NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2318 7.8827 121.4467 61.2022 38.6952 173.7702 17 V 4.3825 8.8682 125.9549 61.7444 32.8147 174.4624 18 G 3.7044 8.4447 113.9399 46.5592 0.0000 173.3889 19 G 4.1564 7.7140 109.8947 44.1584 0.0000 172.5415 20 Y 4.9638 7.7784 116.9405 55.1982 42.2917 174.8519 21 T 4.2585 8.6094 116.9665 63.9017 68.4123 175.2453 22 C 4.3275 8.5733 125.3492 60.9717 35.0171 174.7919 23 G 4.0853 8.7442 106.4704 43.8525 0.0000 172.6355 24 A 4.1851 8.7139 125.5711 53.6478 18.3441 176.8293 25 N 4.2454 8.8211 119.9111 54.8579 36.1030 175.5279 26 T 4.1960 7.6195 107.4357 62.6859 69.9676 175.0349 27 V 4.0499 7.0197 121.8847 59.7651 31.4575 173.6204 28 P 4.4876 0.0000 0.0000 64.3231 31.7830 178.3543 29 Y 5.0343 6.8620 115.1698 56.9995 38.8079 174.6968 30 Q 4.6261 7.3681 123.5467 56.3237 29.2051 175.5154 31 V 4.9071 8.9018 118.6866 59.6407 36.3562 174.1551 32 S 4.9939 8.7539 116.7105 56.5711 65.0368 172.6754 33 L 4.6530 8.5981 127.6974 53.5899 43.1881 175.1135 34 N 5.7418 9.1802 122.6022 49.9540 42.1232 174.9285 *37 S 4.3425 8.4355 120.6339 58.4190 64.1379 174.4884 38 G 4.0240 9.7476 109.1233 46.3163 0.0000 172.9302 39 Y 4.5160 6.6137 115.1547 56.2454 39.9708 172.6209 40 H 4.6003 8.8669 121.5502 56.2667 30.3743 174.7986 41 F 5.0425 7.6392 119.2337 56.6852 39.5835 173.6953 42 C 4.7357 6.8024 114.8306 56.3247 44.6664 173.3653 43 G 4.1991 8.7659 109.4790 45.7033 0.0000 172.2451 44 G 4.4285 7.9434 104.9679 46.4135 0.0000 172.6967 45 S 5.5011 8.7813 115.3313 56.4830 67.1467 173.5503 46 L 4.9012 9.0479 127.0846 54.6135 42.4447 177.0419 47 I 4.4137 8.4282 119.8721 61.0832 38.3869 174.5106 48 N 4.5653 7.6092 117.5156 52.1369 39.4281 175.1606 49 S 4.2620 8.5530 112.3203 60.6735 63.0857 175.4320 50 Q 4.5694 9.2404 118.3551 55.0194 30.4149 174.6573 51 W 5.4865 8.2399 117.3358 54.7385 33.2765 174.5041 52 V 5.0701 9.1632 122.7900 61.1749 34.6507 174.1709 53 V 4.9231 8.8999 126.7738 61.7051 33.8429 174.6821 54 S 5.1673 8.9462 120.4043 57.7299 66.2017 171.9479 55 A 4.6978 8.5236 121.1959 50.7442 20.1597 178.5078 56 A 3.8086 8.3789 124.8200 55.2930 18.4800 178.9646 57 H 4.5429 8.4744 109.1472 57.0268 28.6725 175.2304 58 C 4.7101 7.8461 117.1666 56.9840 40.6132 173.3657 59 Y 4.1862 7.5092 121.8042 57.9883 38.8350 175.1913 60 K 3.7454 6.5369 124.3037 55.2132 34.9090 174.7043 61 S 4.2414 8.0737 118.4230 58.4832 64.4063 173.5794 62 G 3.6518 8.3865 107.9401 46.7225 0.0000 173.8078 63 I 4.1602 7.3944 119.3571 60.3991 39.2388 175.6495 64 Q 4.8275 8.8209 127.5370 54.2120 31.7786 174.1251 65 V 4.4604 8.8777 127.0319 61.8350 33.5853 174.5605 66 R 5.1051 8.9710 127.3152 54.6919 32.3886 175.1627 67 L 4.7847 9.0656 124.6364 52.6666 44.8586 177.5335 *69 G 3.9482 8.2533 107.6434 45.4174 0.0000 172.6979 70 E 4.4763 8.2138 118.3587 55.3222 30.0854 174.1695 71 D 4.8038 7.9338 118.0755 54.7120 44.0992 174.1514 72 N 5.0825 8.9945 120.5465 52.5467 39.1697 176.1232 73 I 3.8478 8.4911 119.6597 62.0793 37.7123 176.1921 74 N 4.8809 8.6332 117.7757 52.9454 39.2657 174.3723 75 V 4.2841 7.4708 118.1143 60.7110 34.2424 175.0215 76 V 3.9527 8.5158 127.0727 63.0722 31.0486 175.1071 77 E 4.3113 9.5921 127.9978 55.9819 30.1738 177.2998 78 G 4.0833 8.2191 105.4065 45.2665 0.0000 173.7704 79 N 5.0208 8.0694 115.1626 52.7033 40.8190 174.1131 80 E 4.5423 8.0842 118.3379 56.4260 30.9161 176.3815 81 Q 4.2859 8.9252 120.2632 54.5081 33.0109 173.9919 82 F 5.5355 8.7757 123.3820 56.0381 40.8620 175.3751 83 I 4.7408 8.7958 125.1771 59.2953 40.7337 175.5913 84 S 4.7764 8.6991 121.2925 57.8179 64.7450 173.2535 85 A 4.6662 8.3912 123.9799 52.1660 18.3775 177.6988 86 S 4.5487 8.6286 115.6766 