NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.0855 8.1227 122.4279 51.5592 21.3883 176.0520 2 V 4.3332 7.7616 116.8189 60.2261 31.9318 174.0276 3 S 4.8050 9.4090 123.7888 56.8572 66.2708 172.2303 4 L 5.1804 8.2837 121.7918 53.3058 44.5244 175.5907 5 D 4.8665 8.4128 122.1884 53.8089 40.1384 175.6713 6 R 4.5949 7.6512 114.6765 56.1115 32.0686 174.3372 7 T 4.4666 8.3066 106.7227 61.8957 69.9462 174.1231 8 R 4.8630 7.5191 116.5601 55.1416 32.7407 174.0408 9 A 4.7076 8.8422 121.0504 50.1708 22.4383 175.0516 10 V 4.7813 8.5579 122.2001 61.2309 33.6321 174.8181 11 F 4.4556 9.4114 132.0382 56.3673 40.5634 174.1369 12 D 4.6554 8.4097 127.4832 54.2098 41.4889 176.8955 13 G 4.0853 9.2672 115.3560 48.5514 0.0000 174.2529 14 S 4.4162 9.3473 115.3686 60.2902 63.4959 174.4777 15 E 4.4677 8.0876 122.6544 55.7226 30.7351 176.7616 16 K 4.4195 8.4513 121.1778 56.8844 32.4352 176.7007 17 S 5.3157 7.6077 110.6348 58.4098 65.9496 173.1503 18 M 4.8072 8.7021 116.7654 54.5937 34.6423 173.4807 19 T 5.1706 8.2615 108.4100 59.8666 72.4103 173.0685 20 L 4.7628 8.4978 121.3427 53.0607 45.6369 175.4812 21 D 5.2134 8.8668 123.0052 53.4628 42.7283 175.4729 22 I 4.8645 8.5220 115.5752 59.3958 41.6877 174.2006 23 S 4.9474 8.7819 116.6248 57.0651 66.2954 172.5827 24 N 5.0415 9.0386 126.4261 52.7619 38.6693 174.8527 25 D 4.5851 9.1752 126.6939 55.5268 41.8790 176.6653 26 N 4.5313 8.2156 119.2224 53.4313 39.7530 175.5731 27 K 4.4872 8.8594 123.9714 56.6726 33.0546 176.8487 28 Q 4.5292 8.4092 117.0822 56.0552 30.9688 175.5453 29 L 4.9974 8.5092 116.6709 52.1684 44.1430 174.9021 30 P 4.9615 0.0000 0.0000 62.6022 32.9270 174.6817 31 Y 4.9190 9.0198 118.5199 56.4148 42.5355 174.4510 32 L 5.1327 8.5823 120.7140 53.4328 44.7859 175.6093 33 A 5.0147 9.1536 123.2254 50.5014 21.8858 174.9986 34 Q 5.1811 9.4367 122.3471 54.8171 30.9496 175.0037 35 A 5.4935 9.1805 125.0147 48.9930 22.2686 175.0087 36 W 5.0231 7.6132 116.6085 55.9171 31.7682 172.9734 37 I 5.2279 8.6082 120.1320 59.6983 40.2014 174.6956 38 E 5.4125 8.9966 123.7569 54.6827 33.9059 176.1599 39 N 4.9586 9.0442 120.1240 51.7623 39.2905 175.2290 40 E 3.8700 8.5150 117.8808 59.1091 29.5291 177.3179 41 N 4.8565 8.3715 113.9432 52.5979 38.7553 174.3812 42 Q 3.6643 8.2284 115.6916 57.0998 26.8839 173.2756 43 E 4.5783 8.4963 117.4910 54.0895 30.9650 176.0272 44 K 4.5864 8.7344 125.6548 56.5742 32.8336 175.7430 45 I 4.7025 8.6941 119.2339 59.1532 40.0372 175.1742 46 I 4.5207 8.4727 114.5573 60.8113 38.3394 175.5861 47 T 4.4046 8.2058 110.0513 61.5310 68.9765 173.9560 48 G 3.7479 8.1964 108.5965 44.1348 0.0000 171.8671 49 P 4.5227 0.0000 0.0000 63.3762 32.1086 176.0474 50 V 4.7109 7.2027 120.2869 61.0417 34.2337 174.2721 51 I 4.8721 9.0744 119.7159 59.0995 41.5400 173.6531 52 A 5.5360 8.6596 123.9392 50.4823 21.7870 175.7238 53 T 4.8477 9.0291 111.4283 59.3903 72.4326 172.0115 54 P 4.8826 0.0000 0.0000 61.4106 32.9513 174.2337 55 P 4.7189 0.0000 0.0000 65.6530 32.2872 176.5314 56 V 5.5621 7.8601 116.5517 61.7082 34.7524 173.6424 57 Q 4.6953 8.6107 122.7083 55.2388 32.1945 172.6009 58 R 5.0747 8.5200 120.0533 54.7200 32.3398 175.0964 59 L 4.8370 9.0966 125.3638 52.8209 44.9436 176.3736 60 E 4.5844 8.8376 123.2548 55.0877 31.2083 174.7200 61 P 4.4560 0.0000 0.0000 64.2956 31.6798 177.7112 62 G 3.9689 8.7417 109.7832 44.9468 0.0000 173.8468 63 A 4.2227 8.0144 122.4943 51.9053 19.5528 176.5081 64 K 4.8013 8.3273 121.0843 55.3125 35.1246 175.8435 65 S 4.6309 8.4405 118.9578 59.2699 66.4676 172.4480 66 M 4.9347 8.3321 114.5014 55.0494 33.9721 174.0169 67 V 4.5111 8.6597 119.0064 61.0719 34.9528 173.8906 68 R 5.0182 9.2434 127.9286 54.8100 32.3417 174.5175 69 L 5.2405 8.8766 126.3874 53.3820 44.0627 175.7995 70 S 5.4550 9.3243 119.5113 57.0493 67.5709 172.9779 71 T 4.8932 8.0256 111.0073 60.3148 71.2234 173.3881 72 T 4.5851 8.0426 112.0724 59.0309 71.9953 173.3714 73 P 4.2228 