NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.3073 7.8827 121.4538 61.1051 38.1876 174.1541 17 V 3.8909 8.5737 127.0305 62.7002 32.0826 174.7153 18 G 3.6440 8.9460 114.4843 46.6078 0.0000 173.1423 19 G 4.2459 7.8828 110.3493 43.7386 0.0000 172.7096 20 Y 4.9618 7.8020 116.2510 55.0545 42.0579 174.9833 21 T 4.3097 8.5941 117.3522 64.0445 68.4249 174.9310 22 C 4.2308 8.5968 125.5556 59.9691 35.8138 175.6724 23 G 4.0197 8.4477 105.6041 44.9973 0.0000 172.7202 24 A 4.1629 8.3210 126.0916 53.5262 17.4606 177.5747 25 N 4.4021 8.9823 117.8075 53.8273 36.5055 176.0875 26 T 3.9565 7.6985 108.1325 63.2455 69.8173 175.1825 27 V 4.1076 6.9170 121.1115 60.2958 31.1792 173.8291 28 P 4.5583 0.0000 0.0000 64.0158 32.0776 178.1009 29 Y 4.9241 6.8561 116.2010 56.7989 38.9978 174.9207 30 Q 4.4621 7.3619 123.4633 56.4954 29.4076 175.7703 31 V 4.8191 9.0383 119.5438 59.7038 35.7113 174.2503 32 S 4.9175 8.7295 117.2955 56.6533 64.6942 172.6729 33 L 4.6554 8.5498 127.5744 53.3080 43.2075 175.0025 34 N 5.9556 9.0710 122.7861 49.9811 41.9414 174.7243 *37 S 4.1225 8.2788 119.9667 58.2933 63.9397 174.5171 38 G 3.9819 9.8605 106.7792 46.0421 0.0000 171.9825 39 Y 4.5192 6.6265 114.9592 56.0884 39.9973 172.7299 40 H 4.5806 8.8377 121.9540 56.0836 30.2787 174.9162 41 F 4.9446 7.7955 120.0437 56.6972 39.6439 173.9493 42 C 4.7651 6.5955 116.8440 55.9801 44.7569 173.9207 43 G 4.0245 8.6163 109.4990 46.6301 0.0000 171.8397 44 G 4.7516 7.7885 105.1953 46.7070 0.0000 172.5118 45 S 5.3852 8.6570 115.0924 56.5862 66.9976 173.5752 46 L 4.8387 9.2330 127.6714 54.5578 42.3482 176.9982 47 I 4.3469 8.5405 120.1067 61.3818 39.0253 174.4929 48 N 4.8158 7.5880 117.2571 52.0617 39.5781 174.8250 49 S 4.3118 8.7073 111.6467 60.5508 63.3022 174.6164 50 Q 4.6431 8.2038 120.2474 55.3320 30.9706 174.2679 51 W 5.6182 8.4930 117.3431 55.6774 33.6730 174.2170 52 V 5.0498 9.0309 123.2404 61.1628 34.3617 174.1422 53 V 4.9129 8.7925 126.7570 61.5775 33.5133 174.6254 54 S 5.2802 9.1644 121.3331 57.2047 66.6586 171.9044 55 A 4.5270 8.4419 121.8838 50.8568 19.7734 178.3095 56 A 3.7739 8.4056 125.2338 55.4414 18.3329 179.0369 57 H 4.5333 8.1998 108.9102 57.1697 28.7069 175.4349 58 C 4.6390 7.8420 117.2810 57.7526 40.6141 173.4102 59 Y 4.1815 7.6658 121.7516 57.9958 38.6946 175.3427 60 K 3.6722 6.7752 122.9244 55.8980 34.7578 174.5766 61 S 4.0775 8.1261 114.5607 58.9301 63.2626 173.2536 62 G 3.6372 8.3911 110.8067 46.5002 0.0000 173.7541 63 I 4.2675 7.3992 119.2794 60.0726 39.4215 175.7117 64 Q 4.8256 8.9438 128.4223 54.2337 31.5321 174.1371 65 V 4.4184 8.8169 127.0948 61.7976 33.3864 174.5726 66 R 5.0285 8.9053 127.7996 54.6715 32.2354 175.3063 67 L 4.6095 9.1914 125.0630 53.0260 44.2061 177.8493 *69 G 3.9420 8.2667 108.2119 45.3325 0.0000 172.9564 70 E 4.3252 8.0492 119.1478 56.0086 30.0574 175.1764 71 D 4.8205 8.2877 118.5857 55.4389 43.6227 174.7137 72 N 5.0404 8.8037 122.9373 52.5005 38.6130 175.9140 73 I 3.9667 8.5728 119.7702 61.7437 37.8763 176.3789 74 N 4.7379 8.4691 117.8679 53.1305 39.3021 174.9115 75 V 4.3624 7.3966 117.9146 60.6158 34.3609 174.9367 76 V 4.0905 8.4186 126.4397 62.6357 31.4035 175.1473 77 E 4.5202 10.7800 127.2663 55.9737 31.4325 176.3310 78 G 3.7873 7.7840 113.5884 45.9384 0.0000 174.1636 79 N 4.8152 7.7335 117.8718 52.5825 38.7985 174.7652 80 E 4.6428 7.8247 117.6270 56.7794 30.7765 176.5367 81 Q 4.4180 9.0690 120.5554 54.6524 33.3688 173.7806 82 F 5.5063 8.9337 123.2452 56.0793 40.7668 175.3349 83 I 4.6682 8.7995 125.0150 59.2573 40.9129 175.5201 84 S 4.6758 8.7290 122.7306 58.2702 64.1472 173.4174 85 A 4.3271 8.4002 126.1023 52.3495 18.1720 177.6277 86 S 4.3309 9.0347 118.2430 60.4578 63.3720 174.6801 87 K 4.7341 7.6601 116.9386 54.8467 36.7751 175.6851 88 S 5.0283 8.8548 119.1519 57.1686 65.5033 174.0882 89 I 4.3446 9.1102 128.2576 59.7016 37.7999 175.4489 90 V 4.1286 8.1701 127.3406 62.1410 32.6370 175.1575 91 H 3.9528 8.6759 127.5200 55.8655 29.9373 174.4109 