.36 0.00 156 E 8.24 3.96 0.00 2.18 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 0.00 2.35 2.38 0.00 157 Y 7.51 3.83 0.00 2.87 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 0.00 158 W 7.86 4.67 0.00 3.54 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 E 8.77 4.01 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 160 T 8.02 3.81 4.16 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 1.10 0.00 0.00 161 L 7.75 3.75 0.00 1.46 1.82 0.04 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 162 N 8.37 4.36 0.00 3.07 2.85 0.00 0.00 7.27 6.24 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 0.00 163 K 8.02 4.02 0.00 2.14 1.87 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.61 7.81 164 N 8.29 4.45 0.00 2.91 2.76 0.00 0.00 7.02 6.85 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 0.00 165 Y 8.51 3.79 0.00 3.28 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 0.00 166 E 8.63 4.23 0.00 2.39 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 0.00 2.44 2.53 0.00 167 E 8.44 3.98 0.00 2.31 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 2.34 2.39 0.00 168 F 8.41 4.02 0.00 3.27 3.23 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 0.00 169 Y 8.11 3.61 0.00 2.57 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 0.00 170 K 7.81 3.45 0.00 1.84 1.73 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.25 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.74 7.81 171 Q 7.85 4.09 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.88 0.00 0.00 0.00 0.00 0.00 2.34 2.63 0.00 172 N 7.39 5.06 0.00 2.63 3.12 0.00 0.00 6.59 7.60 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 0.00 173 V 6.93 3.20 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 -0.35 0.00 0.00 0.43 0.00 0.00 174 Y 7.47 4.51 0.00 3.02 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 0.00 175 D 8.05 4.71 0.00 2.41 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 F 7.73 4.91 0.00 2.55 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 0.00 177 P 0.00 4.82 0.00 2.21 2.30 0.00 3.88 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.16 0.00 178 F 8.25 4.88 0.00 3.15 3.23 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 0.00 179 F 9.41 5.02 0.00 3.14 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 0.00 180 V 8.29 4.15 1.89 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 0.42 0.00 0.00 0.71 0.00 0.00 181 V 8.24 4.01 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 0.81 0.00 0.00 0.64 0.00 0.00 182 D 8.56 4.30 0.00 2.65 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 0.00 183 A 8.68 4.50 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 0.00 184 E 8.47 4.01 0.00 2.04 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 2.35 2.37 0.00 185 L 7.23 4.10 0.00 1.65 1.59 0.92 1.02 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 0.00 186 D 8.30 4.60 0.00 2.93 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 0.00 187 V 8.30 3.57 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.91 0.00 0.00 188 K 8.09 3.92 0.00 1.83 1.85 0.00 1.71 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.54 7.81 189 T 7.69 3.85 4.39 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 1.21 0.00 0.00 190 Q 8.03 4.01 0.00 2.27 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.60 0.00 191 I 8.11 3.72 1.96 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 0.85 0.91 0.00 0.00 192 E 8.23 3.93 0.00 2.16 2.17 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 2.32 2.36 0.00 193 L 8.35 4.12 0.00 1.97 1.92 0.94 0.82 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 0.00 194 I 8.17 3.95 2.14 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.94 0.98 0.00 0.00 195 M 8.49 4.05 0.00 1.96 2.11 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.89 0.00 196 N 8.24 4.27 0.00 2.90 2.87 0.00 0.00 6.68 6.48 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 0.00 197 K 7.59 3.68 0.00 1.04 1.38 0.00 1.38 0.00 0.00 1.08 0.00 0.00 2.90 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 0.99 7.81 198 L 8.11 4.09 0.00 1.80 1.69 0.92 0.60 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 0.00 199 N 8.24 4.40 0.00 2.70 2.87 0.00 0.00 7.13 7.56 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 0.00 200 S 7.81 4.33 0.00 3.98 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 I 7.33 4.07 1.88 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 1.36 0.76 0.93 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.