NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.2484 8.1614 121.7839 56.4354 34.3009 177.7145 4 G 3.5668 7.9731 105.3559 45.8982 0.0000 172.1131 5 E 4.1321 9.0666 120.6088 59.3279 29.6495 177.2835 6 E 4.0684 7.9310 118.3476 58.8701 29.5414 178.2950 7 L 4.1334 7.8607 116.9831 55.2578 40.6392 177.1657 8 F 4.8577 7.9980 117.8597 57.4185 39.4564 176.8679 9 T 3.8965 8.1120 110.5155 62.6922 69.2578 173.9208 10 G 4.3209 7.1932 110.8505 43.8854 0.0000 171.6584 11 V 4.1151 8.4172 119.3935 62.8102 32.3315 176.5732 12 V 4.6620 8.7957 127.9670 60.2542 34.3450 173.0056 13 P 4.8359 0.0000 0.0000 62.9173 32.9999 175.0652 14 I 5.0795 8.7324 122.2512 59.5637 41.0513 174.3562 15 L 5.2357 8.8622 125.5196 52.8835 45.3157 175.6115 16 V 5.0037 8.8497 122.9556 61.1658 34.9682 173.9701 17 E 5.1999 9.4767 126.8288 54.5401 33.1995 174.3514 18 L 5.2347 9.2744 126.6629 53.2529 45.6742 174.5445 19 D 5.1101 8.9213 125.4631 52.4149 43.6737 175.4718 20 G 3.4650 8.6170 110.0685 44.0458 0.0000 171.4008 21 D 5.1402 8.5655 120.8690 52.6133 44.6559 174.2466 22 V 4.7244 8.8845 126.7945 61.3912 34.2357 175.1613 23 N 4.3873 10.2887 126.7108 54.2755 36.6885 175.7572 24 G 3.8583 8.5038 106.0597 45.5777 0.0000 174.2057 25 H 4.5409 8.3332 118.4273 55.0859 28.4004 174.3720 26 K 5.0159 8.4538 124.6732 55.7112 33.3628 176.2541 27 F 4.9980 8.2497 117.1400 56.9767 41.8022 172.9362 28 S 5.2287 8.6711 114.2868 56.8451 67.3340 173.2556 29 V 5.1476 8.9343 122.2836 61.3515 35.0268 174.2397 30 S 5.3226 9.3215 123.1550 56.7544 65.8888 173.3419 31 G 4.3050 9.5771 111.4841 44.4075 0.0000 171.4960 32 E 4.9882 8.5927 120.6490 53.9947 34.0005 175.7723 33 G 4.0656 8.0318 110.1211 46.1077 0.0000 171.4576 34 E 4.9386 8.0675 119.1819 55.1281 33.5488 174.9487 35 G 3.6033 8.6873 107.2206 44.4140 0.0000 171.4543 36 D 5.2380 9.3273 121.6441 51.9025 42.5007 175.6943 37 A 4.4989 9.0752 128.5325 54.8672 18.9870 179.8601 38 T 3.7538 8.1288 111.8740 66.3044 68.4320 174.3645 39 Y 4.7323 7.9372 115.5980 56.8394 38.9588 175.5799 40 G 4.4091 8.2241 108.0829 46.4771 0.0000 172.8560 41 K 4.6835 8.1373 120.0710 54.0426 34.9026 174.4998 42 L 5.1531 8.5298 126.9625 52.9585 45.5122 175.5402 43 T 4.8834 8.5104 112.8113 59.9546 71.5877 172.8836 44 L 4.9181 8.8698 125.2354 52.6222 46.9292 175.0409 45 K 4.7460 8.5359 122.8691 54.6303 34.9661 174.6740 46 F 5.4435 9.2628 126.1903 55.8229 42.0494 174.6756 47 I 5.1231 9.0522 123.1395 59.6381 40.9037 174.2322 48 C 5.1278 9.6017 128.4179 59.3878 31.3682 173.3185 49 T 4.5084 8.8480 117.2077 62.6908 69.1974 175.5652 50 T 4.4760 9.5922 112.0091 61.6563 70.9374 172.4146 51 G 4.1581 7.4241 111.5791 44.5761 0.0000 175.5109 52 K 4.3035 8.2921 126.3534 55.0807 32.6408 176.2475 53 L 3.6378 9.0757 126.7324 54.3689 42.1872 175.1172 54 P 4.3191 0.0000 0.0000 63.4751 31.8651 175.8682 55 V 4.1598 6.4430 111.0427 58.3716 35.5656 173.3505 56 P 4.3682 0.0000 0.0000 62.1888 32.0178 177.6407 57 W 4.3186 9.1512 122.8174 59.8902 28.8889 177.0319 58 P 4.5080 0.0000 0.0000 65.5611 30.5794 178.2035 59 T 4.4122 8.0551 107.1802 63.4448 69.1223 175.4580 60 L 4.6547 8.0816 121.3495 54.8975 42.1201 178.2840 61 V 3.4595 7.6045 119.1137 66.2473 31.5273 177.7174 62 T 4.1699 8.0427 107.4557 64.6820 68.8802 176.4372 63 T 4.1626 7.9382 117.9627 66.1142 69.9121 176.1593 64 L 4.2946 7.6645 120.6425 53.7732 39.8298 178.7778 *68 V 4.0644 7.2050 113.9306 61.7503 33.1800 177.3967 69 Q 4.0318 7.6167 118.4552 57.2349 29.2185 178.4949 70 C 4.0784 7.8655 112.6416 60.2141 30.0613 174.1768 71 F 4.5489 8.1125 119.0417 57.4307 38.7175 175.5615 72 S 4.6102 7.6140 117.6810 58.8760 63.6784 174.2283 73 R 4.3920 9.1382 124.7268 56.0456 30.8449 174.7988 74 Y 4.5477 8.6145 125.2788 55.7978 38.8712 174.2333 75 P 4.3086 0.0000 0.0000 62.5877 32.5044 176.6423 76 D 4.3761 9.0441 121.0975 57.9223 40.9976 178.2990 77 H 4.4827 8.2409 111.3555 57.4068 28.9384 175.3960 78 M 4.6644 8.0455 120.2330 54.8398 32.0101 177.6344 79 K 3.8946 8.0485 121.3627 59.7065 32.5858 178.4983 80 Q 4.0978 7.9460 115.2570 57.5586 28.9297 175.8755 81 H 4.7307 8.1363 115.2325 55.7802 28.9175 174.9945 