92 P 4.2717 0.0000 0.0000 65.2330 31.2131 177.0246 93 S 4.6795 7.9558 113.3356 58.0891 62.9114 173.2054 94 Y 4.4380 8.1830 123.1033 58.2146 38.9599 174.8106 95 N 4.7407 8.3987 125.1357 51.2739 40.5444 175.1875 96 S 3.9586 7.8094 120.2291 60.0920 63.5908 175.3837 97 N 4.3773 8.6623 119.2194 55.8495 38.5322 176.4099 98 T 3.9116 7.7645 105.4555 61.4166 69.6364 175.1407 99 L 3.7959 8.0316 120.6950 55.3401 39.8838 173.9180 100 N 4.4169 7.8092 118.0332 54.8242 39.4157 174.6299 101 N 4.9169 8.7218 120.7027 54.3164 35.7331 175.5154 102 D 4.6056 7.9658 117.8224 52.9632 39.7961 174.4452 103 I 4.6902 7.1110 120.9985 59.3284 42.2686 172.5929 104 M 5.3879 9.2231 127.5747 54.1345 36.1629 173.3828 105 L 5.3401 9.2939 125.7189 53.4885 44.5003 175.4311 106 I 5.0105 9.0418 123.8596 59.3961 40.3303 174.5943 107 K 3.4159 8.4976 129.1715 55.2529 31.8775 175.8850 108 L 4.4469 8.2995 127.3991 53.8788 42.6696 177.9263 109 K 4.2312 8.6129 123.8236 59.1335 32.6809 177.1147 110 S 4.5632 7.4705 111.0173 55.8534 65.6224 173.1072 111 A 4.4262 8.4262 127.4458 51.9154 18.7437 177.3711 112 A 4.3253 9.0224 123.5795 52.0782 19.6607 177.6739 113 S 4.5385 9.2659 116.7519 57.3783 63.3098 174.4373 114 L 4.7322 8.3862 125.5433 54.0368 43.6059 176.2631 115 N 4.4248 8.3883 122.3322 53.7562 41.0693 176.2684 116 S 4.3924 8.7135 110.3779 61.0014 63.3564 176.4910 117 R 4.0268 7.9061 114.3791 57.8272 29.7467 176.5090 118 V 4.5259 7.4372 119.0464 60.9615 34.2166 173.6566 119 A 5.0783 8.6583 127.5474 50.7787 22.9149 175.6316 120 S 5.0841 8.7091 114.9760 58.0563 64.7340 172.9414 121 I 4.4148 8.2592 120.8118 59.1252 39.7376 175.3532 122 S 4.4570 8.3380 123.7466 58.1489 64.1367 173.9239 123 L 4.1835 8.3550 123.1374 53.7469 42.3102 175.3067 124 P 4.5504 0.0000 0.0000 62.8289 32.3011 176.2599 125 T 4.2091 8.1524 108.0922 62.0918 69.8299 174.1721 *127 S 4.4421 7.5562 115.3844 58.2407 63.2301 173.7053 128 C 4.4765 8.4950 122.2904 56.6962 40.7970 172.8526 129 A 4.6131 7.8670 123.8899 50.7252 20.3165 177.7474 130 S 4.0814 8.1333 116.9931 58.2596 63.7759 173.4997 *132 A 4.2351 8.2180 124.7421 53.4574 19.2466 177.3712 133 G 3.9743 9.0535 110.4414 45.3538 0.0000 174.3564 134 T 3.9363 7.4574 117.2271 63.7576 69.4590 173.3407 135 Q 4.6176 8.5836 127.6308 55.9939 30.0760 175.4272 136 C 5.2733 9.3788 122.9407 55.1072 45.6661 172.3478 137 L 5.2426 8.9310 123.0849 53.5475 44.0631 175.0080 138 I 5.2599 9.2348 127.4328 58.7505 39.7897 174.8923 139 S 4.9876 9.1158 120.1730 56.0583 66.5887 173.2826 140 G 3.9031 7.6618 110.1992 46.0469 0.0000 172.7304 141 W 4.6840 8.5276 118.0885 56.3045 29.2921 177.1725 142 G 4.1038 8.3848 108.8407 44.2576 0.0000 173.5101 143 N 3.8811 8.8538 118.0716 54.6330 38.8945 174.4305 144 T 4.8531 8.3336 113.4860 60.4910 69.4646 174.3468 145 K 4.6270 7.7288 121.2126 54.9343 34.8564 176.3631 146 S 4.2166 8.7931 119.3476 60.8513 63.0792 174.5202 147 S 4.5252 8.9978 117.2882 58.8716 63.3014 174.0325 148 G 3.6603 7.2867 113.4465 45.0167 0.0000 170.5588 149 T 4.4036 7.7910 119.3524 62.4768 71.9573 174.0581 150 S 4.3683 9.4516 122.6968 56.9560 65.5384 172.0544 151 Y 5.0156 8.5908 125.6382 55.8569 39.0271 174.4177 152 P 4.6430 0.0000 0.0000 62.6103 32.9298 176.3229 153 D 4.5229 8.8417 118.8089 57.2037 41.2095 177.3177 154 V 5.5371 7.4179 109.5831 58.9190 33.9643 175.5742 155 L 3.2900 8.5162 124.8562 54.9087 43.0782 175.7878 156 K 4.9015 8.1262 124.3860 54.7727 35.2540 174.5682 157 C 5.2106 8.3517 120.4746 55.2950 41.0853 172.7843 158 L 4.7372 8.1620 120.1371 54.2466 45.7891 173.7822 159 K 5.0730 9.0499 125.9233 55.7918 33.1774 176.0544 160 A 4.8044 9.2308 126.4552 49.6240 23.1710 173.5628 161 P 4.8890 0.0000 0.0000 62.4525 33.4002 175.5521 162 I 4.2253 8.5369 123.6320 61.4720 38.0481 175.8945 163 L 4.8162 8.6207 127.4757 53.2437 43.3583 176.7976 164 S 4.3971 8.4040 114.6679 58.0322 64.0492 175.0822 165 D 4.3983 8.7331 121.6177 57.6553 40.4891 179.3036 166 S 4.1790 7.9845 114.3168 61.5533 