58.9498 64.8098 174.3673 87 K 4.5241 7.4414 119.5335 55.5113 35.3119 174.0090 88 S 5.2593 8.8539 122.0495 56.8809 66.3805 173.7711 89 I 4.5944 9.2752 124.3028 59.5024 40.0024 174.8144 90 V 4.1856 8.4504 127.3094 62.1959 32.6232 175.1905 91 H 3.5873 8.6182 126.9900 55.8115 30.0059 174.2920 92 P 4.2594 0.0000 0.0000 65.5278 31.0285 177.0889 93 S 4.6853 7.9179 112.2378 57.9810 63.1175 173.2251 94 Y 4.3060 7.8413 122.3550 57.9850 39.0146 175.2083 95 N 4.4996 8.0558 125.3794 51.3404 40.1215 175.1057 96 S 4.0652 7.9536 120.9254 60.2857 63.5470 175.1331 97 N 4.4413 8.2651 118.9015 55.0929 38.6580 176.0126 98 T 4.0748 7.7067 105.3707 60.6102 70.2050 175.0363 99 L 3.7728 8.1857 120.8275 55.2079 39.8307 173.9214 100 N 4.4455 7.7365 117.8930 54.8075 39.3671 174.6501 101 N 4.6397 8.7680 120.4575 54.3095 35.8908 175.4166 102 D 4.7974 8.0631 117.5626 53.2497 39.4981 174.5163 103 I 4.8303 7.2344 120.9935 59.4429 42.3226 172.7626 104 M 5.4242 9.2499 126.5224 54.3207 36.3141 173.2121 105 L 5.3782 9.3173 124.8148 53.2023 44.9721 175.4573 106 I 5.0143 9.0956 123.3501 59.4860 40.6957 174.2251 107 K 3.8737 8.5958 128.8905 54.5161 33.6927 175.5665 108 L 4.4145 8.2079 127.5673 54.1375 41.9949 177.4745 109 K 4.2111 8.6748 122.3146 58.9423 32.4868 177.6296 110 S 4.5959 7.7204 111.5309 55.7685 66.1117 173.3144 111 A 4.3534 8.4123 123.5265 52.0686 18.6952 177.3833 112 A 4.1706 9.0062 124.1889 51.8335 19.6387 177.4669 113 S 4.4642 9.0857 116.4354 56.9698 62.8152 173.9749 114 L 4.4810 8.4787 128.5571 54.4809 42.3300 176.4289 115 N 4.8929 8.7498 120.0806 52.0854 39.6612 174.8083 116 S 4.1752 8.7669 111.4148 61.0506 62.9671 174.8104 117 R 4.3500 7.9416 118.4210 55.8641 31.2743 175.4429 118 V 4.4183 7.6115 117.5267 60.9606 33.3772 173.6628 119 A 5.1908 8.4202 128.0095 50.3003 22.9678 175.0680 120 S 5.0978 8.7067 113.9166 57.7123 64.9442 173.1033 121 I 4.4539 8.1331 121.1002 59.2046 39.6891 175.4590 122 S 4.4489 8.3921 124.0329 58.2911 64.1138 173.8973 123 L 4.2650 8.2964 122.6361 53.4033 42.5668 175.3053 124 P 4.4873 0.0000 0.0000 62.9103 31.9409 176.6689 125 T 4.2961 8.2372 109.3162 61.8684 70.2661 174.1695 *127 S 4.3964 7.5754 115.1419 58.2582 64.0623 173.9167 128 C 4.4453 8.3588 117.8606 56.3361 40.8714 173.7370 129 A 4.3519 8.0486 125.2287 51.5829 19.4569 176.9182 130 S 4.5374 8.0244 113.0145 56.2620 65.7571 173.1937 *132 A 4.2680 8.2377 123.2498 53.5204 19.3086 176.0633 133 G 4.0710 9.1753 109.7244 45.6099 0.0000 174.6965 134 T 3.9281 7.5538 116.7100 63.7356 69.4427 173.6519 135 Q 4.6685 8.5999 127.5858 56.0912 30.0491 175.4172 136 C 5.2918 9.3383 122.8226 55.0753 45.6832 172.3716 137 L 5.1582 9.0091 122.7308 53.5684 43.9779 175.0526 138 I 5.1855 9.0266 127.4410 58.8633 39.9875 174.8904 139 S 4.9080 8.4030 119.1436 56.6041 66.5042 173.0690 140 G 3.7912 7.5234 108.7584 46.1533 0.0000 172.9822 141 W 4.8840 8.6839 117.2838 56.2855 29.3734 177.1408 142 G 4.1170 8.6048 109.3442 44.2783 0.0000 173.5396 143 N 3.6544 8.6128 118.4726 54.2173 38.9355 174.5466 144 T 5.0842 7.9474 112.7873 60.4863 69.5505 174.2362 145 K 4.6077 7.8151 121.6027 54.8553 34.5627 176.1482 146 S 4.5107 8.5928 116.7268 59.4903 63.9644 174.4518 147 S 4.8023 7.9768 117.0332 57.1409 63.9301 173.8665 148 G 4.0080 7.1816 107.6019 46.4310 0.0000 172.0537 149 T 4.6892 8.2556 116.3810 62.0313 72.4203 174.1450 150 S 4.3396 9.1170 120.8247 58.0916 65.4211 172.5455 151 Y 4.9175 8.6797 126.1028 55.7459 38.9781 174.4536 152 P 4.6438 0.0000 0.0000 62.6940 32.6866 175.7101 153 D 4.7205 8.6761 118.0593 55.1622 41.9163 176.8638 154 V 5.4039 7.4634 110.6939 58.4150 34.5017 175.6101 155 L 3.2578 8.2634 124.8741 55.0336 43.0277 