82 D 3.7184 7.0863 121.5047 52.0540 39.6877 176.3258 83 F 4.1241 8.0328 127.3758 60.0856 39.3601 176.0674 84 F 3.9015 7.5193 115.2706 60.6859 39.1328 177.5056 85 K 4.0437 8.1666 118.0636 59.1130 31.5415 179.6106 86 S 4.1006 7.2898 113.0154 60.8462 63.0677 175.6472 87 A 4.0991 7.4768 122.6213 52.4307 18.4557 176.9930 88 M 4.7036 7.2436 117.3650 53.9085 33.4213 174.8600 89 P 4.7685 0.0000 0.0000 64.1778 32.3299 178.1411 90 E 3.8800 8.1105 118.7095 57.8215 29.8570 176.8088 91 G 3.8001 9.6355 104.9906 44.2920 0.0000 171.1610 92 Y 5.3540 8.0126 115.1845 55.6353 42.2127 174.0845 93 V 4.7395 8.9997 120.9416 61.8844 33.5680 174.3211 94 Q 5.2508 9.4881 129.0845 54.4409 31.9213 173.6646 95 E 5.3305 9.3265 125.7790 54.6511 32.8726 174.9970 96 A 5.1472 8.9496 124.0166 50.7430 23.7086 174.8517 97 T 4.9536 8.9769 116.3575 61.8325 71.8044 173.3197 98 I 4.4816 8.9485 128.1157 59.6952 39.7504 175.0975 99 S 4.7267 8.6753 125.4675 56.7399 64.5307 173.7887 100 F 4.7356 8.6836 125.4596 56.1026 39.8909 175.7900 101 K 4.0321 8.8346 126.1884 58.0995 32.3498 175.8396 102 D 4.5107 8.9853 123.8159 54.9387 38.6664 173.0309 103 D 4.3647 7.8052 118.3353 53.7448 43.7907 173.7010 104 G 2.8183 7.6286 106.7815 44.6167 0.0000 171.6111 105 N 5.6034 7.8143 114.9534 51.4874 41.1717 173.0225 106 Y 5.7328 9.1342 118.5417 56.7352 40.7389 174.7611 107 K 5.3015 9.4445 122.9755 54.8598 35.5994 175.3706 108 T 5.2239 9.1410 114.3496 59.9725 72.7819 172.8101 109 R 5.1781 9.0030 122.3766 54.8740 33.6321 173.6964 110 A 5.3100 9.3898 127.1285 50.2906 23.5095 174.1923 111 E 5.0453 9.1439 119.3015 54.4713 32.7180 175.3359 112 V 4.8671 8.5350 124.9527 60.9879 34.0541 174.4026 113 K 4.7996 8.5179 125.9313 55.6921 36.4906 174.8113 114 F 4.6033 8.6359 119.7576 57.2096 40.0220 175.7611 115 E 4.5297 9.3798 123.5480 55.0798 31.2035 176.9672 116 G 3.8232 8.1677 116.3323 47.3052 0.0000 172.6224 117 D 4.8535 8.9561 124.1086 54.0879 40.9846 175.3218 118 T 4.7735 7.8127 117.2722 61.7394 71.0290 173.4264 119 L 4.0457 8.5492 128.7575 54.2287 43.5348 175.3405 120 V 4.7828 8.5900 126.6516 61.0076 34.5223 173.6207 121 N 5.1652 9.3657 126.7800 52.1344 41.2404 173.0449 122 R 5.0467 8.7544 126.6763 54.7316 32.2504 175.7587 123 I 5.0893 9.0964 124.9144 59.4484 41.5187 174.2631 124 E 5.1165 9.2693 125.3410 54.4171 32.5278 174.6806 125 L 5.0938 8.6966 125.8693 52.9886 45.4594 174.7859 126 K 4.9488 9.4021 127.4536 54.5579 35.1772 174.6738 127 G 5.1100 9.7607 115.7178 44.6175 0.0000 171.9743 128 I 5.2224 8.5831 116.4449 59.3178 41.8650 174.5207 129 D 4.2325 8.8145 119.2524 55.4060 38.1618 174.3908 130 F 4.4808 8.3048 116.9258 57.0756 39.8450 175.7210 131 K 4.3192 9.3762 124.6311 55.8100 32.6264 178.3986 132 E 4.0873 9.0017 123.5343 58.7110 29.5683 177.4034 133 D 4.8968 7.9477 116.7753 52.7920 40.0438 176.3165 134 G 3.9807 7.8173 110.2336 45.3686 0.0000 175.0801 135 N 4.3905 8.0713 112.4869 55.9180 38.7774 177.9713 136 I 3.6330 7.4920 119.0888 63.9026 37.6152 178.0420 137 L 3.9239 7.6605 119.0624 56.8768 41.7190 178.2614 138 G 3.7254 8.0322 105.9867 45.3276 0.0000 173.1185 139 H 3.8837 7.4674 116.3881 57.1870 26.5305 174.8151 140 K 4.5506 8.2394 115.4801 56.1707 33.9742 177.6830 141 L 4.8721 7.6919 120.7584 53.6252 42.6764 176.6741 142 E 4.1571 9.0341 123.4294 56.3801 30.3668 177.2548 143 Y 4.5255 8.4182 124.5651 55.3310 37.2957 173.1986 144 N 4.8382 7.5560 119.1937 52.3695 40.4687 174.2063 145 Y 4.4003 8.0494 118.4740 56.5923 41.4136 173.9348 146 N 4.6361 8.1424 124.6896 52.8307 39.6595 174.7254 147 S 4.7154 8.1790 116.2211 59.0107 63.8728 173.4327 148 H 4.9922 8.8885 118.7762 54.5391 33.7201 171.7622 149 N 5.2190 8.6159 117.3486 51.6165 40.6670 174.5965 150 V 3.8085 8.4250 124.1212 61.4718 33.1648 174.0548 151 Y 4.9868 8.6222 126.9064 57.2600 39.5793 174.7538 152 I 5.1891 8.9458 125.8992 59.7917 40.0973 174.9229 153 T 5.1347 8.8102 115.2187 59.8449 72.4605 173.1213 154 A 4.4418 8.5928 124.5303 52.0087 19.9475 177.0883 155 D 4.6734 8.7138 120.3943 52.0749 41.4991 176.5421 156 K 4.0359 8.3751 123.6762 58.9086 32.6987 179.6914 157 Q 4.0563 8.0936 116.6135 