NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4844 8.1927 115.4154 57.7402 64.7240 174.1442 3 L 3.1971 8.3422 120.7935 57.3420 41.7303 177.0487 4 R 3.2395 7.7548 118.5054 59.2887 30.3546 178.0331 5 S 3.9851 8.3816 114.4083 61.4344 63.0816 176.1371 6 D 4.2790 8.3381 122.8926 56.8124 40.4502 178.5222 7 L 3.8364 8.0700 121.1827 58.2491 42.0667 179.1101 8 I 3.3053 7.4025 119.6790 64.2423 36.8723 178.2110 9 N 4.2778 8.1531 117.2121 56.2738 38.2763 177.3881 10 A 4.0184 8.0465 122.1698 54.9141 18.3972 179.7829 11 L 3.9409 8.1904 118.0260 58.0530 41.8384 179.0572 12 Y 4.4501 8.0406 116.9093 61.4561 37.8627 178.6933 13 D 4.4254 8.4147 119.5402 57.3320 40.9966 178.3777 14 E 4.1149 8.5466 120.0629 59.6189 29.4565 178.3585 15 N 4.7350 8.4795 115.5583 57.0343 39.0048 176.4880 16 Q 4.1899 7.8740 118.4674 58.7881 28.9174 178.2993 17 K 3.8813 7.9945 118.6774 57.4922 32.5091 177.0772 18 Y 4.9147 7.7110 115.1036 56.0750 40.7168 174.9188 19 D 4.9645 8.7096 123.0316 52.2337 42.5328 176.1870 20 V 3.8602 7.8993 124.1189 63.0097 31.9057 175.5394 21 C 4.7031 8.3444 118.5993 56.9977 30.9579 172.9736 22 G 4.1195 7.2727 106.1011 46.3811 0.0000 172.2021 23 I 4.7239 8.4488 113.6087 58.9887 39.9839 174.6816 24 I 5.1423 8.4292 124.8390 59.3775 40.5845 174.6743 25 S 4.8711 9.0800 122.7387 56.6072 65.1066 175.0714 26 A 3.9702 8.7076 123.1946 55.1107 18.1896 178.5084 27 E 4.1722 8.1518 113.0297 57.0068 29.8776 177.4445 28 G 3.9577 8.3842 108.1876 44.5836 0.0000 173.4094 29 K 4.2499 7.9042 121.7607 55.8439 33.6802 175.4182 30 I 5.0887 8.4612 127.6694 59.8059 40.1196 173.9403 31 Y 4.9984 9.1846 124.7913 55.3366 40.0984 174.0253 32 P 4.7872 0.0000 0.0000 62.6290 32.5113 175.9768 33 L 4.3110 8.3817 120.3598 54.1216 42.5776 177.2126 34 G 3.9956 8.2734 110.6446 44.7963 0.0000 173.9002 35 S 4.4763 8.3111 113.1680 58.7046 64.1367 174.9453 36 D 4.6096 7.7152 121.8741 53.0935 41.3778 176.7426 37 T 4.0145 8.5657 116.7295 65.9499 67.1874 176.6814 38 K 3.8262 8.1483 125.1764 59.8463 31.5971 181.3409 39 V 3.6677 7.6078 118.6727 65.9520 31.5878 178.0326 40 L 3.4248 7.7100 118.9689 57.5243 41.3544 179.7336 41 S 4.2526 8.8087 115.0178 61.7484 62.9613 176.6627 42 T 3.8216 7.6425 119.1783 66.4336 68.1213 176.6938 43 I 3.5730 7.5365 121.5873 64.3693 37.0496 178.6201 44 F 4.0723 7.7126 118.8790 60.1901 38.3023 177.7130 45 E 4.1304 7.9763 117.7581 59.5364 29.3968 179.0383 46 L 4.2165 8.0544 119.0272 57.7232 41.4399 179.1854 47 F 4.2215 8.4215 120.1343 61.6652 39.5234 177.1104 48 S 4.3263 8.4330 114.4872 60.9275 62.6703 176.5440 49 R 3.7521 7.7366 121.1669 59.0895 29.8466 177.1710 50 P 4.2160 0.0000 0.0000 65.3753 31.2952 178.6869 51 I 3.5677 7.4826 118.1293 64.4291 37.0345 178.0971 52 I 3.5067 7.5888 120.4988 64.5188 36.8274 178.0491 53 N 4.2190 8.0130 117.5632 56.4167 38.8909 176.7676 54 K 3.8812 8.1620 121.1784 59.7210 32.1855 178.9288 55 I 3.7906 7.9521 119.9117 64.1026 36.9867 178.2645 56 A 4.0015 8.2441 121.9831 55.1901 18.2286 179.4754 57 E 3.9153 8.4650 117.3429 59.4989 29.3281 179.4105 58 K 3.9236 7.7788 118.1503 59.5850 32.2968 177.5344 59 H 4.7408 7.9769 113.3822 55.2027 28.8652 175.7586 60 G 3.8368 7.9747 108.7818 46.2542 0.0000 172.9152 61 Y 4.6073 8.4624 116.8232 56.1116 39.5996 175.9666 62 I 3.9320 8.3746 124.6776 61.1033 38.6641 175.0334 63 V 4.9816 8.2355 124.6423 61.2241 34.0899 174.4842 64 E 4.8694 9.5699 126.8097 54.7999 33.2875 174.9174 65 E 4.9738 8.6920 122.8045 53.3355 31.7889 174.3015 66 P 4.3642 0.0000 0.0000 63.1592 32.2214 177.7719 67 K 4.0639 8.6427 125.4109 57.5334 32.2705 178.3853 68 Q 4.4046 7.6455 119.0952 53.4570 28.7068 178.5390 69 Q 4.1065 8.8074 123.1847 57.3078 28.9119 176.9379 70 N 5.0096 8.0312 114.0881 52.8017 37.9312 173.8282 71 H 5.1004 7.7312 115.9242 54.9969 31.1788 173.7056 72 Y 4.5128 8.8663 125.8253 56.8435 40.1247 172.5955 73 P 4.2791 0.0000 0.0000 60.6520 33.2275 174.8650 74 D 4.1901 8.3439 119.1711 56.7798 41.9555 176.9163 75 F 5.1515 8.1769 116.6096 56.0150 43.3963 174.0219 76 T 5.1587 9.3905 120.8817 61.8842 70.8544 173.3832 77 L 5.9232 9.1302 126.6029 52.4266 45.0328 175.1584 78 Y 5.2112 7.8916 118.8535 56.0129 41.4011 173.7057 79 K 4.1376 8.3055 121.2564 54.7384 33.0729 176.4321 80 P 4.5317 0.0000 0.0000 65.5883 31.0974 177.4370 81 S 4.3183 