63.1929 176.5949 167 S 4.1182 8.1125 118.7975 61.2228 62.6215 175.8606 168 C 4.3172 8.4415 121.5836 59.7806 42.8191 175.8866 169 K 3.9978 8.5057 120.4354 59.4891 31.3432 179.6269 170 S 4.2163 8.1676 114.8698 61.4332 62.7814 176.2159 171 A 3.9953 8.0279 122.8589 53.9025 19.6812 177.3833 172 Y 4.9414 7.7913 113.5041 55.4049 38.4926 173.1638 173 P 4.6362 0.0000 0.0000 63.4662 32.2882 177.7829 174 G 4.0643 9.0447 110.9081 45.7603 0.0000 173.7700 175 Q 4.4182 8.0795 116.6653 55.9931 30.0037 175.5529 176 I 4.3243 7.8373 119.3890 60.1660 37.9873 175.6694 177 T 4.5041 8.2721 116.3695 59.8164 70.6370 175.6051 178 S 4.2256 8.5575 115.2875 60.9777 63.0446 174.6244 179 N 4.9174 8.0440 118.4258 53.2730 38.3689 173.8790 180 M 5.5704 7.9444 117.3170 53.7732 36.0795 174.4341 181 F 5.1005 8.6648 114.6905 56.0042 42.3295 172.2375 182 C 5.5727 9.0435 115.9607 55.4540 41.1448 172.9325 183 A 5.0319 9.7327 123.3614 50.6864 22.3257 174.6080 184A G 3.9454 7.0851 106.9063 44.5899 0.0000 173.1758 184 Y 4.6564 8.4150 119.6443 56.2664 41.6174 176.1662 185 L 4.2554 8.6026 123.8722 56.8573 42.2522 178.8843 186 E 3.9225 8.2185 117.4437 57.3759 29.6292 177.5649 187 G 3.8584 7.4973 104.8643 45.2434 0.0000 173.1960 188A G 4.0015 9.3257 106.8257 44.7311 0.0000 173.9296 188 K 4.8040 7.3931 117.6586 55.0523 35.5962 175.0543 189 D 4.7414 8.7617 123.4471 53.4912 45.4616 174.4958 190 S 4.8883 8.7558 115.9554 58.3761 64.6528 173.9651 191 C 4.8955 9.5443 120.0411 55.1969 44.1742 172.7252 192 Q 4.4510 8.5828 118.5920 57.5265 28.6189 176.8990 193 G 4.4710 9.2402 110.5315 46.2103 0.0000 174.3469 194 D 4.6511 8.5094 118.3268 55.4471 41.6102 176.6956 195 S 4.4533 8.0740 116.0511 60.5233 63.3676 175.4789 196 G 4.0987 8.7943 112.8820 46.2946 0.0000 173.6124 197 G 4.3223 7.7876 107.6446 44.7410 0.0000 171.1311 198 P 5.0570 0.0000 0.0000 62.3976 33.2464 175.6371 199 V 4.6053 8.7363 122.2177 61.4287 33.9629 174.0326 200 V 4.7884 8.7623 128.9492 61.3373 33.9820 173.8053 201 C 5.0735 8.8999 124.6522 55.7256 44.1628 174.5430 202 S 3.6984 9.8252 120.0243 59.7195 60.1042 173.3141 203 G 3.9063 8.4956 104.6578 45.6342 0.0000 174.0109 204 K 4.6819 7.8722 118.5203 53.0571 34.9317 175.4068 *209 L 4.4050 8.2932 123.2415 55.4169 42.3078 175.7902 210 Q 4.4881 9.0083 126.3258 56.8473 30.8199 175.9018 211 G 5.3492 7.9989 104.3909 45.8023 0.0000 171.5016 212 I 5.3125 8.2099 119.7324 58.8843 41.1298 175.3871 213 V 3.7012 8.9126 127.4552 63.7429 31.8585 174.2588 214 S 4.8089 8.5236 121.2655 58.5808 64.0425 174.7432 215 W 5.0659 7.7656 114.7902 56.5055 31.7246 172.8785 216 G 4.1845 8.5497 108.1748 46.8409 0.0000 173.2596 217 S 4.6352 8.4323 117.1121 57.1985 62.5065 173.8100 *219 G 4.2141 7.9408 116.4908 45.4946 0.0000 170.8686 220 C 4.9181 8.3068 116.7078 56.7201 45.5355 173.7455 221A A 4.0561 9.1735 125.5955 53.1259 16.7907 176.8798 221 Q 4.4625 7.3709 117.4038 56.2663 29.6432 175.9394 222 K 4.1615 8.5574 122.3273 58.2263 32.4811 176.0485 223 N 4.2913 9.1163 122.2738 54.1334 36.8221 175.2821 224 K 4.3062 7.7128 117.3325 53.5609 32.4168 174.1523 225 P 4.5794 0.0000 0.0000 62.1255 32.9231 177.3681 226 G 3.5814 8.4897 107.1749 46.3115 0.0000 172.6807 227 V 4.5385 7.5784 122.4623 60.7781 34.2439 174.1120 228 Y 4.9594 8.1096 123.5421 56.0918 42.3563 174.8113 229 T 4.4294 8.6741 120.4624 63.5917 70.0202 174.2393 230 K 5.0361 9.3160 128.2503 55.2385 31.6055 177.1118 231 V 3.9291 8.7362 126.4200 65.9128 31.4091 174.8773 232 C 4.5587 8.3960 112.6204 58.5201 41.3433 174.9183 233 N 4.2637 8.1076 116.8419 54.4454 38.5197 175.5022 234 Y 4.7670 8.1810 117.7973 57.4683 38.9530 177.3678 235 V 3.6980 7.8293 121.2035 66.2148 31.5961 178.0013 236 S 4.1409 8.0873 114.4265 61.1574 62.7204 176.1071 237 W 4.1682 8.3445 130.5530 60.6441 30.4542 177.7792 238 I 3.2636 8.2852 119.8224 64.2608 36.5684 178.6184 239 K 3.7666 7.9827 119.0916 59.6097 31.6645 179.5497 240 Q 3.8920 7.8657 117.1771 58.9608 28.8613 178.7594 241 T 3.7003 