NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2593 7.8827 121.4510 61.2393 38.5873 173.8004 17 V 4.2716 8.7448 126.5133 61.9495 32.5366 174.5739 18 G 3.9242 8.5013 114.2262 46.8128 0.0000 173.4493 19 G 4.2406 7.7557 110.1464 44.4192 0.0000 172.7594 20 Y 4.9534 7.8965 117.2647 55.3761 42.1778 174.9194 21 T 4.1887 8.5871 117.4924 64.0599 68.3877 175.1187 22 C 4.2706 8.5613 125.5519 60.1304 36.9415 175.1826 23 G 4.0895 8.6863 105.9189 44.1820 0.0000 172.6895 24 A 4.0486 8.6830 124.8085 53.8037 18.4843 177.0859 25 N 4.2288 8.7900 120.6657 54.5978 36.2803 175.3416 26 T 4.2554 7.5141 107.6019 62.4676 70.0682 175.1108 27 V 4.0465 6.9903 121.7902 59.9019 31.3384 173.6405 28 P 4.6624 0.0000 0.0000 64.0661 31.9505 177.6502 29 Y 5.0720 6.9169 114.1052 56.6204 38.8132 174.6801 30 Q 4.6059 7.3350 123.5586 56.2545 29.3227 175.4165 31 V 4.9000 9.0117 118.7273 59.6683 36.4023 174.1291 32 S 4.9292 8.7647 116.7116 56.5930 65.1214 172.6262 33 L 4.6122 8.5593 127.4113 53.3083 43.2143 174.9157 34 N 5.6396 8.8339 122.9264 50.1441 41.7713 174.8505 *37 S 4.1945 8.3981 120.9585 58.4133 63.3486 173.9675 38 G 4.0760 9.5990 109.1480 45.5414 0.0000 173.0181 39 Y 4.5087 6.7263 114.9572 56.1289 39.9639 172.7078 40 H 4.4999 8.9917 121.7145 56.4328 30.1620 174.6935 41 F 5.0706 7.8734 120.6621 57.0925 39.8965 174.0928 42 C 4.6269 6.8171 114.9837 56.3052 44.7762 173.1702 43 G 4.1702 8.6206 108.9988 45.7651 0.0000 172.4027 44 G 4.6638 7.4428 102.9576 46.6047 0.0000 172.7141 45 S 5.4595 8.6548 115.8254 56.4290 66.7799 173.5488 46 L 4.9280 9.1894 127.2740 54.3698 42.6538 176.7919 47 I 4.5755 8.0794 118.6665 60.2794 38.6336 174.6160 48 N 4.6333 7.6057 117.5273 52.9400 41.5013 175.1566 49 S 4.3053 8.6143 117.3224 60.6596 63.3959 174.8475 50 Q 4.6099 8.9873 120.6297 55.2098 30.9599 174.3448 51 W 5.5092 8.3842 116.9571 55.4626 33.5818 174.3829 52 V 5.1035 9.0597 122.5518 61.1191 34.7218 174.3713 53 V 4.9803 8.9446 126.7951 60.5904 34.1040 174.9662 54 S 4.8777 9.0263 116.6979 57.9162 65.9591 172.4049 55 A 4.5953 8.5192 120.5359 50.9449 20.1486 178.6305 56 A 3.8420 8.2308 123.7898 55.1760 18.5019 179.3216 57 H 4.4979 7.8768 109.4397 57.3810 28.7941 175.2903 58 C 4.7576 7.6992 117.3690 57.0408 40.2679 173.0789 59 Y 4.2301 7.7079 122.5940 57.5760 38.7659 175.0764 60 K 4.0228 7.1332 126.1683 55.0385 35.1055 174.9117 61 S 4.2768 8.0233 118.0586 58.0379 64.3945 173.3329 62 G 3.7941 8.3307 106.6577 46.7193 0.0000 173.9356 63 I 4.0296 7.5506 120.0732 60.6502 38.7986 175.0784 64 Q 4.8250 8.9347 128.2308 54.2335 31.5660 174.1420 65 V 4.4977 8.8963 127.0455 61.7539 33.6662 174.5576 66 R 5.1103 8.9279 127.1048 54.6092 32.5191 175.2021 67 L 4.7572 9.1345 124.4912 52.6578 45.0449 177.4684 *69 G 3.7788 8.2449 106.7627 45.3977 0.0000 172.8450 70 E 4.3699 8.1979 118.4763 55.6695 29.9083 174.3971 71 D 4.7994 7.9463 118.3999 55.0980 43.7209 174.3205 72 N 4.9660 8.9665 122.9097 52.5621 38.8042 176.1982 73 I 3.8629 8.4200 120.1858 62.2664 37.7661 176.4074 74 N 4.7411 8.6745 118.1659 53.5088 39.4628 175.3656 75 V 4.4180 7.3262 109.8758 59.0513 35.2303 175.4584 76 V 3.9854 8.4343 123.6328 63.0251 31.2243 175.5163 77 E 4.3327 9.7231 127.3999 56.2479 30.0675 177.3374 78 G 3.9351 8.7680 109.8524 45.8165 0.0000 174.5665 79 N 4.8650 8.0108 115.2364 51.8989 38.5562 179.7210 80 E 5.2315 7.6596 117.2833 56.9142 31.1002 176.6009 81 Q 4.3223 8.5310 119.6641 54.8545 32.8801 173.7344 82 F 5.5428 8.7712 123.5996 56.0822 40.8281 175.6555 83 I 4.7850 8.9944 124.8464 59.4140 41.0670 175.4608 84 S 4.7746 8.7226 121.0214 57.8918 64.7850 173.0398 85 A 4.6641 8.4339 123.4373 51.9000 18.5698 177.6256 86 S 4.5748 8.9004 115.7374 59.1778 64.9502 174.6893 87 K 4.7301 7.5838 118.0666 54.9176 36.7860 175.6484 88 S 5.0441 8.7539 118.4062 57.2103 66.2684 173.6965 89 I 4.4489 9.5088 128.1122 59.5600 38.6641 175.5068 90 V 4.2896 8.3315 127.4963 61.9259 32.8000 175.1747 91 H 3.8544 8.8085 127.0287 55.8652 