58.0711 28.7590 177.0426 158 K 4.3776 7.7458 115.2786 55.0280 32.5693 175.4802 159 N 4.2292 7.8740 116.3118 53.8664 38.4213 173.2762 160 G 3.7232 7.8489 106.0076 45.3855 0.0000 172.4058 161 I 5.0392 7.6227 114.4072 59.1038 41.8228 174.7169 162 K 5.1002 9.0224 121.2138 54.5664 35.9121 175.3316 163 A 5.4109 9.0277 123.8074 50.4927 22.9838 174.8866 164 N 5.7720 9.5158 118.4082 51.8058 43.1972 173.6105 165 F 5.2516 8.5683 116.1118 56.3946 41.9867 172.6382 166 K 4.9567 8.8820 118.8178 54.7839 34.1108 175.9307 167 I 4.0538 8.8960 126.7252 60.2249 39.1251 175.2642 168 R 4.7141 8.6743 125.3279 55.0186 31.5915 175.0686 169 H 4.7791 8.9679 123.0023 54.2871 30.6066 174.8530 170 N 4.8110 8.7863 121.5043 53.4110 39.6850 174.4210 171 I 4.8238 8.6539 125.0612 59.9526 38.7619 177.0732 172 E 4.2090 9.0890 123.7388 58.5860 29.4933 177.3769 173 D 4.6423 8.1487 117.9385 53.0642 39.7285 177.2359 174 G 3.8965 8.4015 109.2047 45.3454 0.0000 173.7758 175 S 4.6132 8.2280 114.8651 57.3591 64.9903 172.2964 176 V 4.8134 8.1556 118.9135 61.1554 34.3824 174.8596 177 Q 4.5662 9.2358 129.3670 54.4287 30.3935 174.5250 178 L 4.6700 8.5316 127.1969 54.6946 43.5226 176.3140 179 A 4.5812 8.8195 124.2543 49.9875 21.9421 174.4896 180 D 4.6164 8.7110 122.7257 55.0441 42.7940 174.7237 181 H 5.0444 9.1047 123.3168 53.9709 31.5065 172.4945 182 Y 5.2445 8.7791 124.2640 55.9196 41.3811 173.8899 183 Q 4.9874 8.9503 127.7794 54.2453 33.0146 173.6741 184 Q 4.8077 9.1778 125.3901 54.3421 32.8349 173.4436 185 N 5.6725 9.0641 122.8980 51.8406 42.5155 173.5562 186 T 5.1068 8.8552 118.7946 60.9566 72.6363 171.9414 187 P 4.9188 0.0000 0.0000 63.3604 31.7654 176.3851 188 I 4.0496 8.7698 123.0698 63.8772 38.0173 176.9140 189 G 3.9299 8.0000 109.4979 45.1183 0.0000 172.5334 190 D 4.6345 8.4265 117.1532 54.2991 41.5037 177.4141 191 G 3.9121 7.7503 108.4834 43.7952 0.0000 171.4360 192 P 4.5055 0.0000 0.0000 62.3914 32.0840 175.8955 193 V 4.4486 7.9110 112.0188 59.3507 35.1200 175.0276 194 L 4.2980 8.6835 121.9793 53.9081 42.2336 176.2573 195 L 4.6751 8.3792 124.0299 52.3420 42.6012 174.6089 196 P 4.7405 0.0000 0.0000 61.7691 32.5988 175.6515 197 D 4.6748 8.5551 119.1607 53.6671 41.5801 176.0600 198 N 4.8269 8.5281 118.4850 54.7106 39.1746 174.2310 199 H 5.0045 8.7211 117.2910 55.4830 32.4645 171.5250 200 Y 5.2629 8.4886 115.2615 55.7482 42.1657 173.8506 201 L 4.7998 8.8148 120.4075 53.0750 44.1132 175.6743 202 S 5.2388 9.0842 120.5646 57.5809 63.7646 172.8185 203 T 5.2236 8.9936 117.8864 60.0847 71.8745 173.1052 204 Q 4.9653 9.1295 121.7470 54.5538 33.1969 174.3457 205 S 5.2006 8.8688 117.7710 56.8338 67.3523 173.1198 206 A 4.7509 9.1743 125.6025 50.1329 21.6351 174.7718 207 L 5.1459 8.4858 122.6329 53.3199 44.0325 175.9113 208 S 4.8748 9.1783 116.7482 57.5346 67.0433 172.4527 209 K 4.9607 8.5358 117.8589 54.5647 35.5747 175.8280 210 D 4.6086 8.8327 122.5345 52.5948 41.5198 175.4175 211 P 4.4383 0.0000 0.0000 64.6043 31.5722 176.4748 212 N 4.6547 8.5067 115.8540 53.0405 39.0650 174.0840 213 E 4.3888 7.9759 120.6092 54.7661 30.4284 175.8058 214 K 4.3187 8.4555 124.8681 57.3354 33.1548 177.3400 215 R 4.1950 8.1554 117.8298 55.4952 30.7391 175.6292 216 D 4.8052 8.6372 120.3351 54.9559 42.1932 174.7490 217 H 5.0406 8.5527 119.9072 55.1536 31.9772 172.3878 218 M 4.4929 8.2847 118.0280 53.1727 35.6186 173.4256 219 V 4.6340 8.5951 126.3677 61.3654 33.7241 174.1431 220 L 5.2067 8.9633 129.6509 53.0769 45.4907 174.5189 221 L 5.0206 8.6631 127.4942 53.2146 44.7945 174.6251 222 E 5.1040 8.9058 126.3720 54.4483 33.7521 173.7742 223 F 5.3358 9.2932 124.2588 55.6960 42.6900 174.4071 224 V 4.8922 9.1020 122.7166 61.5645 34.8683 174.1112 225 T 5.0298 8.9099 123.9903 61.5388 71.9447 173.4238 226 A 4.3171 8.6395 128.7032 52.0426 19.4563 176.1237 227 A 4.0269 8.4763 121.4960 51.3281 23.2512 177.2680 228 G 4.1169 9.3876 105.9610 45.4782 0.0000 173.9321 229 I 4.1901 7.1475 124.9673 61.3846 38.1059 175.0870 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 3 K 8.16 4.25 0.00 1.78 1.84 0.00 1.66 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.59 7.81 