7.4820 116.8080 66.5894 68.3105 176.7939 242 I 2.6480 7.1662 121.5325 64.1056 36.7397 178.3381 243 A 3.9338 7.6542 120.4133 54.9620 18.2230 179.2437 244 S 4.3647 7.7622 112.1003 59.6907 63.2401 174.1868 245 N 4.6972 7.8318 123.6481 53.3054 38.8434 174.1273 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 16 I 7.88 4.31 1.80 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 1.48 1.43 0.86 0.00 0.00 17 V 8.57 3.89 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 1.01 0.00 0.00 0.95 0.00 0.00 18 G 8.95 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.88 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.80 4.96 0.00 2.91 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 21 T 8.59 4.31 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 1.23 0.00 0.00 22 C 8.60 4.23 0.00 2.75 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 23 G 8.45 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.32 4.16 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.98 4.40 0.00 3.03 2.98 0.00 0.00 6.92 7.06 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 26 T 7.70 3.96 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 27 V 6.92 4.11 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 0.29 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.56 0.00 2.39 2.37 0.00 3.72 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.00 0.00 29 Y 6.86 4.92 0.00 3.25 3.43 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 30 Q 7.36 4.46 0.00 1.77 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.49 0.00 0.00 0.00 0.00 0.00 1.90 2.48 0.00 31 V 9.04 4.82 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 0.98 0.00 0.00 0.97 0.00 0.00 32 S 8.73 4.92 0.00 3.16 3.34 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 33 L 8.55 4.66 0.00 0.58 0.79 0.76 0.26 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 34 N 9.07 5.96 0.00 2.37 2.43 0.00 0.00 6.61 7.05 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 *37 S 8.28 4.12 0.00 3.81 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 38 G 9.86 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 39 Y 6.63 4.52 0.00 3.03 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 H 8.84 4.58 0.00 2.88 3.16 0.00 5.86 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.80 4.94 0.00 3.10 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.60 4.77 0.00 2.27 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 43 G 8.62 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.79 4.75 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 45 S 8.66 5.39 0.00 3.82 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 46 L 9.23 4.84 0.00 1.86 1.68 1.10 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.54 4.35 1.90 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.88 0.96 0.00 0.00 48 N 7.59 4.82 0.00 2.95 3.00 0.00 0.00 6.64 7.55 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 49 S 8.71 4.31 0.00 4.06 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 0.00 50 Q 8.20 4.64 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.94 0.00 0.00 0.00 0.00 0.00 1.99 2.23 0.00 51 W 8.49 5.62 0.00 3.37 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 52 V 9.03 5.05 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 1.14 0.00 0.00 0.99 0.00 0.00 53 V 8.79 4.91 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.02 0.00 0.00 54 S 9.16 5.28 0.00 3.87 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.44 4.53 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.41 3.77 0.26 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 57 H 8.20 4.53 0.00 3.36 3.57 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.84 4.64 0.00 3.18 3.33 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 59 Y 7.67 4.18 0.00 3.00 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 60 K 6.78 3.67 0.00 1.50 1.35 0.00 1.13 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.68 0.88 