7.8593 111.6916 59.7370 64.1901 173.8139 82 E 4.6861 8.3007 120.9266 54.0296 29.7039 174.5351 83 P 3.9063 0.0000 0.0000 65.5054 32.0120 177.6469 84 N 4.5353 7.8905 112.8520 53.2777 39.0072 175.3799 85 K 4.6449 7.7280 116.7679 54.9996 31.1228 176.1903 86 K 4.5112 8.4324 121.9332 55.9733 34.4347 177.6379 87 I 4.7397 8.7357 123.2415 59.4518 40.0710 174.3879 88 A 5.1007 8.6691 128.7612 50.3170 21.6386 175.6081 89 I 5.0798 8.7494 122.2935 59.5530 40.9769 174.1729 90 D 5.4576 9.3494 126.1439 52.5191 44.6552 174.2858 91 I 5.1627 8.3200 123.3776 59.6113 39.3549 175.0543 92 A 5.0201 9.2831 127.9891 50.5819 22.4301 174.9510 93 T 5.5770 8.7407 116.2568 62.7195 73.1058 172.7281 94 T 4.6821 8.7076 117.2183 61.6332 71.4730 171.3086 95 Y 4.5369 8.0184 121.5037 55.0231 41.3181 174.3535 96 T 4.2697 8.5973 113.5948 60.6735 70.9041 173.8547 97 N 4.6428 9.4367 122.1650 53.8059 40.1105 175.3380 *101 E 4.1033 7.8648 117.5644 55.3831 30.5736 175.2428 102 K 4.4131 8.3450 124.9016 56.6506 33.0899 175.9733 103 I 4.7443 9.3371 118.4599 60.1249 41.5713 174.5496 104 K 5.3961 8.1179 124.1797 53.9138 35.8319 175.7145 105 F 5.0664 9.7510 120.3810 55.8136 43.0884 174.2684 106 T 4.8436 8.6746 110.9410 60.5236 70.1417 174.5379 107 L 4.7283 9.2045 125.2342 54.6586 43.0201 176.9822 108 G 3.9307 8.7004 105.4744 44.5049 0.0000 174.1067 109 G 3.7142 8.0790 107.7923 45.5050 0.0000 173.3530 110 Y 4.4319 7.9047 118.7418 56.6493 38.6233 176.8069 111 T 4.6789 7.3599 109.1854 61.5248 71.0853 173.9237 112 S 4.5246 7.2376 117.0379 58.1437 60.8684 177.4225 113 F 4.3039 8.7877 118.4782 59.3003 37.7255 177.2504 114 I 3.0587 6.2679 113.5636 62.5287 37.6216 176.7735 115 R 4.2237 7.0749 121.9235 57.7468 31.1701 176.6758 116 N 4.8459 8.1611 115.3060 50.4469 38.8761 177.7009 117 N 4.4511 7.2443 123.6217 55.0092 40.7831 175.5512 118 T 4.5877 8.1385 105.1192 60.7646 70.2199 173.9182 119 K 4.0093 8.2125 124.3501 57.4154 32.5938 175.8928 120 N 3.7620 8.8370 124.7784 54.1493 36.2881 173.5859 121 I 4.9588 7.4062 115.0077 58.8736 41.4342 174.6227 122 V 3.6984 8.7821 127.8879 65.5689 31.5123 175.7680 123 Y 4.8006 7.7584 114.0279 54.9106 41.5027 173.4420 124 P 4.6156 0.0000 0.0000 62.9457 32.2988 177.1879 125 F 4.4458 9.6411 125.3777 61.6925 39.3195 176.8021 126 D 4.5686 8.4444 117.7812 55.1159 39.3371 176.8034 127 Q 4.1219 8.3436 119.1653 56.7427 29.2852 174.7304 128 Y 4.7521 7.6724 116.9249 56.7617 38.9648 175.3286 129 I 4.4685 8.5405 116.8353 60.7250 38.7078 175.1646 130 A 4.6674 7.3518 123.1084 51.5277 22.8166 175.3847 131 H 5.0668 8.8932 116.7245 54.1682 32.3261 172.2898 132 W 5.5556 9.6141 124.4268 55.0438 32.0954 175.3471 133 I 4.9252 9.0267 124.3259 59.7243 39.5763 174.5792 134 I 4.4915 9.0522 128.5519 59.6877 38.9277 174.7238 135 G 3.1051 7.6367 115.4848 43.9650 0.0000 171.3092 136 Y 4.9836 8.8070 122.3971 56.0527 41.0195 175.2271 137 V 5.4564 9.1876 116.9591 58.7190 35.7054 174.3045 138 Y 5.3289 7.8125 120.8486 55.9199 42.2824 173.5124 139 T 5.4829 8.5288 116.4117 61.4566 70.4486 174.2950 140 R 4.6024 8.8086 127.4058 56.3584 31.2015 176.3922 141 V 3.9862 8.1674 119.2424 60.8946 31.7471 176.1883 142 A 4.3508 8.3039 128.6493 49.8816 19.3942 174.4943 *147 S 4.2997 8.0889 113.9922 58.6356 63.4673 173.4889 148 L 4.6937 8.5519 126.5068 55.1360 41.9876 176.5892 149 K 4.7474 7.5423 120.8121 53.5567 35.5393 178.0068 150 T 4.5685 7.9120 107.8206 61.6581 71.3712 172.9000 151 Y 5.0327 8.6779 119.5007 56.4051 43.0842 173.6644 152 N 5.3477 9.5503 117.4151 50.8379 40.3005 175.8146 153 I 3.8881 8.7741 122.3584 65.0562 37.1887 177.7192 154 N 4.6300 8.6064 115.5390 53.3200 37.8921 179.9812 155 E 4.7062 8.5575 116.4784 56.9019 30.2132 177.6129 156 L 3.8519 8.0160 122.1035 58.0718 41.6386 178.4403 157 N 4.6266 7.9993 113.4484 54.5560 39.1547 174.8396 158 E 4.2845 8.0372 116.3309 57.7772 30.3822 176.4932 159 I 3.2024 6.7746 119.6275 59.6985 37.2690 174.1479 160 P 4.2116 0.0000 0.0000 62.6351 31.7263 175.7455 161 K 4.1971 8.2147 122.0895 54.6164 32.9311 174.8250 162 P 4.8458 0.0000 0.0000 63.1494 32.2390 174.7284 163 Y 4.9286 7.1128 117.0905 56.5301 40.9122 173.1803 164 K 4.3313 9.7332 118.9142 57.3670 33.8480 177.0178 165 G 4.1264 8.0075 113.9410 44.0830 0.0000 170.7775 166 V 4.3251 8.3630 126.1654 62.5423 32.6842 