0.0000 0.0000 65.8948 31.1836 178.2422 74 D 4.5217 8.0303 116.3197 56.0989 40.2598 177.8455 75 I 3.6715 7.8522 120.3753 63.5079 37.6229 177.2355 76 S 4.3359 7.7092 113.1734 60.3743 63.1294 175.3513 77 K 4.1504 8.1631 121.8777 58.3927 32.1902 177.5540 78 L 4.3126 7.2661 118.3786 53.2260 42.1999 175.1222 79 P 4.3853 0.0000 0.0000 63.4256 31.6222 176.3627 80 Q 4.4420 8.6129 118.6702 56.2089 29.3870 175.7390 81 D 4.7976 7.6783 116.8230 52.2962 39.7085 175.6326 82 R 4.3079 7.1035 113.5053 55.5209 31.5446 173.9687 83 E 4.6052 8.3573 118.7746 56.6039 30.4886 176.6591 84 S 5.0382 9.0857 117.7346 56.7882 66.5685 172.7024 85 L 4.7254 8.3108 124.6499 53.4826 43.7282 175.1474 86 F 4.9483 8.6180 123.3257 55.9943 44.1983 172.8796 87 Y 5.0992 8.9303 115.7725 56.4687 42.0741 174.5799 88 F 5.0191 9.2707 125.8323 56.5504 41.9305 174.0147 89 N 4.8424 7.3002 122.4370 50.9308 42.0260 173.3035 90 L 4.6926 8.1581 123.8839 53.2985 45.5461 174.8413 91 R 5.1701 8.9629 127.3494 54.4263 32.9771 174.7448 92 E 4.9453 8.9081 124.3787 55.9735 31.8998 176.4481 93 I 4.6525 8.6576 120.6110 58.8812 40.1450 173.4351 94 P 3.6773 0.0000 0.0000 60.9358 32.2796 174.7012 95 P 4.2550 0.0000 0.0000 62.0972 31.9618 176.1817 96 R 3.8367 8.4054 120.0266 56.6448 30.3730 176.1675 97 S 4.1618 8.5668 121.1009 59.1516 62.8939 174.7263 *98 E 4.1236 8.8585 125.2147 58.0148 30.0120 175.4280 99 K 4.4752 7.4034 117.5160 53.6469 33.4960 180.7015 100 A 4.5942 8.1768 119.8501 52.7541 20.7113 176.6038 101 N 4.1675 8.5904 115.9180 53.8528 35.3534 173.6635 102 V 4.3423 7.4009 116.6505 60.7087 35.2019 174.0135 103 L 4.5432 8.4548 128.2311 53.3681 42.7837 175.4855 104 Q 4.3823 8.4983 125.5491 54.9604 29.8554 175.4271 105 I 4.3669 8.3212 122.3084 59.4576 39.1012 174.7106 106 A 4.7882 8.4768 128.4521 50.3093 20.9604 175.8677 107 L 4.4899 8.5590 122.5338 54.3324 43.3600 175.7170 108 Q 5.0642 8.5423 122.5549 54.6772 32.6530 174.2024 109 T 4.6595 8.9329 121.4294 61.5332 72.3193 172.6604 110 K 5.1221 8.7348 127.0250 54.4963 34.6450 174.9256 111 I 4.8514 8.7020 119.9269 58.6605 41.7203 174.6980 112 K 3.8629 8.5035 122.6190 56.1385 33.4068 175.7793 113 L 4.7926 8.2352 127.2662 53.3004 44.4253 175.0906 114 F 5.0357 8.9130 127.3540 56.5596 40.5736 174.7428 115 Y 4.8440 9.1581 126.9301 56.9740 40.0448 174.2293 116 R 4.2512 8.4188 128.7254 53.5531 31.5570 173.0590 117 P 4.2909 0.0000 0.0000 62.4575 32.2367 177.5182 118 A 3.8835 8.9069 125.0155 55.2509 18.5438 179.8789 119 A 4.0755 8.0779 117.8696 54.4401 18.5361 178.0356 120 I 4.4269 7.4872 108.0587 60.2049 37.8581 175.7023 121 K 3.9533 7.7483 122.2234 57.5446 32.3707 176.3213 122 T 4.5829 8.3341 117.5575 60.6704 71.2007 174.5084 123 R 4.4484 8.6203 120.5567 54.5287 29.8689 175.9872 124 P 4.4567 0.0000 0.0000 63.7779 31.6930 176.3019 125 N 4.9993 7.9960 115.1238 52.2623 37.7197 173.4419 126 E 4.6481 8.5029 119.2810 55.2854 31.8138 175.9276 127 V 3.8575 7.8365 124.3758 60.0836 32.2041 175.6303 128 W 4.3153 7.9133 123.2953 58.3232 28.7517 179.0155 129 Q 3.7947 7.0995 118.5618 58.5143 28.1240 177.1345 130 D 4.5942 7.5036 115.7787 53.7187 39.1766 176.9009 131 Q 4.3766 7.6253 118.0522 56.5097 29.5976 176.1167 132 L 4.4589 7.3946 117.6932 55.4453 42.6613 176.8380 133 I 4.9230 8.5791 121.5873 59.5968 41.2343 174.3118 134 L 5.0495 8.8143 126.5674 53.2161 44.0417 175.1063 135 N 5.4018 8.8359 122.5440 51.0138 40.7341 174.4915 136 K 3.9910 9.0983 127.1269 56.5412 33.0136 176.4409 137 V 4.3816 8.4458 119.7029 59.0812 35.9700 174.2218 138 S 4.1360 8.4785 115.1809 60.5425 62.1118 174.4021 139 G 4.0567 9.0043 116.5035 44.6202 0.0000 173.5622 140 G 4.2695 6.4974 109.3932 46.5103 0.0000 172.7915 141 Y 5.0966 8.6784 121.6498 55.9959 42.5619 174.0323 142 R 4.7539 9.2618 124.1582 55.1917 31.6298 175.0045 143 I 4.7985 9.2111 129.3769 60.4687 38.9608 174.8556 144 E 4.8951 9.4534 127.4583 54.9961 31.9149 174.8451 145 N 5.0287 