29.9215 174.3208 92 P 4.2361 0.0000 0.0000 65.5041 31.0077 177.0306 93 S 4.6722 7.8728 112.4281 58.0189 62.8326 173.2354 94 Y 4.2894 8.2494 123.7842 57.8102 39.0502 174.5369 95 N 4.7305 8.2777 125.8005 51.3409 40.1991 175.3146 96 S 3.9305 8.0438 122.8368 60.7371 63.7297 176.1471 97 N 4.3991 8.1294 117.9262 55.0345 37.6406 181.2488 98 T 3.9490 8.1223 107.6424 61.5302 69.4085 175.6621 99 L 3.7542 7.9795 120.9048 55.0399 39.7944 173.8725 100 N 4.5063 7.6178 118.4913 54.5778 39.4352 174.5883 101 N 4.8004 8.7446 119.8154 54.5608 35.7955 175.4181 102 D 4.7806 8.0647 117.2197 53.3887 39.2518 174.5363 103 I 4.8042 7.1811 120.8498 59.3276 42.4271 173.0927 104 M 5.5084 9.1742 126.7500 54.2811 36.2680 173.1413 105 L 5.4600 9.4814 124.8167 53.1093 45.1616 175.3803 106 I 4.9221 9.1175 124.0448 59.4050 40.4218 174.3644 107 K 3.4791 8.5920 129.3366 54.7377 33.3297 175.8802 108 L 4.3204 8.2404 127.8804 54.1782 41.9139 177.2048 109 K 4.1514 8.7958 124.5599 59.0516 32.6142 176.9870 110 S 4.6337 7.6851 111.2451 55.9139 66.1909 173.0335 111 A 4.4333 8.3332 122.8707 51.7852 18.7847 177.4615 112 A 4.2908 9.2283 126.3504 52.5729 19.6332 178.3029 113 S 4.5633 9.0220 119.6436 57.4965 62.8508 174.8934 114 L 4.5865 8.4520 128.0210 53.0972 42.5866 177.7095 *115 N 4.7180 8.6065 118.4322 52.8268 39.3626 173.4263 116 S 4.4401 8.5665 118.1550 60.9676 63.0300 176.0119 117 R 4.3095 7.9350 117.0434 57.2149 29.6056 179.5251 118 V 4.6916 7.6449 115.5203 61.4340 34.0665 173.7280 119 A 4.8583 8.5840 127.7789 50.7863 22.9655 175.2498 120 S 5.1430 8.6666 114.1898 57.8207 65.0094 173.0610 121 I 4.4191 8.4067 121.4052 59.1890 39.8861 175.4586 122 S 4.4452 8.3666 124.1094 58.2411 64.1197 173.8471 123 L 4.3946 8.3509 123.1276 53.4582 42.4029 175.3388 124 P 4.4210 0.0000 0.0000 63.7207 32.1434 177.2607 125 T 4.0380 8.3011 112.2647 62.7431 69.0924 175.1306 *127 S 4.4680 7.5439 112.4759 58.1001 64.0564 174.1498 128 C 4.3552 8.4276 117.9658 56.8857 40.5775 173.6189 129 A 4.4419 8.0517 125.4490 51.3094 19.8020 177.1739 130 S 4.4339 8.0567 114.0232 56.6510 65.2116 173.2097 *132 A 4.3054 8.1958 123.3265 53.5355 19.2219 177.1716 133 G 3.9852 9.2576 111.1823 45.3081 0.0000 174.3029 134 T 3.9939 7.8844 120.0068 64.3654 69.4558 174.2428 135 Q 4.7675 8.5926 126.7431 55.3335 29.2756 173.2545 136 C 5.2522 9.3925 120.9053 54.1668 46.5058 172.5968 137 L 5.1530 8.8747 123.0722 53.6810 43.6852 175.0206 138 I 5.2749 9.2098 127.7354 58.8921 39.7105 174.9958 139 S 4.8893 8.6464 119.4677 56.4241 66.5519 173.0421 140 G 3.7180 7.4093 108.2476 46.2433 0.0000 173.0438 141 W 4.5974 8.5859 116.8421 56.2554 29.3803 176.9407 142 G 4.1238 8.3134 109.1706 44.2631 0.0000 173.4855 143 N 3.8495 8.7201 118.4618 54.3313 38.9162 174.5906 144 T 5.0965 8.3112 113.6100 60.5882 69.6117 174.3940 145 K 4.6264 7.7752 121.6805 54.7505 34.7844 176.2388 146 S 4.2166 8.9055 120.2146 61.0523 63.5191 175.0842 *147 S 4.4981 8.8598 118.5900 56.6828 62.3617 175.1570 148 G 3.9673 7.4922 115.6660 43.9899 0.0000 170.8289 149 T 4.5252 7.8800 113.9664 59.8418 71.9113 170.0803 150 S 4.2925 9.3910 123.6633 56.6713 65.0556 172.0516 151 Y 4.8694 8.4754 125.7070 55.8663 38.7976 174.4435 152 P 4.6354 0.0000 0.0000 62.5709 32.8378 176.1777 153 D 4.5334 8.7997 118.9445 57.0154 41.2794 177.3501 154 V 5.2920 7.4188 109.7199 58.9303 33.9109 175.7477 155 L 3.3218 8.2951 124.6737 55.0033 43.0245 175.9604 156 K 4.8273 8.2588 125.0877 54.9488 35.0020 174.6350 157 C 5.3044 8.7044 119.5899 55.2052 41.0491 172.9774 158 L 4.9608 8.6488 122.4827 53.9212 45.6145 174.3705 159 K 5.1922 9.0237 125.5705 55.1467 33.5460 175.7482 160 A 4.8710 8.9788 126.2748 49.6116 23.2020 173.2224 161 P 5.0622 0.0000 0.0000 61.6594 33.9360 175.1734 162 I 4.2423 8.6371 122.9027 61.5046 38.1112 175.3889 163 L 5.0463 8.7043 126.7252 52.7431 43.9249 176.8807 164 S 4.2795 8.6057 117.8281 58.7930 63.9306 175.6766 165 D 4.4974 8.8055 124.3974 58.6559 39.4311 180.0319 