175.0687 167 K 4.8262 9.2457 126.0315 54.5236 36.0984 175.5961 168 V 4.8049 8.4876 121.8381 60.0126 34.5681 174.3682 169 F 5.1083 8.3036 116.5605 55.4337 41.9535 172.6936 170 L 5.1927 8.3956 120.8213 53.4394 44.4297 175.1311 171 Q 4.5060 9.0055 125.8063 54.4531 33.1670 173.4831 172 D 5.0598 8.8075 123.9267 53.8835 41.4069 177.4756 173 K 3.8672 9.4470 125.6518 59.6794 31.9346 179.3118 174 W 2.8724 7.8852 114.8226 58.9891 28.4112 177.9611 175 V 2.7166 6.4331 119.1908 64.7715 30.8267 177.0766 176 I 4.0379 7.1416 109.6851 59.7645 38.1767 175.1719 177 A 4.4585 7.0883 124.0484 52.4763 19.1650 177.9669 178 G 4.4487 8.9836 112.2309 44.4420 0.0000 173.3529 179 D 4.6108 8.7751 120.5808 52.6959 40.9168 175.6369 180 L 5.1486 8.0528 119.4473 52.7268 45.0113 175.4443 181 A 4.5352 9.1269 125.1165 53.0388 18.3707 177.8232 182 G 4.0455 9.4345 109.1361 47.7328 0.0000 173.6074 183 S 4.3513 8.0180 113.1456 57.9814 65.5831 173.2606 184 G 3.8453 8.9934 108.9169 47.1388 0.0000 175.3811 185 N 4.3320 8.2270 122.5075 54.3579 38.0198 176.3053 186 T 4.2359 7.6721 107.6834 61.2964 69.7821 175.3659 187 T 3.3694 7.5433 110.5942 62.7856 67.8715 170.9448 188 N 5.2274 8.1250 123.3794 52.2706 41.6653 176.4944 189 I 2.5340 8.7443 123.7286 61.0797 38.3857 175.3328 190 G 4.9729 8.1173 113.0272 44.0132 0.0000 173.5950 191 S 5.2541 8.6684 118.6234 56.9005 65.1249 173.5459 192 I 4.0046 8.4488 113.9464 61.3649 38.3442 175.4227 193 H 5.1688 8.6218 122.7363 55.2495 31.0599 172.5045 194 A 4.5011 8.7737 127.2594 51.4096 23.2709 174.6602 195 H 4.7491 8.6866 114.5312 55.5222 30.0168 176.0626 196 Y 4.5447 9.2826 125.7345 62.0373 38.3297 179.5357 197 K 3.8238 8.4340 123.6811 60.1576 31.5585 180.2812 198 D 4.3765 8.1391 119.5800 57.2629 40.5117 179.0178 199 F 3.5556 7.8446 118.1917 60.0084 38.5369 177.9342 200 V 3.2577 7.0506 116.8220 65.8867 31.3120 176.5697 201 E 4.0473 8.1636 116.3155 56.1038 29.6536 176.4342 202 G 3.5657 7.0991 106.8795 46.6035 0.0000 175.6926 203 K 4.1478 7.8259 120.5468 54.6768 31.0805 177.8847 204 G 4.3424 7.7567 112.6491 43.4140 0.0000 170.4426 205 I 4.3179 7.9833 110.1141 60.5528 39.5366 175.8992 206 F 4.5995 7.9235 119.4730 57.1965 39.5365 175.4006 207 D 4.6947 9.8407 124.8060 56.7620 41.1944 176.7253 208 S 3.9079 7.6205 112.5625 56.2331 66.5445 175.2729 209 E 3.3682 7.0180 121.6429 58.7486 29.1165 177.8055 210 D 4.2921 7.7537 117.7965 57.3231 41.3285 177.7443 211 E 4.0355 8.3271 119.7635 59.2205 29.6552 178.4392 212 F 2.3000 7.9486 120.5639 60.7546 39.3301 177.0996 213 L 3.2237 7.9540 118.7031 57.6474 41.2177 179.0236 214 D 4.3467 7.9615 116.8051 57.3057 40.9959 177.3583 215 Y 3.2841 8.0109 120.3220 60.3969 38.5778 178.3148 216 W 3.9562 7.6688 118.0404 59.3047 29.1608 178.6005 217 R 4.1084 8.1896 117.8200 58.0654 29.4745 177.0419 218 N 4.7526 7.2733 113.0547 52.6488 39.4315 173.6750 219 Y 3.2206 7.4885 120.6301 56.6748 39.0426 175.2309 220 E 4.0364 7.3284 126.8390 55.9636 30.2556 177.4834 221 R 4.5147 8.7630 120.2221 58.1551 30.6116 177.3882 222 T 4.7589 7.3456 106.7086 58.8924 73.1580 174.8836 223 S 3.9824 8.4530 117.3898 61.8001 62.6595 176.5588 224 Q 3.9712 8.1406 122.6364 60.0913 28.9163 178.8952 225 L 4.0786 7.4378 121.6266 59.4292 40.8149 181.2295 226 R 3.7278 7.9300 118.4930 59.0220 29.6627 178.7830 227 N 4.3144 8.1771 115.8206 55.6306 38.4919 175.4371 228 D 4.7366 7.3903 118.0157 53.8841 40.4785 176.5729 229 K 4.5044 7.3044 119.6939 55.5993 35.9388 174.9727 230 Y 4.8747 6.4563 115.7593 56.6353 40.2904 173.9825 231 N 4.8928 9.4930 118.1907 52.7532 40.6511 174.0632 232 N 5.2150 7.8581 116.6350 51.2584 41.3854 174.7182 233 I 3.7492 9.1411 120.4965 64.3161 37.7651 177.9801 234 S 4.1611 8.1289 115.5978 61.7503 62.7033 176.3679 235 E 4.1220 8.9770 121.5625 59.4118 29.1524 178.8304 236 Y 3.4710 8.2389 119.8327 60.5978 38.8316 178.2202 237 R 3.7795 8.4756 119.2529 59.0455 30.0043 178.6019 238 N 4.4474 8.2822 117.2204 56.3067 38.9597 176.7571 239 W 4.1755 8.4540 130.1689 60.3764 30.7192 178.0900 240 I 3.2191 7.7414 119.8060 64.3499 36.3350 177.5118 241 Y 4.0416 7.6185 118.8611 60.9356 38.6842 178.2906 242 R 3.6486 7.8302 116.7841 57.1074 30.0991 177.3183 243 G 3.6037 7.2458 107.3526 45.4044 0.0000 173.6548 244 R 2.0000 6.9028 114.1491 54.8874 27.6610 176.8145 245 K 4.1710 