9.3950 123.3789 51.1109 39.7867 172.3185 146 P 4.6932 0.0000 0.0000 63.2629 32.5165 176.5255 147 T 4.3445 7.9242 112.2539 60.7053 70.9387 173.3844 148 P 4.3019 0.0000 0.0000 63.0167 32.1556 175.2704 149 Y 5.0028 6.9403 116.8893 55.9438 40.5477 175.3571 150 Y 4.4380 8.9886 120.0435 58.1290 39.1847 175.5947 151 V 4.4948 8.8424 122.1805 61.6281 35.0611 174.3126 152 T 5.0136 8.8084 124.9525 62.3606 70.1361 173.6744 153 V 4.7260 8.9760 128.7937 61.9675 32.4402 176.1397 154 I 4.6849 8.3267 120.7257 60.2401 39.2741 175.7380 155 G 4.3614 7.6070 108.7663 45.4415 0.0000 172.3426 156 L 4.4788 7.5484 123.8835 54.2476 44.3436 174.0339 157 G 3.5987 8.9114 114.3570 44.8944 0.0000 172.3047 158 G 3.4351 7.4614 107.4278 46.8065 0.0000 174.0980 159 S 4.0093 7.1004 113.7394 55.1752 67.7436 174.5423 160 E 3.6478 7.5552 122.9284 60.1998 29.0799 180.5162 161 K 4.0729 7.6969 122.9177 59.8106 31.7067 180.6629 162 Q 4.0891 7.8304 120.1326 58.9966 28.9291 178.1682 163 A 3.8584 8.2441 122.4201 54.1941 18.1855 178.5732 164 E 4.3258 7.7635 113.5800 56.8122 30.5365 176.6156 165 E 4.4345 8.2982 118.8944 57.3839 31.4657 177.0647 166 G 3.8512 7.7894 106.4045 45.6119 0.0000 172.5921 167 E 4.1517 8.6585 123.4722 55.8215 30.2359 175.9554 168 F 4.9109 8.4516 127.1732 56.6654 42.5452 172.9355 169 E 4.1613 7.7809 125.7773 55.4525 30.3477 176.3395 170 T 4.4774 8.3740 121.0458 63.7259 69.8622 173.7857 171 V 4.6808 8.7970 117.9321 59.7484 36.1620 174.0620 172 M 5.1503 8.7815 123.6574 53.8868 34.3010 174.7371 173 L 4.5690 9.2502 127.2861 53.8711 43.1256 177.0477 174 S 4.2611 8.7394 119.9605 57.4451 63.7375 172.3979 175 P 4.1696 0.0000 0.0000 63.0032 31.6976 176.6088 176 R 3.6652 8.4760 120.2710 56.8756 28.1552 174.2471 177 S 4.8644 8.0654 112.6593 57.1428 67.6656 174.0206 178 E 5.2478 8.5378 116.1259 55.1326 32.5712 174.5087 179 Q 4.6720 9.1178 120.9357 55.1707 33.2497 173.1230 180 T 5.1470 8.5392 120.5366 61.8388 70.9983 173.7977 181 V 4.5921 8.9207 127.8081 61.5222 35.1793 175.1904 182 K 5.0738 8.6129 129.1891 54.3830 32.6743 176.7286 183 S 4.6823 8.2974 117.8474 57.4397 65.7215 176.7312 184 A 4.0664 8.3805 124.7578 51.8881 18.8791 176.3196 185 N 4.5084 8.0552 117.8721 52.6845 39.8945 173.7817 186 Y 5.0520 8.4846 122.8185 56.0454 40.9058 175.2580 187 N 4.5074 9.4005 123.8592 56.4426 39.2034 174.9611 188 T 4.6096 7.6146 109.8457 58.5960 69.4583 171.2315 189 P 4.6586 0.0000 0.0000 63.4829 33.0738 174.5377 190 Y 5.1541 8.9405 120.5828 56.1222 41.3948 174.2529 191 L 5.1495 9.4580 126.2286 53.2257 45.5848 174.8870 192 S 5.4582 9.1282 120.1727 56.0723 65.6611 172.1149 193 Y 5.4277 7.9484 122.0767 56.0087 42.1008 173.1073 194 I 4.7938 8.2828 120.5336 59.7619 39.2150 176.1836 195 N 4.9248 8.6772 126.2273 51.5732 39.6976 174.9249 196 D 4.3041 8.7597 116.7164 57.7517 40.6953 177.1948 197 Y 4.4232 8.6162 114.0093 57.7173 38.2778 176.4272 198 G 4.0282 8.2883 108.5553 44.8838 0.0000 174.4114 199 G 3.7603 8.0911 108.8053 45.5212 0.0000 173.4843 200 R 5.2970 7.7644 119.1644 52.7725 30.1036 173.6738 201 P 4.4204 0.0000 0.0000 62.1522 33.5036 175.9320 202 V 4.7897 8.1114 120.4518 61.2345 34.1735 174.4154 203 L 4.7314 9.7414 128.6881 53.0974 44.3833 175.1660 204 S 4.2996 8.3261 117.8242 56.7550 64.0564 172.6435 205 F 5.2543 8.9656 126.1043 55.5789 41.6235 174.9423 206 I 4.6092 9.0852 115.1121 59.3800 40.1942 173.5113 207 C 5.3430 8.9130 122.7916 55.4027 37.0109 173.7109 208 N 4.7224 10.1688 123.3805 52.0803 38.8818 175.6066 209 G 4.0342 7.9604 117.2504 46.6363 0.0000 172.9002 210 S 4.4315 8.6856 121.3608 58.3958 62.7753 172.5478 211 R 4.8943 7.9008 122.7381 54.9202 31.6434 174.1427 212 C 5.5144 9.3874 124.4125 55.2751 42.0001 173.3161 213 S 5.2057 9.3070 117.0194 56.1089 66.9462 173.2328 214 V 3.4172 8.1024 122.9455 63.0040 31.7046 176.4479 215 K 3.9514 8.1915 134.3711 55.7557 32.3695 175.3418 *216 K 4.1004 8.5156 124.4968 54.1982 32.3815 