166 S 4.3489 8.0031 114.8577 61.6198 63.2041 176.7197 167 S 4.2425 7.8055 119.5377 60.3409 62.7732 175.5728 168 C 4.3164 8.2750 122.1696 59.6501 43.2257 175.8409 169 K 4.0132 8.1260 119.0193 59.2293 31.4085 179.2102 170 S 4.2949 8.2658 114.4525 60.9531 62.8435 176.4374 171 A 3.9794 7.9833 124.0524 53.6381 19.6627 177.1723 172 Y 4.7206 7.8426 114.8480 54.5383 38.3321 171.4789 173 P 4.4263 0.0000 0.0000 64.0100 32.0445 176.4439 174 G 4.0751 9.0286 110.8740 46.6650 0.0000 173.8431 175 Q 4.5762 8.1677 118.1849 55.2718 31.1369 176.0845 176 I 4.2510 7.9715 119.1725 60.6438 38.0022 175.3884 177 T 4.6196 8.2436 115.2227 59.4844 71.0809 175.1883 178 S 4.2836 8.5536 115.0932 60.6045 63.2633 174.4993 179 N 4.9505 8.2242 118.4452 53.2733 38.4658 173.8539 180 M 5.5884 7.8819 117.2333 53.6753 36.0366 174.7785 181 F 5.1368 8.8307 115.3052 55.7243 42.0808 172.7625 182 C 5.4401 8.9848 116.8381 55.9980 42.0867 172.4866 183 A 5.0050 8.9420 121.8605 51.2465 22.4632 175.8923 184A G 4.1084 6.8203 107.0373 44.6979 0.0000 172.4034 184 Y 4.7058 8.3755 118.7371 55.9860 41.3207 176.5948 185 L 4.0974 8.7863 126.7561 58.1732 42.0612 179.6827 186 E 3.8824 8.2260 113.5429 56.8642 29.9452 181.8996 187 G 3.8170 7.9508 104.9736 45.4971 0.0000 173.6614 188A G 4.0632 9.0851 106.2425 45.0811 0.0000 173.3635 188 K 5.0704 7.2713 116.8883 55.0951 35.5171 175.2731 189 D 4.6147 8.8135 123.4891 53.9262 45.6888 174.7657 190 S 4.9287 8.7408 116.4326 57.9907 65.3289 173.0702 191 C 4.7343 9.2738 118.9018 55.4772 46.0137 172.3399 192 Q 4.3871 8.6846 119.1669 57.9327 28.3564 178.0414 193 G 4.2722 9.2889 110.5912 45.6118 0.0000 173.6877 194 D 4.7321 8.3708 118.7567 54.8707 41.9869 176.7557 195 S 4.4563 8.0797 115.3778 60.4518 63.4160 175.6655 196 G 4.2443 8.7932 112.1158 46.4050 0.0000 173.7451 197 G 4.3007 7.8335 107.5810 45.1035 0.0000 171.3249 198 P 5.0488 0.0000 0.0000 62.4762 33.4040 175.7844 199 V 4.5923 8.4855 120.7999 61.3772 33.9364 173.7281 200 V 4.7437 8.6486 128.5737 61.2816 33.6355 173.7482 201 C 5.1056 8.9120 127.4069 56.3116 43.9326 175.1936 *202 S 3.7728 9.7803 119.1207 59.1883 59.3153 170.2957 203 G 3.9797 8.5161 106.6062 46.3662 0.0000 174.2145 204 K 4.6665 7.6504 118.0630 53.1005 34.9601 175.4557 *209 L 4.2116 8.2519 122.7121 55.4294 42.2093 175.8686 210 Q 4.4778 8.8895 126.1216 56.8389 30.9299 175.8215 211 G 5.2832 7.9937 104.4333 45.8410 0.0000 171.4477 212 I 5.2300 8.2129 119.4601 58.8755 40.8742 175.5210 213 V 3.7065 8.8945 127.5569 64.1613 31.8032 174.2090 214 S 4.8433 8.4780 120.9301 58.5233 64.1614 174.2320 215 W 5.1118 7.7878 113.9790 55.8561 32.4106 172.5609 216 G 3.3760 7.9670 105.4224 45.7745 0.0000 172.5977 217 S 4.4714 8.2206 114.3341 56.4008 63.6079 173.4756 *219 G 4.1628 8.0327 117.2039 45.5079 0.0000 170.4945 220 C 4.8557 8.0891 114.9371 56.3725 43.7690 173.8345 221A A 4.4238 8.9680 125.1765 53.1362 16.6040 177.0323 221 Q 4.4707 7.5541 119.4082 57.1380 29.6342 176.9123 222 K 4.2121 8.4131 122.6231 56.0177 32.2627 176.8857 223 N 4.3614 9.4150 119.0870 53.3579 36.8630 175.5101 224 K 4.3514 7.5446 118.0092 53.6546 32.3839 174.0106 225 P 4.6170 0.0000 0.0000 62.0590 33.1387 177.0731 226 G 3.6367 8.4511 106.8404 46.0536 0.0000 172.6733 227 V 4.3550 7.6270 122.1551 60.7751 33.6866 174.2461 228 Y 4.8605 8.2388 124.3419 56.0201 42.3014 174.8259 229 T 4.4280 8.5565 119.3659 63.3586 69.9312 174.4387 230 K 5.0437 9.5728 128.4995 55.7589 31.6863 177.2486 231 V 3.9213 8.9532 127.3410 65.9527 31.3912 174.9931 232 C 4.3019 8.3733 112.6511 58.4586 41.3611 174.8773 233 N 4.2644 7.8717 116.5762 54.3472 38.5871 174.9343 234 Y 4.7905 8.0938 117.4116 57.1105 39.7227 177.3208 235 V 3.7480 8.3179 123.4965 67.0431 31.3902 178.6461 236 S 4.1537 8.0890 117.6069 63.0796 62.1996 177.8781 237 W 4.4035 8.3312 131.9563 60.2560 30.4292 177.8873 238 I 3.2135 8.5071 120.1331 64.2621 36.7561 178.3922 239 K 3.7071 8.0885 119.2395 59.6036 32.0016 179.2712 240 Q 