175.9550 156 K 4.8427 8.0915 124.6056 54.8975 35.0358 174.6160 157 C 5.1950 8.7504 119.9437 55.1643 43.5205 172.9881 158 L 4.8945 8.4333 122.5555 53.8799 45.5599 174.4532 159 K 5.0637 8.9861 125.6752 55.4924 33.3954 175.9295 160 A 4.8681 9.0070 125.8866 49.8140 23.1435 173.2772 161 P 5.1008 0.0000 0.0000 61.5832 34.0823 174.9912 162 I 4.3539 8.2438 122.6381 61.3981 38.1670 175.3743 163 L 5.0675 8.8480 126.6238 52.3933 44.6847 176.6347 164 S 4.3132 8.4225 114.6187 58.2302 63.9515 174.9309 165 D 4.4197 8.9128 122.3244 58.0415 40.4888 179.1932 166 S 4.1621 8.2443 114.8509 62.0825 62.5342 176.7437 167 S 4.1220 7.8134 116.6423 61.7729 62.6343 175.5878 168 C 4.5350 7.9720 116.9901 59.0570 35.9418 175.7405 169 K 4.0937 8.1532 120.2013 59.3016 31.4017 178.9723 170 S 3.9853 7.8015 112.8827 61.1905 62.1795 175.0251 171 A 4.6494 7.7841 118.1527 51.6052 19.3461 176.2531 172 S 4.6177 7.8007 112.3988 59.0615 62.8330 174.3301 173 S 4.4537 9.1082 122.2080 58.4899 63.2486 173.8805 174 F 4.8965 7.7577 118.1973 54.9264 41.9874 175.0208 175 I 3.9170 8.3141 123.2513 61.4952 37.4110 175.9906 176 I 4.6153 8.3932 125.3630 59.8690 39.0840 175.5990 177 T 4.4884 8.3166 116.5035 60.0153 70.5438 175.4320 178 S 4.3775 8.5148 114.7398 60.2516 63.3184 174.3350 179 N 4.9130 8.1622 118.5125 53.4131 38.4624 173.8883 180 M 5.6017 7.9060 117.0002 53.7070 36.1023 174.5230 181 F 5.1142 8.7650 114.8165 55.6942 42.3957 172.1478 182 C 5.3330 9.0371 119.3686 55.2545 43.8810 172.1435 183 A 5.0607 9.1466 126.3206 50.6558 22.3430 174.4265 184 G 3.8679 7.0034 108.6807 44.7099 0.0000 172.7932 184A Y 4.6925 8.3475 119.9857 56.1386 41.6946 176.4074 185 L 4.2331 8.6491 123.6441 56.9223 42.1857 178.0132 186 E 4.3195 8.3596 115.0160 55.4249 29.8557 177.5028 187 G 3.8322 8.0908 108.8176 45.2600 0.0000 172.4279 188 G 4.1374 9.1400 105.5014 44.7209 0.0000 173.6843 188A K 5.2776 7.2027 116.9365 53.5325 35.5443 175.4241 189 D 4.6016 8.2835 122.7414 53.9558 44.6309 175.1820 190 S 4.7956 8.7975 117.3737 58.2608 65.2535 172.7370 191 C 4.7345 9.2027 118.2191 55.6567 44.6567 172.2526 192 Q 4.3627 8.6380 118.4306 58.0634 28.5415 177.7634 193 G 4.3290 9.2999 110.5729 45.6768 0.0000 174.0193 194 D 4.6836 8.3666 118.5427 55.3818 41.7715 176.7727 195 S 4.5149 8.0613 115.4026 60.5626 63.2761 175.3800 196 G 4.2720 8.8861 112.7409 46.4214 0.0000 173.7621 197 G 4.1688 7.9335 107.2435 45.3721 0.0000 171.2555 198 P 5.1353 0.0000 0.0000 62.2641 33.6939 175.6600 199 V 4.5935 8.4711 120.3070 61.4585 34.3622 173.9722 200 V 4.8046 8.7715 129.0678 61.3099 33.8456 173.7900 201 C 5.0812 8.6480 124.5324 55.7220 44.1204 174.5614 202 S 3.6329 9.7738 119.3175 59.7312 60.0831 173.3015 203 G 3.9220 8.4962 104.7225 45.6973 0.0000 174.0908 204 K 4.7127 7.5709 117.8986 53.0769 35.1349 175.5289 *209 L 4.3363 8.2276 122.7349 55.3955 41.9815 175.8202 210 Q 4.4114 8.6592 125.9526 57.0490 30.6443 175.8844 211 G 5.3347 8.0254 104.4149 45.7274 0.0000 171.4608 212 I 5.2452 8.2081 119.7165 58.8366 41.0170 175.2411 213 V 3.8180 8.9486 127.5330 64.2378 31.8068 174.2581 214 S 4.8202 8.4347 120.6974 58.5463 64.3414 174.0545 215 W 4.8736 7.2032 114.0988 56.0275 31.8173 172.2836 216 G 4.0387 8.4354 105.9988 46.4256 0.0000 173.3368 217 E 4.4733 8.3106 120.4299 54.8796 29.6241 175.5128 *219 G 4.1511 7.9907 114.3507 45.5451 0.0000 170.8179 220 C 4.7915 8.2589 116.2359 56.3619 42.5664 173.5410 221 A 3.7679 8.9482 126.8903 53.2072 16.6657 176.7065 221A Q 4.6656 7.7861 117.2061 55.7223 30.2618 175.8798 222 K 4.2326 8.4292 122.2671 58.0539 32.6330 176.8160 223 N 4.4000 9.3397 121.3794 53.8326 37.2692 175.1740 224 K 4.5400 7.7188 117.5576 53.7163 32.2323 173.6657 