6.8688 120.4298 57.5999 31.9336 175.3170 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 S 8.19 4.48 0.00 4.03 4.11 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 3 L 8.34 3.20 0.00 1.66 1.70 0.75 -0.26 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 4 R 7.75 3.24 0.00 1.37 1.63 0.00 2.75 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.50 0.00 5 S 8.38 3.99 0.00 3.96 4.01 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 6 D 8.34 4.28 0.00 2.90 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 7 L 8.07 3.84 0.00 1.75 1.60 0.83 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 8 I 7.40 3.31 1.45 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.38 -0.06 0.00 0.00 9 N 8.15 4.28 0.00 2.86 2.87 0.00 0.00 6.92 6.80 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 10 A 8.05 4.02 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.19 3.94 0.00 1.50 1.67 0.78 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 8.04 4.45 0.00 3.13 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 13 D 8.41 4.43 0.00 2.83 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.55 4.11 0.00 2.20 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 2.21 0.00 15 N 8.48 4.73 0.00 3.14 3.20 0.00 0.00 7.35 6.59 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 16 Q 7.87 4.19 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.77 0.00 0.00 0.00 0.00 0.00 2.68 2.55 0.00 17 K 7.99 3.88 0.00 1.54 0.78 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.47 1.35 7.81 18 Y 7.71 4.91 0.00 3.43 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 19 D 8.71 4.96 0.00 2.72 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 20 V 7.90 3.86 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 0.72 0.00 0.00 0.83 0.00 0.00 21 C 8.34 4.70 0.00 2.95 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 22 G 7.27 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 23 I 8.45 4.72 1.89 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 1.33 1.22 0.91 0.00 0.00 24 I 8.43 5.14 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.15 0.94 0.00 0.00 25 S 9.08 4.87 0.00 4.14 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.71 3.97 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 27 E 8.15 4.17 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 28 G 8.38 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.90 4.25 0.00 1.85 1.71 0.00 1.54 0.00 0.00 1.55 0.00 0.00 2.54 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.73 1.17 7.81 30 I 8.46 5.09 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 1.27 0.56 1.00 0.00 0.00 31 Y 9.18 5.00 0.00 2.90 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 32 P 0.00 4.79 0.00 2.15 2.21 0.00 3.91 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 2.16 2.37 0.00 33 L 8.38 4.31 0.00 1.62 1.58 0.93 0.83 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 34 G 8.27 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 35 S 8.31 4.48 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 D 7.72 4.61 0.00 2.88 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.57 4.01 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 1.26 0.00 0.00 38 K 8.15 3.83 0.00 1.80 1.82 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.45 1.08 7.81 39 V 7.61 3.67 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 0.99 0.00 0.00 0.95 0.00 0.00 40 L 7.71 3.42 0.00 1.60 1.25 0.23 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.81 4.25 0.00 4.11 4.28 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 42 T 7.64 3.82 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 43 I 7.54 3.57 1.22 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.40 0.44 0.00 0.00 44 F 7.71 4.07 0.00 2.72 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 7.98 4.13 0.00 2.18 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 2.49 2.71 0.00 46 L 8.05 4.22 0.00 1.87 1.75 0.91 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 47 F 8.42 4.22 0.00 3.00 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 48 S 8.43 4.33 0.00 4.23 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 49 R 7.74 3.75 0.00 1.89 2.12 0.00 3.26 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.16 0.00 50 P 0.00 4.22 