173.9682 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 A 8.12 4.09 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 V 7.76 4.33 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 0.77 0.00 0.00 0.81 0.00 0.00 3 S 9.41 4.80 0.00 3.86 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 4 L 8.28 5.18 0.00 1.66 1.57 0.96 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 5 D 8.41 4.87 0.00 2.67 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 6 R 7.65 4.59 0.00 1.91 1.93 0.00 3.14 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.79 0.00 7 T 8.31 4.47 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 1.24 0.00 0.00 8 R 7.52 4.86 0.00 1.99 2.00 0.00 3.34 0.00 0.00 3.48 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.85 0.00 9 A 8.84 4.71 1.16 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 0.00 0.00 10 V 8.56 4.78 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 0.86 0.00 0.00 1.09 0.00 0.00 11 F 9.41 4.46 0.00 3.28 3.06 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 12 D 8.41 4.66 0.00 2.75 2.44 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 0.00 13 G 9.27 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 0.00 0.00 0.00 14 S 9.35 4.42 0.00 3.97 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 15 E 8.09 4.47 0.00 1.87 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 2.25 0.00 16 K 8.45 4.42 0.00 1.68 1.80 0.00 1.83 0.00 0.00 1.87 0.00 0.00 2.87 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.40 0.99 7.81 17 S 7.61 5.32 0.00 4.06 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 M 8.70 4.81 0.00 1.63 1.96 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 19 T 8.26 5.17 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 1.19 0.00 0.00 20 L 8.50 4.76 0.00 1.38 1.36 0.72 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.87 5.21 0.00 2.74 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 8.52 4.86 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.88 0.97 0.00 0.00 23 S 8.78 4.95 0.00 3.87 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 N 9.04 5.04 0.00 2.83 2.72 0.00 0.00 7.00 8.11 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 25 D 9.18 4.59 0.00 2.57 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.22 4.53 0.00 2.71 2.85 0.00 0.00 7.00 5.34 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 27 K 8.86 4.49 0.00 1.79 1.84 0.00 1.77 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.39 7.81 28 Q 8.41 4.53 0.00 2.04 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.75 0.00 0.00 0.00 0.00 0.00 2.47 2.31 0.00 29 L 8.51 5.00 0.00 1.66 1.53 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.96 0.00 2.10 2.07 0.00 3.69 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 1.92 1.99 0.00 31 Y 9.02 4.92 0.00 2.90 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 8.58 5.13 0.00 1.69 1.62 0.94 1.01 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 33 A 9.15 5.01 1.25 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 0.00 0.00 34 Q 9.44 5.18 0.00 2.33 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.71 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 35 A 9.18 5.49 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 36 W 7.61 5.02 0.00 3.30 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 37 I 8.61 5.23 1.95 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 1.47 0.88 1.02 0.00 0.00 38 E 9.00 5.41 0.00 2.13 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 2.57 2.59 0.00 39 N 9.04 4.96 0.00 2.91 3.10 0.00 0.00 6.78 7.87 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 40 E 8.51 3.87 0.00 1.89 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 2.33 2.36 0.00 41 N 8.37 4.86 0.00 2.87 2.82 0.00 0.00 6.93 7.69 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 42 Q 8.23 3.66 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.23 