4 G 7.97 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 E 9.07 4.13 0.00 2.21 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 6 E 7.93 4.07 0.00 2.05 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 2.34 2.42 0.00 7 L 7.86 4.13 0.00 1.22 0.90 0.41 0.35 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 8 F 8.00 4.86 0.00 3.29 3.05 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 9 T 8.11 3.90 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 1.24 0.00 0.00 10 G 7.19 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 11 V 8.42 4.12 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 0.82 0.00 0.00 1.03 0.00 0.00 12 V 8.80 4.66 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 1.27 0.00 0.00 1.13 0.00 0.00 13 P 0.00 4.84 0.00 2.14 2.14 0.00 3.92 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 2.09 2.01 0.00 14 I 8.73 5.08 1.72 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.64 0.90 0.00 0.00 15 L 8.86 5.24 0.00 1.53 1.51 0.91 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.85 5.00 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 1.09 0.00 0.00 17 E 9.48 5.20 0.00 1.88 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 18 L 9.27 5.23 0.00 1.69 1.51 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.92 5.11 0.00 2.55 2.38 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 20 G 8.62 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.57 5.14 0.00 2.62 2.43 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 22 V 8.88 4.72 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 0.85 0.00 0.00 0.95 0.00 0.00 23 N 10.29 4.39 0.00 2.96 2.92 0.00 0.00 7.23 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.50 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 25 H 8.33 4.54 0.00 3.34 3.29 0.00 5.61 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.45 5.02 0.00 1.65 1.70 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.44 7.81 27 F 8.25 5.00 0.00 2.98 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 28 S 8.67 5.23 0.00 3.78 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 29 V 8.93 5.15 2.26 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 1.49 0.00 0.00 1.08 0.00 0.00 30 S 9.32 5.32 0.00 3.87 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 31 G 9.58 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 0.00 0.00 0.00 0.00 32 E 8.59 4.99 0.00 1.76 1.68 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 2.15 2.18 0.00 33 G 8.03 4.07 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 0.00 0.00 0.00 34 E 8.07 4.94 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 2.08 2.16 0.00 35 G 8.69 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 36 D 9.33 5.24 0.00 2.74 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 37 A 9.08 4.50 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.13 3.75 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 0.46 0.00 0.00 39 Y 7.94 4.73 0.00 3.09 3.05 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 40 G 8.22 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 0.00 0.00 0.00 0.00 41 K 8.14 4.68 0.00 2.00 1.71 0.00 1.78 0.00 0.00 1.81 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.16 0.77 7.81 42 L 8.53 5.15 0.00 1.42 1.33 0.95 0.44 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 43 T 8.51 4.88 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 1.08 0.00 0.00 44 L 8.87 4.92 0.00 1.36 0.72 0.97 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.54 4.75 0.00 1.64 1.45 0.00 1.51 0.00 0.00 1.56 0.00 0.00 2.75 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.22 1.30 7.81 46 F 9.26 5.44 0.00 2.77 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 47 I 9.05 5.12 1.97 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 1.16 1.07 1.01 0.00 0.00 48 C 9.60 5.13 0.00 3.04 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 49 T 8.85 4.51 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 1.29 0.00 0.00 50 T 9.59 4.48 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 1.27 0.00 0.00 51 G 7.42 