225 P 4.6185 0.0000 0.0000 61.6919 33.3085 176.9784 226 G 3.5354 8.3396 105.8533 46.0747 0.0000 172.7295 227 V 4.3590 7.6317 121.8443 60.7024 33.8413 174.1602 228 Y 4.8463 8.0214 124.4104 55.8988 42.0879 175.0440 229 T 4.3051 8.4755 119.7175 63.6698 70.0080 174.2448 230 K 4.9188 9.3998 128.4359 55.3569 31.5930 177.1068 231 V 3.9548 8.7890 126.6862 66.0005 31.3828 174.8951 232 C 4.5518 8.3582 112.3523 58.0749 41.4412 174.6830 233 N 4.2746 7.9921 117.1821 54.2575 38.7025 175.4650 234 Y 4.8098 8.1642 117.6692 57.4177 38.9684 177.2184 235 V 3.6772 7.9796 120.6413 66.2365 31.4208 177.6295 236 S 4.0712 8.0855 112.1055 61.1795 62.3375 175.7471 237 W 4.1909 8.3376 130.5510 60.4718 30.5177 177.7212 238 I 3.0546 8.2934 120.0334 64.1753 36.6974 178.5479 239 K 3.7624 8.0600 119.2579 59.5105 31.7566 179.4833 240 Q 3.8996 8.0615 118.2731 59.1591 28.3991 179.0001 241 T 3.5798 7.2698 115.7587 66.5273 68.2318 176.5948 242 I 2.7322 6.9870 114.5656 63.3154 37.1882 178.0529 243 A 4.0386 7.4592 121.3128 54.1512 18.2715 178.6648 244 S 4.6028 7.4833 110.9735 58.5684 63.5119 174.1098 245 N 4.7118 7.7708 123.8022 53.4390 39.1800 174.0537 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 4.23 1.79 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 1.37 0.86 0.84 0.00 0.00 17 V 8.87 4.38 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 1.03 0.00 0.00 0.96 0.00 0.00 18 G 8.44 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 0.00 0.00 0.00 19 G 7.71 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 20 Y 7.78 4.96 0.00 3.01 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 8.61 4.26 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 22 C 8.57 4.33 0.00 2.78 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 8.74 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 8.71 4.19 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 8.82 4.25 0.00 2.88 2.91 0.00 0.00 7.18 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 7.62 4.20 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 1.24 0.00 0.00 27 V 7.02 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 0.29 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.49 0.00 2.37 2.30 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.96 0.00 29 Y 6.86 5.03 0.00 3.26 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 7.37 4.63 0.00 1.82 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.73 0.00 0.00 0.00 0.00 0.00 1.88 2.45 0.00 31 V 8.90 4.91 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 0.89 0.00 0.00 0.98 0.00 0.00 32 S 8.75 4.99 0.00 3.07 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 33 L 8.60 4.65 0.00 0.47 0.96 0.77 0.23 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 34 N 9.18 5.74 0.00 2.41 2.36 0.00 0.00 6.78 7.21 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 *37 S 8.44 4.34 0.00 3.69 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 38 G 9.75 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 39 Y 6.61 4.52 0.00 3.06 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 40 H 8.87 4.60 0.00 2.87 3.19 0.00 5.87 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.64 5.04 0.00 3.05 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 42 C 6.80 4.74 0.00 2.11 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 43 G 8.77 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.94 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.78 5.50 0.00 3.81 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 46 L 9.05 4.90 0.00 1.88 1.67 1.07 0.80 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 8.43 4.41 1.89 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 