6.63 0.00 0.00 0.00 0.00 0.00 1.63 2.14 0.00 43 E 8.50 4.58 0.00 2.13 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 0.00 2.26 2.48 0.00 44 K 8.73 4.59 0.00 1.65 1.64 0.00 0.69 0.00 0.00 1.37 0.00 0.00 2.86 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.34 1.52 7.81 45 I 8.69 4.70 1.93 0.00 0.00 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 1.60 0.94 1.03 0.00 0.00 46 I 8.47 4.52 1.87 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 1.46 0.74 0.89 0.00 0.00 47 T 8.21 4.40 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 48 G 8.20 3.75 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 0.00 0.00 0.00 49 P 0.00 4.52 0.00 1.88 2.21 0.00 3.90 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 1.88 1.87 0.00 50 V 7.20 4.71 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 0.52 0.00 0.00 -0.05 0.00 0.00 51 I 9.07 4.87 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 1.29 1.16 0.88 0.00 0.00 52 A 8.66 5.54 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 T 9.03 4.85 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 1.25 0.00 0.00 54 P 0.00 4.88 0.00 2.38 2.12 0.00 3.83 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 55 P 0.00 4.72 0.00 2.14 2.20 0.00 3.63 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 56 V 7.86 5.56 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 0.64 0.00 0.00 0.98 0.00 0.00 57 Q 8.61 4.70 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.66 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 58 R 8.52 5.07 0.00 1.85 1.86 0.00 3.19 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 59 L 9.10 4.84 0.00 1.61 1.56 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.84 4.58 0.00 1.92 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 2.42 2.31 0.00 61 P 0.00 4.46 0.00 2.07 2.17 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.29 0.00 62 G 8.74 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 63 A 8.01 4.22 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.33 4.80 0.00 1.73 1.67 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.45 7.81 65 S 8.44 4.63 0.00 3.94 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 M 8.33 4.93 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 67 V 8.66 4.51 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 1.14 0.00 0.00 1.08 0.00 0.00 68 R 9.24 5.02 0.00 1.89 1.79 0.00 3.14 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.76 0.00 69 L 8.88 5.24 0.00 1.81 1.70 0.83 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 70 S 9.32 5.45 0.00 3.72 3.75 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 71 T 8.03 4.89 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 0.67 0.00 0.00 72 T 8.04 4.59 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 1.16 0.00 0.00 73 P 0.00 4.22 0.00 2.16 2.15 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 74 D 8.03 4.52 0.00 2.67 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 75 I 7.85 3.67 1.80 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.77 0.92 0.00 0.00 76 S 7.71 4.34 0.00 4.12 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 77 K 8.16 4.15 0.00 1.76 1.92 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.65 1.55 7.81 78 L 7.27 4.31 0.00 1.85 1.72 0.80 1.07 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 79 P 0.00 4.39 0.00 2.17 2.06 0.00 3.81 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 2.04 2.01 0.00 80 Q 8.61 4.44 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.35 0.00 0.00 0.00 0.00 0.00 2.33 2.30 0.00 81 D 7.68 4.80 0.00 2.65 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 0.00 0.00 0.00 0.00 82 R 7.10 4.31 0.00 1.68 1.70 0.00 2.92 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.55 0.00 83 E 8.36 4.61 0.00 2.03 2.31 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 2.55 2.22 0.00 84 S 9.09 5.04 0.00 4.13 