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 52 K 8.29 4.30 0.00 1.71 1.67 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.33 7.81 53 L 9.08 3.64 0.00 1.02 0.99 0.08 -0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.32 0.00 1.94 1.92 0.00 2.54 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.83 0.00 55 V 6.44 4.16 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.45 0.00 0.00 56 P 0.00 4.37 0.00 2.13 1.99 0.00 3.37 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.90 0.00 57 W 9.15 4.32 0.00 3.65 3.35 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 58 P 0.00 4.51 0.00 2.30 2.55 0.00 3.71 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.26 0.00 59 T 8.06 4.41 4.52 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 1.06 0.00 0.00 60 L 8.08 4.65 0.00 1.89 1.74 0.71 0.61 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 61 V 7.60 3.46 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.66 0.00 0.00 62 T 8.04 4.17 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 63 T 7.94 4.16 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 64 L 7.66 4.29 0.00 1.28 1.25 0.28 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 *68 V 7.21 4.06 2.43 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 0.94 0.00 0.00 1.09 0.00 0.00 69 Q 7.62 4.03 0.00 1.26 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.92 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 70 C 7.87 4.08 0.00 2.34 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 71 F 8.11 4.55 0.00 3.25 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 7.61 4.61 0.00 4.00 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 73 R 9.14 4.39 0.00 2.01 1.83 0.00 3.11 0.00 0.00 3.27 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 74 Y 8.61 4.55 0.00 2.84 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.31 0.00 2.01 2.00 0.00 3.45 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 2.01 2.03 0.00 76 D 9.04 4.38 0.00 2.76 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.24 4.48 0.00 3.33 3.42 0.00 5.54 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 78 M 8.05 4.66 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.34 0.00 79 K 8.05 3.89 0.00 1.93 2.17 0.00 1.30 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.36 7.81 80 Q 7.95 4.10 0.00 2.06 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.10 0.00 0.00 0.00 0.00 0.00 1.86 2.07 0.00 81 H 8.14 4.73 0.00 3.33 3.30 0.00 5.64 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.09 3.72 0.00 1.58 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 F 8.03 4.12 0.00 2.96 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 0.00 0.00 0.00 0.00 84 F 7.52 3.90 0.00 3.09 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.17 4.04 0.00 1.63 1.76 0.00 1.56 0.00 0.00 1.46 0.00 0.00 2.89 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 1.03 7.81 86 S 7.29 4.10 0.00 3.93 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 87 A 7.48 4.10 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 88 M 7.24 4.70 0.00 2.41 2.42 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.23 3.02 0.00 89 P 0.00 4.77 0.00 2.22 2.06 0.00 3.68 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 1.88 0.00 90 E 8.11 3.88 0.00 1.98 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 2.32 2.38 0.00 91 G 9.64 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 0.00 0.00 0.00 92 Y 8.01 5.35 0.00 3.30 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 93 V 9.00 4.74 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 1.01 0.00 0.00 1.00 0.00 0.00 94 Q 9.49 5.25 0.00 2.46 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.53 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 95 E 9.33 5.33 0.00 1.90 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 2.24 2.26 0.00 96 A 8.95 5.15 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 97 T 8.98 4.95 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 1.23 0.00 0.00 98 I 8.95 4.48 1.80 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 0.74 0.80 0.10 0.00 0.00 99 S 