3.8371 8.0457 119.6020 59.3412 28.7597 178.2014 241 T 3.4994 7.3270 115.9423 66.4669 68.3826 176.3297 242 I 2.1838 6.9432 120.4516 63.8234 37.0653 178.2026 243 A 4.1210 7.4568 119.9959 53.8160 18.1530 178.6233 244 S 4.7828 7.4622 111.5855 58.0710 64.3418 174.0667 245 N 4.6303 7.9748 125.1422 54.6266 39.5649 174.3513 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 4.26 1.80 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 1.38 0.84 0.92 0.00 0.00 17 V 8.74 4.27 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 1.03 0.00 0.00 0.89 0.00 0.00 18 G 8.50 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.76 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.90 4.95 0.00 2.96 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 21 T 8.59 4.19 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 8.56 4.27 0.00 2.75 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 23 G 8.69 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 24 A 8.68 4.05 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 25 N 8.79 4.23 0.00 2.87 2.90 0.00 0.00 7.14 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 26 T 7.51 4.26 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 1.28 0.00 0.00 27 V 6.99 4.05 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.66 0.00 2.28 2.11 0.00 3.86 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.21 0.00 29 Y 6.92 5.07 0.00 3.24 3.36 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 30 Q 7.33 4.61 0.00 1.77 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.74 0.00 0.00 0.00 0.00 0.00 1.81 2.42 0.00 31 V 9.01 4.90 2.13 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 0.88 0.00 0.00 1.01 0.00 0.00 32 S 8.76 4.93 0.00 3.24 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 8.56 4.61 0.00 0.57 1.01 0.74 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.83 5.64 0.00 2.44 2.51 0.00 0.00 6.66 7.19 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 *37 S 8.40 4.19 0.00 3.43 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 38 G 9.60 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.73 4.51 0.00 3.05 2.98 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 40 H 8.99 4.50 0.00 2.92 3.22 0.00 5.86 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 41 F 7.87 5.07 0.00 3.08 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 42 C 6.82 4.63 0.00 2.02 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 8.62 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 0.00 0.00 0.00 44 G 7.44 4.66 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 45 S 8.65 5.46 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 9.19 4.93 0.00 1.86 1.68 1.09 0.96 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 47 I 8.08 4.58 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 1.29 0.92 0.99 0.00 0.00 48 N 7.61 4.63 0.00 2.77 2.95 0.00 0.00 6.89 7.14 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 49 S 8.61 4.31 0.00 4.23 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.99 4.61 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.78 0.00 0.00 0.00 0.00 0.00 1.86 2.18 0.00 51 W 8.38 5.51 0.00 3.31 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 52 V 9.06 5.10 2.13 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 1.16 0.00 0.00 0.98 0.00 0.00 53 V 8.94 4.98 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 0.82 0.00 0.00 1.03 0.00 0.00 54 S 9.03 4.88 0.00 3.86 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 55 A 8.52 4.60 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 56 A 8.23 3.84 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 7.88 4.50 0.00 3.40 3.54 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.70 4.76 0.00 3.18 3.22 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 59 Y 7.71 4.23 0.00 3.00 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 60 K 7.13 4.02 0.00 1.29 1.19 0.00 0.78 0.00 0.00 0.61 0.00 0.00 2.38 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.87 1.03 7.81 61 S 8.02 4.28 0.00 3.94 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 62 G 8.33 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 63 I 7.55 4.03 1.84 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 1.38 0.82 0.92 0.00 0.00 64 Q 8.93 4.82 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.86 0.00 0.00 0.00 0.00 0.00 2.08 2.22 0.00 65 V 8.90 4.50 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.89 0.00 0.00 66 R 8.93 5.11 0.00 1.47 1.70 0.00 2.58 0.00 0.00 2.