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 85 L 8.31 4.73 0.00 0.91 1.25 0.15 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 86 F 8.62 4.95 0.00 3.07 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 87 Y 8.93 5.10 0.00 2.97 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 F 9.27 5.02 0.00 3.11 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 89 N 7.30 4.84 0.00 1.44 1.42 0.00 0.00 6.09 6.02 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 90 L 8.16 4.69 0.00 1.64 1.37 1.02 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.96 5.17 0.00 1.97 1.96 0.00 3.25 0.00 0.00 3.66 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 92 E 8.91 4.95 0.00 2.34 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 2.67 2.46 0.00 93 I 8.66 4.65 1.91 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 1.37 1.40 0.90 0.00 0.00 94 P 0.00 3.68 0.00 1.84 1.91 0.00 3.78 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 1.92 1.98 0.00 95 P 0.00 4.25 0.00 2.11 1.96 0.00 3.19 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.79 0.00 96 R 8.41 3.84 0.00 1.75 1.87 0.00 3.23 0.00 0.00 3.13 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 97 S 8.57 4.16 0.00 3.85 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *98 E 8.86 4.12 0.00 2.03 1.85 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 2.22 1.87 0.00 99 K 7.40 4.48 0.00 1.76 1.63 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.33 1.24 7.81 100 A 8.18 4.59 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.59 4.17 0.00 2.86 2.85 0.00 0.00 6.62 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 7.40 4.34 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 0.80 0.00 0.00 1.02 0.00 0.00 103 L 8.45 4.54 0.00 1.62 1.56 0.93 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0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.13 0.97 0.00 0.00 112 K 8.50 3.86 0.00 1.26 0.74 0.00 1.75 0.00 0.00 1.93 0.00 0.00 2.95 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.40 1.47 7.81 113 L 8.24 4.79 0.00 1.64 1.52 0.97 0.86 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 0.00 114 F 8.91 5.04 0.00 3.15 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 0.00 115 Y 9.16 4.84 0.00 3.25 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 0.00 116 R 8.42 4.25 0.00 1.94 1.75 0.00 3.16 0.00 0.00 3.18 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 117 P 0.00 4.29 0.00 2.16 2.21 0.00 3.50 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.10 0.00 118 A 8.91 3.88 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 0.00 119 A 8.08 4.08 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 7.49 4.43 1.61 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.72 0.79 0.00 0.00 121 K 7.75 3.95 0.00 1.82 1.81 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.48 1.40 7.81 122 T 8.33 4.58 4.47 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 0.97 0.00 0.00 123 R 8.62 4.45 0.00 1.79 1.86 0.00 3.31 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.46 0.00 124 P 0.00 4.46 0.00 2.05 2.22 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 2.08 2.19 0.00 125 N 8.00 5.00 0.00 2.75 2.84 0.00 0.00 5.83 7.66 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 0.00 126 E 8.50 4.65 0.00 1.95 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.29 0.00 127 V 7.84 3.86 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 0.80 0.00 0.00 0.82 0.00 0.00 128 W 7.91 4.32 0.00 3.62 3.45 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 0.00 129 Q 7.10 3.79 0.00 1.40 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 7.16 0.00 0.00 0.00 0.00 0.00 1.16 1.79 0.00 130 D 7.50 4.59 0.00 2.58 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 Q 7.63 4.38 0.00 2.29 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 132 L 7.39 4.46 0.00 1.81 1.84 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 133 I 8.58 4.92 1.93 0.00 0.00 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 1.46 1.05 0.97 0.00 0.00 134 L 8.81 5.05 0.00 1.40 1.52 0.43 -0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 135 N 8.84 5.40 0.00 2.68 2.75 0.00 0.00 6.