8.68 4.73 0.00 3.59 3.70 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 0.00 100 F 8.68 4.74 0.00 3.16 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 0.00 101 K 8.83 4.03 0.00 1.69 1.76 0.00 1.94 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.42 7.81 102 D 8.99 4.51 0.00 2.88 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 0.00 103 D 7.81 4.36 0.00 2.63 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 0.00 104 G 7.63 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 0.00 0.00 0.00 105 N 7.81 5.60 0.00 2.94 2.81 0.00 0.00 7.33 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 0.00 106 Y 9.13 5.73 0.00 3.01 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 0.00 107 K 9.44 5.30 0.00 1.71 1.73 0.00 1.65 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.56 7.81 108 T 9.14 5.22 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 1.29 0.00 0.00 109 R 9.00 5.18 0.00 1.88 1.77 0.00 3.06 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 110 A 9.39 5.31 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 0.00 111 E 9.14 5.05 0.00 1.89 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 2.23 2.23 0.00 112 V 8.54 4.87 1.09 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 0.90 0.00 0.00 0.95 0.00 0.00 113 K 8.52 4.80 0.00 2.08 1.80 0.00 1.37 0.00 0.00 1.64 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.42 7.81 114 F 8.64 4.60 0.00 2.91 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 0.00 115 E 9.38 4.53 0.00 1.94 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 2.21 2.35 0.00 116 G 8.17 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 0.00 117 D 8.96 4.85 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 0.00 118 T 7.81 4.77 4.40 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 1.24 0.00 0.00 119 L 8.55 4.05 0.00 1.28 1.54 1.00 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.59 4.78 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 0.87 0.00 0.00 0.90 0.00 0.00 121 N 9.37 5.17 0.00 2.85 2.71 0.00 0.00 6.78 7.32 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 0.00 122 R 8.75 5.05 0.00 1.81 1.83 0.00 3.12 0.00 0.00 3.17 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 123 I 9.10 5.09 1.88 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 1.28 0.90 0.97 0.00 0.00 124 E 9.27 5.12 0.00 1.84 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 125 L 8.70 5.09 0.00 1.57 1.26 0.55 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 126 K 9.40 4.95 0.00 1.80 1.65 0.00 1.65 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.40 7.81 127 G 9.76 5.11 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 0.00 128 I 8.58 5.22 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 1.30 0.76 0.99 0.00 0.00 129 D 8.81 4.23 0.00 2.73 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 0.00 130 F 8.30 4.48 0.00 3.24 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 0.00 131 K 9.38 4.32 0.00 1.81 1.74 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.40 7.81 132 E 9.00 4.09 0.00 1.97 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 2.35 2.35 0.00 133 D 7.95 4.90 0.00 2.74 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 7.82 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 0.00 135 N 8.07 4.39 0.00 2.91 2.87 0.00 0.00 7.47 7.34 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 0.00 136 I 7.49 3.63 1.62 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.05 0.26 0.00 0.00 137 L 7.66 3.92 0.00 1.79 1.69 1.01 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 138 G 8.03 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 0.00 0.00 0.00 139 H 7.47 3.88 0.00 3.25 3.30 0.00 5.63 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 0.00 140 K 8.24 4.55 0.00 1.82 1.81 0.00 1.85 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.37 1.37 7.81 141 L 7.69 4.87 0.00 1.54 1.62 0.83 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 142 E 9.03 4.16 0.00 2.02 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.31 0.00 143 Y 8.42 4.53 0.00 3.05 