0.00 2.01 2.01 0.00 3.65 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 51 I 7.48 3.57 1.88 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.35 0.83 0.00 0.00 52 I 7.59 3.51 1.41 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.49 0.46 0.00 0.00 53 N 8.01 4.22 0.00 2.94 2.77 0.00 0.00 6.92 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 8.16 3.88 0.00 1.87 1.94 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.46 7.81 55 I 7.95 3.79 1.83 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 1.62 1.36 0.90 0.00 0.00 56 A 8.24 4.00 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 57 E 8.46 3.92 0.00 2.17 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 2.32 2.55 0.00 58 K 7.78 3.92 0.00 1.79 2.05 0.00 1.71 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.45 7.81 59 H 7.98 4.74 0.00 3.29 3.62 0.00 5.77 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 G 7.97 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 Y 8.46 4.61 0.00 2.84 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 62 I 8.37 3.93 0.89 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 0.92 0.58 0.66 0.00 0.00 63 V 8.24 4.98 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 1.03 0.00 0.00 0.93 0.00 0.00 64 E 9.57 4.87 0.00 2.15 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 2.35 2.41 0.00 65 E 8.69 4.97 0.00 1.81 1.72 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 2.14 2.23 0.00 66 P 0.00 4.36 0.00 2.10 1.94 0.00 3.52 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.14 0.00 67 K 8.64 4.06 0.00 1.77 1.71 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.34 1.00 7.81 68 Q 7.65 4.40 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.85 0.00 0.00 0.00 0.00 0.00 2.33 1.94 0.00 69 Q 8.81 4.11 0.00 2.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 7.51 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 70 N 8.03 5.01 0.00 2.84 2.91 0.00 0.00 5.87 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 H 7.73 5.10 0.00 3.21 3.25 0.00 5.84 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 8.87 4.51 0.00 3.10 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 73 P 0.00 4.28 0.00 1.68 0.49 0.00 3.69 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.58 0.00 74 D 8.34 4.19 0.00 2.56 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 75 F 8.18 5.15 0.00 2.97 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 76 T 9.39 5.16 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 77 L 9.13 5.92 0.00 1.47 1.51 0.95 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 78 Y 7.89 5.21 0.00 2.89 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 79 K 8.31 4.14 0.00 1.54 1.48 0.00 1.36 0.00 0.00 1.34 0.00 0.00 2.66 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.70 0.21 7.81 80 P 0.00 4.53 0.00 2.16 2.19 0.00 3.56 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.88 0.00 81 S 7.86 4.32 0.00 3.96 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 82 E 8.30 4.69 0.00 1.88 1.81 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 2.17 2.19 0.00 83 P 0.00 3.91 0.00 1.85 1.81 0.00 3.60 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.21 0.00 84 N 7.89 4.54 0.00 2.60 2.74 0.00 0.00 6.69 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 7.73 4.64 0.00 1.67 1.71 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.33 7.81 86 K 8.43 4.51 0.00 0.79 1.22 0.00 0.61 0.00 0.00 0.71 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 1.03 7.81 87 I 8.74 4.74 1.48 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.73 -0.47 0.00 0.00 88 A 8.67 5.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.75 5.08 2.11 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 1.21 1.12 1.09 0.00 0.00 90 D 9.35 5.46 0.00 2.92 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 I 8.32 5.16 2.06 0.00 0.00 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 1.40 1.06 1.26 0.00 0.00 92 A 9.28 5.02 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 93 T 8.74 5.58 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 1.86 0.00 0.00 94 T 8.71 4.68 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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8.67 4.84 4.54 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 