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 K 9.10 3.99 0.00 1.61 1.58 0.00 1.50 0.00 0.00 1.38 0.00 0.00 2.19 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.69 1.33 7.81 137 V 8.45 4.38 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 0.68 0.00 0.00 0.94 0.00 0.00 138 S 8.48 4.14 0.00 3.78 3.77 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 0.00 139 G 9.00 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 0.00 0.00 0.00 140 G 6.50 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 0.00 141 Y 8.68 5.10 0.00 2.91 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 0.00 142 R 9.26 4.75 0.00 1.86 1.86 0.00 3.28 0.00 0.00 3.18 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 143 I 9.21 4.80 1.93 0.00 0.00 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 1.23 0.56 0.94 0.00 0.00 144 E 9.45 4.90 0.00 1.90 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 145 N 9.39 5.03 0.00 2.79 2.79 0.00 0.00 6.74 7.66 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 0.00 146 P 0.00 4.69 0.00 2.12 2.15 0.00 3.86 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 147 T 7.92 4.34 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 148 P 0.00 4.30 0.00 1.10 1.93 0.00 2.77 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 1.63 1.83 0.00 149 Y 6.94 5.00 0.00 2.24 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 0.00 150 Y 8.99 4.44 0.00 2.60 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 0.00 151 V 8.84 4.49 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 0.83 0.00 0.00 1.18 0.00 0.00 152 T 8.81 5.01 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 153 V 8.98 4.73 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 1.05 0.00 0.00 1.05 0.00 0.00 154 I 8.33 4.68 1.98 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 1.28 1.27 1.03 0.00 0.00 155 G 7.61 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 0.00 0.00 0.00 0.00 156 L 7.55 4.48 0.00 0.93 0.89 0.60 0.92 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 0.00 157 G 8.91 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 0.00 158 G 7.46 3.44 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 0.00 0.00 0.00 0.00 159 S 7.10 4.01 0.00 3.65 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 0.00 160 E 7.56 3.65 0.00 1.63 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 2.36 2.28 0.00 161 K 7.70 4.07 0.00 1.76 1.82 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.44 1.07 7.81 162 Q 7.83 4.09 0.00 1.99 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 163 A 8.24 3.86 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 E 7.76 4.33 0.00 2.13 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 2.48 2.27 0.00 165 E 8.30 4.43 0.00 1.99 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 2.22 2.28 0.00 166 G 7.79 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 0.00 167 E 8.66 4.15 0.00 2.00 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 2.34 2.33 0.00 168 F 8.45 4.91 0.00 2.96 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 0.00 169 E 7.78 4.16 0.00 1.97 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 0.00 1.84 1.95 0.00 170 T 8.37 4.48 4.31 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 1.39 0.00 0.00 171 V 8.80 4.68 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 1.09 0.00 0.00 172 M 8.78 5.15 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.87 0.00 173 L 9.25 4.57 0.00 1.64 1.62 1.01 0.83 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 0.00 174 S 8.74 4.26 0.00 3.69 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 P 0.00 