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 0.00 144 N 7.56 4.84 0.00 2.84 2.79 0.00 0.00 6.07 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 0.00 145 Y 8.05 4.40 0.00 2.87 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 0.00 146 N 8.14 4.64 0.00 2.50 2.54 0.00 0.00 7.19 7.57 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 0.00 147 S 8.18 4.72 0.00 3.73 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 0.00 148 H 8.89 4.99 0.00 3.07 3.11 0.00 5.78 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 0.00 149 N 8.62 5.22 0.00 1.98 1.85 0.00 0.00 6.79 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 0.00 150 V 8.42 3.81 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 0.84 0.00 0.00 0.07 0.00 0.00 151 Y 8.62 4.99 0.00 3.24 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 0.00 152 I 8.95 5.19 1.64 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 1.28 1.56 0.90 0.00 0.00 153 T 8.81 5.13 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 1.29 0.00 0.00 154 A 8.59 4.44 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 0.00 155 D 8.71 4.67 0.00 2.65 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.38 4.04 0.00 1.89 1.84 0.00 1.60 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.53 1.51 7.81 157 Q 8.09 4.06 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.15 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 158 K 7.75 4.38 0.00 1.76 1.79 0.00 1.97 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.34 7.81 159 N 7.87 4.23 0.00 2.85 2.87 0.00 0.00 6.81 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 0.00 160 G 7.85 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 0.00 161 I 7.62 5.04 1.64 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.11 0.74 0.26 0.00 0.00 162 K 9.02 5.10 0.00 1.70 1.78 0.00 1.69 0.00 0.00 1.93 0.00 0.00 3.01 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.22 1.30 7.81 163 A 9.03 5.41 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 0.00 164 N 9.52 5.77 0.00 2.85 2.80 0.00 0.00 6.44 8.21 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 0.00 165 F 8.57 5.25 0.00 3.10 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 0.00 166 K 8.88 4.96 0.00 1.68 1.76 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.70 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.44 7.81 167 I 8.90 4.05 1.76 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.88 0.52 0.00 0.00 168 R 8.67 4.71 0.00 1.64 1.86 0.00 3.40 0.00 0.00 3.28 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 169 H 8.97 4.78 0.00 3.26 3.25 0.00 5.62 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 N 8.79 4.81 0.00 2.83 2.84 0.00 0.00 7.10 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 I 8.65 4.82 2.09 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 1.32 0.74 1.12 0.00 0.00 172 E 9.09 4.21 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.27 0.00 173 D 8.15 4.64 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 0.00 174 G 8.40 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 0.00 175 S 8.23 4.61 0.00 3.96 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 V 8.16 4.81 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 0.85 0.00 0.00 0.94 0.00 0.00 177 Q 9.24 4.57 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.78 0.00 0.00 0.00 0.00 0.00 2.44 2.63 0.00 178 L 8.53 4.67 0.00 1.66 1.55 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 179 A 8.82 4.58 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 D 8.71 4.62 0.00 2.73 2.41 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 0.00 181 H 9.10 5.04 0.00 1.51 2.41 0.00 5.80 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 8.78 5.24 0.00 2.93 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 0.00 183 Q 8.95 4.99 0.00 2.17 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.54 0.00 0.00 0.00 0.00 0.00 2.39 2.34 0.00 184 Q 9.18 4.81 0.00 1.76 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.53 0.00 0.00 0.00 0.00 0.00 2.16 2.19 0.00 185 N 9.06 5.67 0.00 2.31 2.59 0.00 0.00 6.52 7.07 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 0.00 186 T 8.86 5.11 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 1.30 0.00 0.00 187 P 0.00 4.92 0.00 2.15 2.13 0.00 3.88 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.26 0.00 188 I 8.77 4.05 2.14 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 1.22 0.65 0.94 0.00 0.00 189 G 8.