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.14 0.00 67 L 9.13 4.76 0.00 1.66 1.65 1.04 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.24 3.78 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 0.00 0.00 0.00 70 E 8.20 4.37 0.00 2.12 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 2.34 2.02 0.00 71 D 7.95 4.80 0.00 2.78 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.97 4.97 0.00 2.84 2.74 0.00 0.00 7.16 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 I 8.42 3.86 1.41 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.51 -0.65 0.00 0.00 74 N 8.67 4.74 0.00 2.82 2.89 0.00 0.00 6.71 7.52 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 75 V 7.33 4.42 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 0.68 0.00 0.00 0.95 0.00 0.00 76 V 8.43 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 0.72 0.00 0.00 0.98 0.00 0.00 77 E 9.72 4.33 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.45 0.00 78 G 8.77 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 79 N 8.01 4.87 0.00 2.64 2.77 0.00 0.00 6.92 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 80 E 7.66 5.23 0.00 1.59 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 2.66 2.35 0.00 81 Q 8.53 4.32 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.89 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 82 F 8.77 5.54 0.00 2.81 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.99 4.79 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 1.30 0.71 0.94 0.00 0.00 84 S 8.72 4.77 0.00 3.86 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 85 A 8.43 4.66 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 86 S 8.90 4.57 0.00 3.76 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 87 K 7.58 4.73 0.00 1.56 1.71 0.00 1.60 0.00 0.00 1.91 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.42 7.81 88 S 8.75 5.04 0.00 4.01 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 9.51 4.45 2.05 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.80 1.11 0.00 0.00 90 V 8.33 4.29 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 0.66 0.00 0.00 0.77 0.00 0.00 91 H 8.81 3.85 0.00 2.93 3.11 0.00 5.66 0.00 0.00 0.00 0.00 6.72 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 4.24 0.00 2.20 2.23 0.00 3.10 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.03 0.00 93 S 7.87 4.67 0.00 3.93 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 8.25 4.29 0.00 3.04 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 8.28 4.73 0.00 2.54 2.41 0.00 0.00 6.65 7.53 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 96 S 8.04 3.93 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 97 N 8.13 4.40 0.00 2.77 2.76 0.00 0.00 6.68 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 98 T 8.12 3.95 4.14 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 1.11 0.00 0.00 99 L 7.98 3.75 0.00 1.53 1.83 0.08 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.62 4.51 0.00 2.69 2.64 0.00 0.00 7.25 6.70 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 0.00 101 N 8.74 4.80 0.00 3.06 2.67 0.00 0.00 7.24 8.06 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 0.00 102 D 8.06 4.78 0.00 3.11 2.70 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 0.00 103 I 7.18 4.80 1.43 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 1.34 1.23 0.12 0.00 