7.81 61 S 8.13 4.08 0.00 3.75 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.39 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.40 4.27 1.86 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 1.57 1.00 0.90 0.00 0.00 64 Q 8.94 4.83 0.00 1.99 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.39 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 65 V 8.82 4.42 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 0.98 0.00 0.00 0.89 0.00 0.00 66 R 8.91 5.03 0.00 1.52 1.66 0.00 2.21 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 1.12 1.14 0.00 67 L 9.19 4.61 0.00 1.59 1.72 0.97 0.81 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 *69 G 8.27 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 0.00 0.00 0.00 70 E 8.05 4.33 0.00 2.15 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 2.45 2.05 0.00 71 D 8.29 4.82 0.00 2.78 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 72 N 8.80 5.04 0.00 2.85 2.82 0.00 0.00 7.17 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 73 I 8.57 3.97 1.44 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.94 -0.43 0.00 0.00 74 N 8.47 4.74 0.00 2.84 2.89 0.00 0.00 6.64 8.87 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 75 V 7.40 4.36 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.42 4.09 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 0.82 0.00 0.00 0.93 0.00 0.00 77 E 10.78 4.52 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 78 G 7.78 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 79 N 7.73 4.82 0.00 2.78 2.83 0.00 0.00 7.06 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 80 E 7.82 4.64 0.00 1.59 1.80 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 2.61 2.48 0.00 81 Q 9.07 4.42 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.79 0.00 0.00 0.00 0.00 0.00 2.26 2.33 0.00 82 F 8.93 5.51 0.00 2.73 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.80 4.67 1.87 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 1.25 0.70 0.96 0.00 0.00 84 S 8.73 4.68 0.00 3.74 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 85 A 8.40 4.33 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 9.03 4.33 0.00 3.67 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 87 K 7.66 4.73 0.00 1.59 1.64 0.00 1.66 0.00 0.00 1.87 0.00 0.00 3.16 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.41 7.81 88 S 8.85 5.03 0.00 4.13 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 89 I 9.11 4.34 2.08 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.97 1.08 0.00 0.00 90 V 8.17 4.13 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 0.67 0.00 0.00 0.71 0.00 0.00 91 H 8.68 3.95 0.00 2.78 3.09 0.00 5.65 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.27 0.00 2.24 2.23 0.00 3.53 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.11 0.00 93 S 7.96 4.68 0.00 4.05 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 94 Y 8.18 4.44 0.00 3.09 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.40 4.74 0.00 2.57 2.45 0.00 0.00 6.54 6.82 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 96 S 7.81 3.96 0.00 3.93 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 97 N 8.66 4.38 0.00 2.69 2.78 0.00 0.00 6.88 7.48 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 98 T 7.76 3.91 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 1.12 0.00 0.00 99 L 8.03 3.80 0.00 1.47 1.86 0.32 0.95 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 0.00 100 N 7.81 4.42 0.00 2.78 2.67 0.00 0.00 7.31 6.69 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 0.00 101 N 8.72 4.92 0.00 3.05 2.66 0.00 0.00 7.23 8.27 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 0.00 102 D 7.97 4.61 0.00 3.04 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 0.00 103 I 7.11 4.69 1.39 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.05 0.03 0.00 0.00 104 M 9.22 5.39 0.00 2.08 1.82 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.63 