1.30 0.00 0.00 107 L 9.20 4.73 0.00 1.41 1.70 0.98 1.28 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 0.00 108 G 8.70 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 0.00 109 G 8.08 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 Y 7.90 4.43 0.00 3.40 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 0.00 111 T 7.36 4.68 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 0.93 0.00 0.00 112 S 7.24 4.52 0.00 4.15 3.20 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 0.00 113 F 8.79 4.30 0.00 3.28 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 I 6.27 3.06 1.42 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 0.94 0.33 0.15 0.00 0.00 115 R 7.07 4.22 0.00 2.01 1.97 0.00 3.10 0.00 0.00 3.26 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 116 N 8.16 4.85 0.00 2.57 2.65 0.00 0.00 6.69 7.67 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 0.00 117 N 7.24 4.45 0.00 2.95 2.96 0.00 0.00 6.59 7.22 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 0.00 118 T 8.14 4.59 4.30 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 1.29 0.00 0.00 119 K 8.21 4.01 0.00 1.74 1.79 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.53 7.81 120 N 8.84 3.76 0.00 3.05 3.00 0.00 0.00 6.48 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 I 7.41 4.96 1.61 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.95 1.08 0.00 0.00 122 V 8.78 3.70 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.94 0.00 0.00 123 Y 7.76 4.80 0.00 2.93 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 0.00 124 P 0.00 4.62 0.00 2.40 2.11 0.00 3.95 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.18 0.00 125 F 9.64 4.45 0.00 3.24 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 8.44 4.57 0.00 2.88 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 0.00 127 Q 8.34 4.12 0.00 1.94 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.89 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 128 Y 7.67 4.75 0.00 2.85 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 I 8.54 4.47 1.88 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 1.15 0.50 0.88 0.00 0.00 130 A 7.35 4.67 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 0.00 131 H 8.89 5.07 0.00 3.29 3.49 0.00 5.59 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 W 9.61 5.56 0.00 3.25 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 0.00 133 I 9.03 4.93 1.97 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 1.33 1.32 0.81 0.00 0.00 134 I 9.05 4.49 1.90 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 1.07 0.73 0.63 0.00 0.00 135 G 7.64 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 0.00 0.00 0.00 136 Y 8.81 4.98 0.00 2.71 2.23 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 0.00 137 V 9.19 5.46 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 1.26 0.00 0.00 0.91 0.00 0.00 138 Y 7.81 5.33 0.00 3.16 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 0.00 139 T 8.53 5.48 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 1.31 0.00 0.00 140 R 8.81 4.60 0.00 2.25 1.95 0.00 3.34 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.23 0.00 141 V 8.17 3.99 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 0.71 0.00 0.00 0.98 0.00 0.00 142 A 8.30 4.35 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 *147 S 8.09 4.30 0.00 3.99 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 0.00 148 L 8.55 4.69 0.00 1.63 1.63 0.94 0.78 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 0.00 149 K 7.54 4.75 0.00 1.51 1.55 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.27 1.21 7.81 150 T 7.91 4.57 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 0.81 0.00 0.00 151 Y 8.68 5.03 0.00 2.89 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 0.00 152 N 9.55 5.35 0.00 2.76 2.89 0.00 0.00 7.41 7.93 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 0.00 153 I 8.77 3.89 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 1.29 0.55 0.92 0.00 0.00 154 N 8.61 4.63 0.00 2.73 2.72 0.00 0.00 6.90 8.24 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 0.00 155 E 8.56 4.71 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.47 0.00 156 L 8.02 3.85 0.00 1.69 1.71 0.94 