0.00 104 M 9.17 5.51 0.00 2.26 1.83 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.65 0.00 105 L 9.48 5.46 0.00 1.73 1.88 0.11 0.74 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 0.00 106 I 9.12 4.92 1.90 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 1.18 0.88 0.87 0.00 0.00 107 K 8.59 3.48 0.00 0.79 1.07 0.00 1.45 0.00 0.00 1.40 0.00 0.00 2.69 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.80 0.21 7.81 108 L 8.24 4.32 0.00 1.45 1.56 0.96 0.84 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 0.00 109 K 8.80 4.15 0.00 1.91 1.80 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.35 7.81 110 S 7.69 4.63 0.00 3.92 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.33 4.43 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 0.00 112 A 9.23 4.29 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 0.00 113 S 9.02 4.56 0.00 3.39 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 0.00 114 L 8.45 4.59 0.00 1.65 1.65 0.96 1.12 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 *115 N 8.61 4.72 0.00 2.49 2.63 0.00 0.00 6.66 7.64 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 0.00 116 S 8.57 4.44 0.00 3.62 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 7.93 4.31 0.00 1.73 1.95 0.00 3.15 0.00 0.00 3.26 7.39 0.00 0.00 0.00 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1.21 0.00 0.00 *127 S 7.54 4.47 0.00 3.97 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 0.00 128 C 8.43 4.36 0.00 2.93 2.98 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 0.00 129 A 8.05 4.44 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 0.00 130 S 8.06 4.43 0.00 3.97 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 *132 A 8.20 4.31 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 0.00 133 G 9.26 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.88 3.99 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 1.15 0.00 0.00 135 Q 8.59 4.77 0.00 1.84 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.81 0.00 0.00 0.00 0.00 0.00 2.25 1.96 0.00 136 C 9.39 5.25 0.00 2.73 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 8.87 5.15 0.00 1.78 1.58 1.04 1.08 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 0.00 138 I 9.21 5.27 1.88 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.47 1.02 0.00 0.00 139 S 8.65 4.89 0.00 3.48 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 0.00 140 G 7.41 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 0.00 0.00 0.00 141 W 8.59 4.60 0.00 3.15 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 8.31 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 0.00 143 N 8.72 3.85 0.00 2.32 2.64 0.00 0.00 7.13 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 0.00 144 T 8.31 5.10 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 1.25 0.00 0.00 145 K 7.78 4.63 0.00 1.91 1.69 0.00 1.86 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 0.95 7.81 146 S 8.91 4.22 0.00 4.03 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *147 S 8.86 4.50 0.00 3.61 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 0.00 148 G 7.49 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 0.00 149 T 7.88 4.53 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 150 S 9.39 4.29 0.00 3.74 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 0.00 151 Y 8.48 4.87 0.00 2.97 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 0.00 152 P 0.00 4.64 0.00 2.46 2.10 0.00 4.13 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.04 0.00 153 D 8.80 4.53 0.00 2.80 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 0.00 154 V 7.42 5.29 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 1.09 0.00 0.00 0.97 0.00 0.00 155 L 8.30 3.32 0.00 1.29 1.28 -0.79 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.26 4.83 0.00 1.67 1.51 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.48 7.81 157 C 8.70 5.30 0.00 1.54 