0.00 105 L 9.29 5.34 0.00 1.86 1.95 0.31 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.04 5.01 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 1.20 0.82 0.95 0.00 0.00 107 K 8.50 3.42 0.00 0.79 1.11 0.00 1.30 0.00 0.00 1.32 0.00 0.00 2.61 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.70 0.21 7.81 108 L 8.30 4.45 0.00 1.50 1.58 0.96 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.61 4.23 0.00 1.83 1.80 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.35 7.81 110 S 7.47 4.56 0.00 3.80 3.63 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 0.00 111 A 8.43 4.43 1.24 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 0.00 0.00 0.00 112 A 9.02 4.33 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 0.00 113 S 9.27 4.54 0.00 3.72 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.39 4.73 0.00 1.66 1.62 0.96 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.39 4.42 0.00 2.75 2.44 0.00 0.00 6.98 7.38 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 0.00 116 S 8.71 4.39 0.00 3.92 3.95 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 0.00 117 R 7.91 4.03 0.00 1.94 2.22 0.00 3.36 0.00 0.00 3.16 7.38 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.44 0.00 3.84 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.49 4.48 0.00 2.95 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.87 4.61 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 0.00 130 S 8.13 4.08 0.00 3.84 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 *132 A 8.22 4.24 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 0.00 133 G 9.05 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 0.00 134 T 7.46 3.94 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 1.14 0.00 0.00 135 Q 8.58 4.62 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.78 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 136 C 9.38 5.27 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 0.00 137 L 8.93 5.24 0.00 1.77 1.57 1.02 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.23 5.26 1.89 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 1.64 0.99 0.00 0.00 139 S 9.12 4.99 0.00 3.48 3.56 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 0.00 140 G 7.66 3.90 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 0.00 0.00 0.00 141 W 8.53 4.68 0.00 3.12 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 0.00 142 G 8.38 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 0.00 0.00 0.00 143 N 8.85 3.88 0.00 2.41 2.72 0.00 0.00 7.33 7.55 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 0.00 144 T 8.33 4.85 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 1.27 0.00 0.00 145 K 7.73 4.63 0.00 1.78 1.68 0.00 1.58 0.00 0.00 1.66 0.00 0.00 3.10 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.29 1.44 7.81 146 S 8.79 4.22 0.00 3.86 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 0.00 147 S 9.00 4.53 0.00 3.81 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 0.00 148 G 7.29 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 7.79 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 1.15 0.00 0.00 150 S 9.45 4.37 0.00 3.73 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 0.00 151 Y 8.59 5.02 0.00 3.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.64 0.00 2.48 2.12 0.00 4.14 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 2.21 2.07 0.00 153 D 8.84 4.52 0.00 2.81 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 0.00 154 V 7.42 5.54 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.97 0.00 0.00 155 L 8.52 3.29 0.00 1.18 1.38 -0.55 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.13 4.90 0.00 1.69 1.49 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.81 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.47 7.81 157 C 8.35 5.21 0.00 1.58 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.16 4.74 0.00 1.71 1.44 1.02 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.05 