1.61 0.88 0.95 0.00 0.00 48 N 7.61 4.57 0.00 2.98 2.98 0.00 0.00 6.00 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 49 S 8.55 4.26 0.00 4.19 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 0.00 50 Q 9.24 4.57 0.00 2.10 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.78 0.00 0.00 0.00 0.00 0.00 2.20 2.30 0.00 51 W 8.24 5.49 0.00 3.25 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 9.16 5.07 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 1.15 0.00 0.00 0.98 0.00 0.00 53 V 8.90 4.92 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 1.04 0.00 0.00 1.00 0.00 0.00 54 S 8.95 5.17 0.00 3.91 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 55 A 8.52 4.70 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.38 3.81 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.47 4.54 0.00 3.38 3.57 0.00 5.55 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.85 4.71 0.00 3.24 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.51 4.19 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 60 K 6.54 3.75 0.00 1.13 1.04 0.00 0.87 0.00 0.00 1.29 0.00 0.00 2.61 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.89 1.02 7.81 61 S 8.07 4.24 0.00 3.98 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 62 G 8.39 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.39 4.16 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 0.70 0.92 0.00 0.00 64 Q 8.82 4.83 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.87 0.00 0.00 0.00 0.00 0.00 2.09 2.20 0.00 65 V 8.88 4.46 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 0.98 0.00 0.00 0.90 0.00 0.00 66 R 8.97 5.11 0.00 1.67 1.81 0.00 2.66 0.00 0.00 2.52 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.24 0.00 67 L 9.07 4.78 0.00 1.62 1.63 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.25 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 70 E 8.21 4.48 0.00 2.15 1.92 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 2.39 2.14 0.00 71 D 7.93 4.80 0.00 2.78 2.77 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 72 N 8.99 5.08 0.00 2.84 2.82 0.00 0.00 7.17 7.10 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 73 I 8.49 3.85 1.46 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 1.17 0.52 -0.33 0.00 0.00 74 N 8.63 4.88 0.00 2.82 2.84 0.00 0.00 6.60 8.37 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 75 V 7.47 4.28 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 8.52 3.95 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.97 0.00 0.00 77 E 9.59 4.31 0.00 1.97 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 2.49 0.00 78 G 8.22 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 79 N 8.07 5.02 0.00 2.61 2.77 0.00 0.00 7.13 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 8.08 4.54 0.00 1.42 1.69 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 2.54 2.44 0.00 81 Q 8.93 4.29 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 2.22 2.29 0.00 82 F 8.78 5.54 0.00 2.83 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.80 4.74 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.70 0.93 0.00 0.00 84 S 8.70 4.78 0.00 3.86 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 85 A 8.39 4.67 1.21 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 86 S 8.63 4.55 0.00 3.79 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 7.44 4.52 0.00 1.76 1.52 0.00 1.68 0.00 0.00 1.91 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.47 7.81 88 S 8.85 5.26 0.00 3.97 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 89 I 9.28 4.59 2.08 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.03 1.17 0.00 