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 0.00 0.00 0.00 0.00 158 L 8.65 4.96 0.00 1.71 1.46 1.04 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.02 5.19 0.00 1.81 1.82 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.49 1.65 7.81 160 A 8.98 4.87 1.17 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 0.00 0.00 161 P 0.00 5.06 0.00 2.02 2.07 0.00 3.12 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.67 0.00 162 I 8.64 4.24 1.90 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 1.04 0.86 0.76 0.00 0.00 163 L 8.70 5.05 0.00 1.54 1.59 0.92 0.73 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 0.00 164 S 8.61 4.28 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 0.00 165 D 8.81 4.50 0.00 2.70 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.00 4.35 0.00 4.05 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 7.81 4.24 0.00 4.06 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 0.00 168 C 8.27 4.32 0.00 3.22 3.36 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 0.00 169 K 8.13 4.01 0.00 2.01 1.91 0.00 1.90 0.00 0.00 1.80 0.00 0.00 3.11 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.60 7.81 170 S 8.27 4.29 0.00 4.05 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 0.00 171 A 7.98 3.98 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 0.00 172 Y 7.84 4.72 0.00 3.12 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 0.00 173 P 0.00 4.43 0.00 2.08 2.07 0.00 3.88 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.23 0.00 174 G 9.03 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.17 4.58 0.00 2.52 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.96 6.72 0.00 0.00 0.00 0.00 0.00 2.27 2.55 0.00 176 I 7.97 4.25 1.98 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 1.85 0.91 1.00 0.00 0.00 177 T 8.24 4.62 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 8.55 4.28 0.00 4.00 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 0.00 179 N 8.22 4.95 0.00 2.94 3.10 0.00 0.00 6.59 7.28 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 0.00 180 M 7.88 5.59 0.00 1.82 2.00 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 2.65 2.60 0.00 181 F 8.83 5.14 0.00 3.07 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 0.00 182 C 8.98 5.44 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 8.94 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 184A G 6.82 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 0.00 0.00 0.00 184 Y 8.38 4.71 0.00 3.07 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 0.00 185 L 8.79 4.10 0.00 1.71 1.74 0.91 1.02 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 0.00 186 E 8.23 3.88 0.00 1.99 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 2.23 1.87 0.00 187 G 7.95 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A G 9.09 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 0.00 188 K 7.27 5.07 0.00 1.69 1.78 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.68 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.20 7.81 189 D 8.81 4.61 0.00 2.83 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 0.00 190 S 8.74 4.93 0.00 3.98 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 0.00 191 C 9.27 4.73 0.00 2.94 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 0.00 192 Q 8.68 4.39 0.00 2.34 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.43 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 193 G 9.29 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 0.00 194 D 8.37 4.73 0.00 2.95 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 0.00 195 S 8.08 4.46 0.00 3.98 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.79 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.83 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 0.00 0.00 0.00 0.00 198 P 0.00 5.05 0.00 2.33 2.37 0.00 3.68 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 199 V 8.49 4.59 