5.07 0.00 1.82 1.85 0.00 1.81 0.00 0.00 1.96 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.49 1.74 7.81 160 A 9.23 4.80 1.20 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 0.00 0.00 161 P 0.00 4.89 0.00 2.01 2.08 0.00 3.06 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.70 0.00 162 I 8.54 4.23 1.73 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.48 0.75 0.00 0.00 163 L 8.62 4.82 0.00 1.56 1.60 0.92 1.00 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 0.00 164 S 8.40 4.40 0.00 4.00 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 0.00 165 D 8.73 4.40 0.00 2.80 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 0.00 166 S 7.98 4.18 0.00 4.05 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 0.00 167 S 8.11 4.12 0.00 4.05 3.95 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 0.00 168 C 8.44 4.32 0.00 3.19 3.32 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 0.00 169 K 8.51 4.00 0.00 1.86 1.89 0.00 1.85 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.63 7.81 170 S 8.17 4.22 0.00 4.00 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 0.00 171 A 8.03 4.00 1.08 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 0.00 0.00 172 Y 7.79 4.94 0.00 3.13 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 0.00 173 P 0.00 4.64 0.00 2.09 2.05 0.00 3.87 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.21 0.00 174 G 9.04 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 0.00 175 Q 8.08 4.42 0.00 2.51 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.55 0.00 0.00 0.00 0.00 0.00 2.32 2.60 0.00 176 I 7.84 4.32 1.98 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 1.84 0.94 1.00 0.00 0.00 177 T 8.27 4.50 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 1.26 0.00 0.00 178 S 8.56 4.23 0.00 4.00 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 0.00 179 N 8.04 4.92 0.00 2.85 3.09 0.00 0.00 6.55 7.72 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 0.00 180 M 7.94 5.57 0.00 1.87 2.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.59 0.00 181 F 8.66 5.10 0.00 3.09 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 0.00 182 C 9.04 5.57 0.00 2.98 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 0.00 183 A 9.73 5.03 1.15 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 0.00 0.00 184A G 7.09 3.95 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 0.00 0.00 0.00 184 Y 8.42 4.66 0.00 3.05 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.60 4.26 0.00 1.73 1.88 0.92 0.96 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 0.00 186 E 8.22 3.92 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 187 G 7.50 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 0.00 0.00 0.00 188A G 9.33 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 0.00 188 K 7.39 4.80 0.00 1.52 1.70 0.00 0.72 0.00 0.00 1.35 0.00 0.00 2.54 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.34 1.14 7.81 189 D 8.76 4.74 0.00 2.85 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.76 4.89 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 0.00 191 C 9.54 4.90 0.00 2.89 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 0.00 192 Q 8.58 4.45 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 5.49 0.00 0.00 0.00 0.00 0.00 2.55 2.53 0.00 193 G 9.24 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 0.00 0.00 0.00 0.00 194 D 8.51 4.65 0.00 2.95 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 0.00 195 S 8.07 4.45 0.00 4.00 3.88 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 0.00 196 G 8.79 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 0.00 0.00 0.00 197 G 7.79 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.06 0.00 2.36 2.39 0.00 3.69 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 2.20 2.19 0.00 199 V 8.74 4.61 2.24 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 0.93 0.00 0.00 0.63 0.00 0.00 200 V 8.76 