4.17 0.00 1.63 1.67 0.00 3.12 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.46 0.00 176 R 8.48 3.67 0.00 1.69 1.85 0.00 3.08 0.00 0.00 3.14 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 177 S 8.07 4.86 0.00 3.84 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 0.00 178 E 8.54 5.25 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.30 0.00 179 Q 9.12 4.67 0.00 2.15 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 180 T 8.54 5.15 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 1.28 0.00 0.00 181 V 8.92 4.59 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 1.04 0.00 0.00 1.03 0.00 0.00 182 K 8.61 5.07 0.00 1.58 1.57 0.00 1.94 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.33 1.00 7.81 183 S 8.30 4.68 0.00 4.19 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 0.00 184 A 8.38 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 N 8.06 4.51 0.00 2.53 2.62 0.00 0.00 6.75 7.54 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 0.00 186 Y 8.48 5.05 0.00 3.07 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 0.00 187 N 9.40 4.51 0.00 2.75 2.95 0.00 0.00 6.92 7.70 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 0.00 188 T 7.61 4.61 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 189 P 0.00 4.66 0.00 1.81 1.70 0.00 3.58 0.00 0.00 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.39 0.00 190 Y 8.94 5.15 0.00 2.89 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 0.00 191 L 9.46 5.15 0.00 1.53 1.73 0.84 0.72 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 0.00 192 S 9.13 5.46 0.00 3.87 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 0.00 193 Y 7.95 5.43 0.00 3.28 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 0.00 194 I 8.28 4.79 1.99 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 1.30 0.72 0.98 0.00 0.00 195 N 8.68 4.92 0.00 2.96 3.10 0.00 0.00 6.53 8.19 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 0.00 196 D 8.76 4.30 0.00 1.95 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 Y 8.62 4.42 0.00 2.92 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 0.00 198 G 8.29 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 0.00 199 G 8.09 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 0.00 200 R 7.76 5.30 0.00 1.69 1.76 0.00 3.26 0.00 0.00 3.85 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.68 0.00 201 P 0.00 4.42 0.00 1.69 1.82 0.00 2.38 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 202 V 8.11 4.79 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 1.00 0.00 0.00 0.90 0.00 0.00 203 L 9.74 4.73 0.00 1.65 1.28 0.82 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 204 S 8.33 4.30 0.00 3.68 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 0.00 205 F 8.97 5.25 0.00 2.81 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 0.00 206 I 9.09 4.61 1.85 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 1.23 1.35 0.92 0.00 0.00 207 C 8.91 5.34 0.00 2.92 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 0.00 208 N 10.17 4.72 0.00 2.80 2.81 0.00 0.00 6.91 7.85 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 0.00 209 G 7.96 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 0.00 210 S 8.69 4.43 0.00 3.89 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 0.00 211 R 7.90 4.89 0.00 1.95 1.83 0.00 3.06 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 212 C 9.39 5.51 0.00 2.97 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 0.00 213 S 9.31 5.21 0.00 3.80 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 0.00 214 V 8.10 3.42 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 0.49 0.00 0.00 0.32 0.00 0.00 215 K 8.19 3.95 0.00 1.60 1.59 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.39 1.27 7.81 *216 K 8.52 4.10 0.00 1.51 1.65 0.00 1.58 0.00 0.00 1.74 0.00 0.00 3.09 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.