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 157 N 8.00 4.63 0.00 2.66 2.80 0.00 0.00 6.92 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 0.00 158 E 8.04 4.28 0.00 2.13 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 2.29 2.25 0.00 159 I 6.77 3.20 1.55 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 -0.30 -0.07 0.64 0.00 0.00 160 P 0.00 4.21 0.00 2.12 2.03 0.00 3.58 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.02 0.00 161 K 8.21 4.20 0.00 1.31 0.84 0.00 1.41 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.24 1.31 7.81 162 P 0.00 4.85 0.00 2.12 2.23 0.00 3.55 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.07 0.00 163 Y 7.11 4.93 0.00 3.09 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 K 9.73 4.33 0.00 1.98 1.88 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.73 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.37 1.37 7.81 165 G 8.01 4.13 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 0.00 166 V 8.36 4.33 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 0.52 0.00 0.00 0.78 0.00 0.00 167 K 9.25 4.83 0.00 1.17 0.96 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.64 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.03 1.06 7.81 168 V 8.49 4.80 1.60 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 0.94 0.00 0.00 0.14 0.00 0.00 169 F 8.30 5.11 0.00 2.95 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 0.00 170 L 8.40 5.19 0.00 1.38 1.24 0.70 -0.09 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 0.00 171 Q 9.01 4.51 0.00 2.04 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.77 0.00 0.00 0.00 0.00 0.00 2.08 2.15 0.00 172 D 8.81 5.06 0.00 2.41 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 0.00 173 K 9.45 3.87 0.00 2.02 1.93 0.00 1.85 0.00 0.00 1.92 0.00 0.00 3.21 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.36 1.51 7.81 174 W 7.89 2.87 0.00 3.21 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 V 6.43 2.72 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 -0.63 0.00 0.00 176 I 7.14 4.04 1.99 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 1.70 0.61 0.70 0.00 0.00 177 A 7.09 4.46 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 G 8.98 4.45 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 0.00 179 D 8.78 4.61 0.00 2.40 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 0.00 0.00 0.00 180 L 8.05 5.15 0.00 1.75 1.76 1.01 1.19 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 0.00 181 A 9.13 4.54 1.70 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 0.00 0.00 182 G 9.43 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 0.00 0.00 0.00 183 S 8.02 4.35 0.00 3.88 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 0.00 184 G 8.99 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 0.00 185 N 8.23 4.33 0.00 2.83 2.99 0.00 0.00 5.86 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 T 7.67 4.24 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 187 T 7.54 3.37 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 1.15 0.00 0.00 188 N 8.12 5.23 0.00 2.73 2.74 0.00 0.00 7.08 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 0.00 189 I 8.74 2.53 1.50 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 -0.11 0.50 0.20 0.00 0.00 190 G 8.12 4.97 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 0.00 191 S 8.67 5.25 0.00 4.48 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 I 8.45 4.00 1.70 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 0.95 0.04 0.87 0.00 0.00 193 H 8.62 5.17 0.00 3.19 3.25 0.00 5.77 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 A 8.77 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 H 8.69 4.75 0.00 3.24 3.30 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 Y 9.28 4.54 0.00 3.15 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 0.00 197 K 8.43 3.82 0.00 1.80 1.82 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.45 1.12 7.81 198 D 8.14 4.38 0.00 2.81 2.36 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 0.00 199 F 7.84 3.56 0.00 2.21 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 V 7.05 3.26 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 0.76 0.00 0.00 0.36 0.00 0.00 201 E 8.16 4.05 0.00 1.90 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 