4.79 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 0.88 0.00 0.00 0.68 0.00 0.00 201 C 8.90 5.07 0.00 2.76 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 0.00 202 S 9.83 3.70 0.00 3.95 3.90 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 0.00 203 G 8.50 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 0.00 204 K 7.87 4.68 0.00 1.90 1.64 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.37 7.81 *209 L 8.29 4.40 0.00 1.52 1.64 1.06 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 9.01 4.49 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.36 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 211 G 8.00 5.35 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 0.00 212 I 8.21 5.31 1.91 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 1.29 0.81 0.94 0.00 0.00 213 V 8.91 3.70 2.37 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 0.99 0.00 0.00 1.18 0.00 0.00 214 S 8.52 4.81 0.00 3.91 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 0.00 215 W 7.77 5.07 0.00 3.31 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 0.00 216 G 8.55 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.43 4.64 0.00 4.13 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 *219 G 7.94 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 0.00 0.00 0.00 0.00 220 C 8.31 4.92 0.00 2.96 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 221A A 9.17 4.06 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 7.37 4.46 0.00 2.14 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.92 0.00 0.00 0.00 0.00 0.00 2.58 2.61 0.00 222 K 8.56 4.16 0.00 1.72 1.74 0.00 1.94 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.56 1.43 7.81 223 N 9.12 4.29 0.00 2.84 2.81 0.00 0.00 6.81 7.13 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 0.00 224 K 7.71 4.31 0.00 1.75 1.80 0.00 1.74 0.00 0.00 1.36 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.51 7.81 225 P 0.00 4.58 0.00 2.14 2.09 0.00 3.59 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 226 G 8.49 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.58 4.54 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 0.00 0.00 0.39 0.00 0.00 -0.71 0.00 0.00 228 Y 8.11 4.96 0.00 1.43 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 0.00 0.00 0.00 229 T 8.67 4.43 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 1.19 0.00 0.00 230 K 9.32 5.04 0.00 2.20 1.97 0.00 1.82 0.00 0.00 1.90 0.00 0.00 3.09 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.60 7.81 231 V 8.74 3.93 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.03 0.00 0.00 232 C 8.40 4.56 0.00 3.16 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 0.00 233 N 8.11 4.26 0.00 2.29 2.44 0.00 0.00 6.97 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Y 8.18 4.77 0.00 3.17 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.83 3.70 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 1.09 0.00 0.00 1.08 0.00 0.00 236 S 8.09 4.14 0.00 3.98 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 0.00 237 W 8.34 4.17 0.00 3.56 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 0.00 238 I 8.29 3.26 2.02 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.99 0.77 0.00 0.00 239 K 7.98 3.77 0.00 1.75 1.77 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.52 7.81 240 Q 7.87 3.89 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.00 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 241 T 7.48 3.70 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 242 I 7.17 2.65 1.56 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.07 0.38 0.00 0.00 243 A 7.65 3.93 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 0.00 244 S 7.76 4.36 0.00 3.94 3.90 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 0.00 245 N 7.83 4.70 0.00 2.96 2.95 0.00 0.00 6.83 7.82 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 * Residues marked with a * may have inaccurate shift predictions.