0.00 90 V 8.45 4.19 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 0.64 0.00 0.00 0.85 0.00 0.00 91 H 8.62 3.59 0.00 2.85 3.05 0.00 5.66 0.00 0.00 0.00 0.00 6.64 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 4.26 0.00 2.16 2.19 0.00 2.45 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.82 0.00 93 S 7.92 4.69 0.00 3.99 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 94 Y 7.84 4.31 0.00 2.85 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 95 N 8.06 4.50 0.00 2.58 2.43 0.00 0.00 6.66 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 96 S 7.95 4.07 0.00 3.96 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 97 N 8.27 4.44 0.00 2.79 2.83 0.00 0.00 6.85 7.08 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 98 T 7.71 4.07 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 1.15 0.00 0.00 99 L 8.19 3.77 0.00 1.39 1.88 0.82 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.74 4.45 0.00 2.78 2.66 0.00 0.00 7.24 6.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.77 4.64 0.00 2.94 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 4.80 0.00 3.14 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 0.00 103 I 7.23 4.83 1.49 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 1.38 1.30 0.20 0.00 0.00 104 M 9.25 5.42 0.00 2.12 1.84 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.65 0.00 105 L 9.32 5.38 0.00 1.75 1.86 0.04 1.06 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 0.00 106 I 9.10 5.01 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.95 0.88 0.00 0.00 107 K 8.60 3.87 0.00 0.79 1.03 0.00 1.16 0.00 0.00 1.31 0.00 0.00 2.64 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.73 0.21 7.81 108 L 8.21 4.41 0.00 1.46 1.56 0.90 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.67 4.21 0.00 1.65 1.83 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.52 7.81 110 S 7.72 4.60 0.00 3.88 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 0.00 111 A 8.41 4.35 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 9.01 4.17 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 0.00 113 S 9.09 4.46 0.00 3.86 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 0.00 114 L 8.48 4.48 0.00 1.70 1.62 0.95 1.11 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 0.00 115 N 8.75 4.89 0.00 2.86 2.91 0.00 0.00 6.38 7.84 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 0.00 116 S 8.77 4.18 0.00 4.01 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 0.00 117 R 7.94 4.35 0.00 1.88 1.99 0.00 3.17 0.00 0.00 3.27 7.31 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.58 4.40 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 0.00 128 C 8.36 4.45 0.00 2.94 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 4.35 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.02 4.54 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 *132 A 8.24 4.27 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 0.00 133 G 9.18 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 0.00 134 T 7.55 3.93 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 1.15 0.00 0.00 135 Q 8.60 4.67 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 136 C 9.34 5.29 0.00 2.78 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 9.01 5.16 0.00 1.74 1.56 0.95 1.11 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 9.03 5.19 1.86 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.46 0.96 0.00 0.00 139 S 8.40 4.91 0.00 3.55 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 0.00 140 G 7.52 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 0.00 141 W 8.68 4.88 0.00 3.18 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 