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 D 8.43 4.63 0.00 2.68 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 G 7.75 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 0.00 192 P 0.00 4.51 0.00 2.18 2.06 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 193 V 7.91 4.45 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.18 0.00 0.00 194 L 8.68 4.30 0.00 1.60 1.70 0.87 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 195 L 8.38 4.68 0.00 1.62 1.59 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 196 P 0.00 4.74 0.00 2.34 2.39 0.00 3.69 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 197 D 8.56 4.67 0.00 2.63 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 0.00 198 N 8.53 4.83 0.00 2.67 2.86 0.00 0.00 6.74 8.16 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 0.00 199 H 8.72 5.00 0.00 3.37 3.37 0.00 5.22 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 8.49 5.26 0.00 2.75 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 0.00 201 L 8.81 4.80 0.00 1.44 1.50 0.85 0.69 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 0.00 202 S 9.08 5.24 0.00 4.02 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 0.00 203 T 8.99 5.22 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 1.17 0.00 0.00 204 Q 9.13 4.97 0.00 2.18 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.31 2.41 0.00 205 S 8.87 5.20 0.00 3.75 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 0.00 206 A 9.17 4.75 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 L 8.49 5.15 0.00 0.86 0.88 0.56 0.65 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 0.00 208 S 9.18 4.87 0.00 3.85 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 0.00 209 K 8.54 4.96 0.00 1.60 1.71 0.00 1.35 0.00 0.00 1.24 0.00 0.00 2.13 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.19 1.14 7.81 210 D 8.83 4.61 0.00 2.64 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 0.00 211 P 0.00 4.44 0.00 2.21 2.16 0.00 3.79 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 1.97 1.98 0.00 212 N 8.51 4.65 0.00 2.80 2.86 0.00 0.00 6.82 8.52 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 0.00 213 E 7.98 4.39 0.00 1.74 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.36 0.00 214 K 8.46 4.32 0.00 1.78 1.84 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.44 7.81 215 R 8.16 4.20 0.00 1.95 1.94 0.00 3.21 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 1.70 1.63 0.00 216 D 8.64 4.81 0.00 2.84 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 0.00 217 H 8.55 5.04 0.00 3.25 3.22 0.00 5.54 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 M 8.28 4.49 0.00 1.17 0.75 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.26 0.00 219 V 8.60 4.63 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 0.84 0.00 0.00 0.93 0.00 0.00 220 L 8.96 5.21 0.00 1.82 1.55 0.79 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 221 L 8.66 5.02 0.00 1.71 1.42 0.63 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 222 E 8.91 5.10 0.00 1.92 1.57 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 2.15 2.43 0.00 223 F 9.29 5.34 0.00 3.05 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 0.00 224 V 9.10 4.89 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 0.91 0.00 0.00 0.92 0.00 0.00 225 T 8.91 5.03 4.19 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 0.00 0.00 0.00 1.13 0.00 0.00 226 A 8.64 4.32 0.13 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 0.00 227 A 8.48 4.03 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 G 9.39 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 0.00 229 I 7.15 4.19 1.80 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.69 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.