2.24 2.30 0.00 202 G 7.10 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 K 7.83 4.15 0.00 1.81 1.64 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.43 1.25 7.81 204 G 7.76 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 I 7.98 4.32 1.55 0.00 0.00 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.75 0.00 0.00 206 F 7.92 4.60 0.00 3.57 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 D 9.84 4.69 0.00 2.84 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 0.00 208 S 7.62 3.91 0.00 3.73 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 0.00 209 E 7.02 3.37 0.00 1.16 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 2.39 2.45 0.00 210 D 7.75 4.29 0.00 2.79 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 E 8.33 4.04 0.00 2.25 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.75 0.00 212 F 7.95 2.30 0.00 2.53 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 0.00 213 L 7.95 3.22 0.00 1.80 1.61 1.18 1.04 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 0.00 214 D 7.96 4.35 0.00 2.84 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 0.00 215 Y 8.01 3.28 0.00 2.35 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 0.00 216 W 7.67 3.96 0.00 2.90 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 0.00 217 R 8.19 4.11 0.00 1.95 1.99 0.00 3.09 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 218 N 7.27 4.75 0.00 2.73 2.42 0.00 0.00 6.95 7.12 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 0.00 219 Y 7.49 3.22 0.00 2.25 2.27 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 0.00 220 E 7.33 4.04 0.00 1.50 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.09 0.00 221 R 8.76 4.51 0.00 1.83 2.07 0.00 3.21 0.00 0.00 2.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.72 0.00 222 T 7.35 4.76 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 223 S 8.45 3.98 0.00 3.87 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 0.00 224 Q 8.14 3.97 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 7.09 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 225 L 7.44 4.08 0.00 1.75 1.66 0.92 0.93 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 0.00 226 R 7.93 3.73 0.00 1.73 1.85 0.00 2.21 0.00 0.00 2.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.45 0.00 227 N 8.18 4.31 0.00 2.89 2.86 0.00 0.00 6.99 8.59 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 0.00 228 D 7.39 4.74 0.00 2.69 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 K 7.30 4.50 0.00 1.34 0.97 0.00 1.60 0.00 0.00 1.07 0.00 0.00 2.17 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.61 1.24 7.81 230 Y 6.46 4.87 0.00 3.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 N 9.49 4.89 0.00 2.87 2.89 0.00 0.00 6.76 7.94 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 0.00 232 N 7.86 5.21 0.00 3.19 2.98 0.00 0.00 6.36 7.78 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 0.00 233 I 9.14 3.75 1.39 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 1.19 1.43 0.77 0.00 0.00 234 S 8.13 4.16 0.00 4.11 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 0.00 235 E 8.98 4.12 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.67 0.00 236 Y 8.24 3.47 0.00 1.97 3.12 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 0.00 237 R 8.48 3.78 0.00 2.07 2.00 0.00 3.25 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.99 0.00 238 N 8.28 4.45 0.00 2.94 3.06 0.00 0.00 6.74 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 0.00 239 W 8.45 4.18 0.00 3.51 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 0.00 240 I 7.74 3.22 1.87 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.36 0.80 0.00 0.00 241 Y 7.62 4.04 0.00 2.94 3.20 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 0.00 242 R 7.83 3.65 0.00 1.75 1.82 0.00 3.21 0.00 0.00 3.45 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.02 0.00 243 G 7.25 3.60 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 0.00 0.00 0.00 244 R 6.90 2.00 0.00 1.46 1.05 0.00 3.02 0.00 0.00 3.06 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.99 0.00 245 K 6.87 4.17 0.00 1.78 1.60 0.00 1.50 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.19 1.30 7.81 * Residues marked with a * may have inaccurate shift predictions.