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 0.92 0.00 0.00 0.52 0.00 0.00 200 V 8.65 4.74 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 0.93 0.00 0.00 0.72 0.00 0.00 201 C 8.91 5.11 0.00 2.79 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 *202 S 9.78 3.77 0.00 3.77 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 0.00 203 G 8.52 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 0.00 204 K 7.65 4.67 0.00 1.80 1.64 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.47 1.39 7.81 *209 L 8.25 4.21 0.00 1.50 1.63 1.00 0.76 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 0.00 210 Q 8.89 4.48 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.37 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 211 G 7.99 5.28 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 0.00 212 I 8.21 5.23 1.93 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 1.30 0.88 0.88 0.00 0.00 213 V 8.89 3.71 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 1.00 0.00 0.00 1.25 0.00 0.00 214 S 8.48 4.84 0.00 3.90 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 0.00 215 W 7.79 5.11 0.00 3.36 2.98 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 0.00 216 G 7.97 3.38 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 0.00 0.00 0.00 0.00 217 S 8.22 4.47 0.00 4.28 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 *219 G 8.03 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.09 4.86 0.00 2.95 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 8.97 4.42 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 7.55 4.47 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.93 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 222 K 8.41 4.21 0.00 1.77 1.60 0.00 1.94 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.03 7.81 223 N 9.42 4.36 0.00 2.79 2.89 0.00 0.00 6.76 8.17 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 0.00 224 K 7.54 4.35 0.00 1.66 1.78 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.49 7.81 225 P 0.00 4.62 0.00 2.13 2.10 0.00 3.67 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.01 0.00 226 G 8.45 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 0.00 227 V 7.63 4.36 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 0.33 0.00 0.00 -0.75 0.00 0.00 228 Y 8.24 4.86 0.00 1.43 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 0.00 229 T 8.56 4.43 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 1.26 0.00 0.00 230 K 9.57 5.04 0.00 2.14 1.99 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.58 7.81 231 V 8.95 3.92 2.35 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 1.22 0.00 0.00 1.15 0.00 0.00 232 C 8.37 4.30 0.00 3.15 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 7.87 4.26 0.00 2.46 2.32 0.00 0.00 6.78 8.80 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 0.00 234 Y 8.09 4.79 0.00 3.11 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 0.00 235 V 8.32 3.75 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 1.12 0.00 0.00 1.11 0.00 0.00 236 S 8.09 4.15 0.00 3.77 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 0.00 237 W 8.33 4.40 0.00 3.48 3.61 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 0.00 238 I 8.51 3.21 2.06 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.12 0.80 0.00 0.00 239 K 8.09 3.71 0.00 1.73 1.78 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.57 7.81 240 Q 8.05 3.84 0.00 2.16 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 241 T 7.33 3.50 3.22 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 0.68 0.00 0.00 242 I 6.94 2.18 1.39 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 0.75 -0.36 0.36 0.00 0.00 243 A 7.46 4.12 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 0.00 244 S 7.46 4.78 0.00 4.03 3.89 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 0.00 245 N 7.97 4.63 0.00 3.02 3.04 0.00 0.00 6.96 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.