0.00 142 G 8.60 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 8.61 3.65 0.00 2.07 2.57 0.00 0.00 7.10 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 0.00 144 T 7.95 5.08 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 145 K 7.82 4.61 0.00 1.74 1.69 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.27 1.27 7.81 146 S 8.59 4.51 0.00 4.13 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 0.00 147 S 7.98 4.80 0.00 3.83 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 0.00 148 G 7.18 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 0.00 0.00 0.00 149 T 8.26 4.69 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 1.43 0.00 0.00 150 S 9.12 4.34 0.00 3.84 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 0.00 151 Y 8.68 4.92 0.00 2.96 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 0.00 152 P 0.00 4.64 0.00 2.43 2.09 0.00 4.08 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.03 0.00 153 D 8.68 4.72 0.00 2.79 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 0.00 154 V 7.46 5.40 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 1.10 0.00 0.00 0.98 0.00 0.00 155 L 8.26 3.26 0.00 1.33 1.27 -0.74 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.09 4.84 0.00 1.70 1.49 0.00 1.59 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.47 7.81 157 C 8.75 5.20 0.00 1.56 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.43 4.89 0.00 1.68 1.43 0.99 0.74 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 8.99 5.06 0.00 1.82 1.82 0.00 1.86 0.00 0.00 1.81 0.00 0.00 2.80 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.64 1.48 7.81 160 A 9.01 4.87 1.21 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 0.00 161 P 0.00 5.10 0.00 2.01 2.07 0.00 3.12 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.68 0.00 162 I 8.24 4.35 1.89 0.00 0.00 0.50 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 0.60 0.79 0.00 0.00 163 L 8.85 5.07 0.00 1.47 1.56 0.87 1.03 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 0.00 164 S 8.42 4.31 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 8.91 4.42 0.00 2.77 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 0.00 166 S 8.24 4.16 0.00 3.87 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 0.00 167 S 7.81 4.12 0.00 4.01 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 7.97 4.53 0.00 2.93 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 0.00 169 K 8.15 4.09 0.00 1.85 1.90 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.53 1.67 7.81 170 S 7.80 3.99 0.00 3.93 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 0.00 171 A 7.78 4.65 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 0.00 172 S 7.80 4.62 0.00 4.23 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 0.00 173 S 9.11 4.45 0.00 3.47 3.39 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 0.00 174 F 7.76 4.90 0.00 2.86 2.64 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 0.00 175 I 8.31 3.92 1.91 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 1.44 0.75 0.96 0.00 0.00 176 I 8.39 4.62 1.99 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.06 1.00 0.00 0.00 177 T 8.32 4.49 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 1.27 0.00 0.00 178 S 8.51 4.38 0.00 4.02 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 8.16 4.91 0.00 2.91 3.09 0.00 0.00 6.62 8.29 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 0.00 180 M 7.91 5.60 0.00 1.88 2.12 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.62 0.00 181 F 8.77 5.11 0.00 3.04 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 0.00 182 C 9.04 5.33 0.00 3.07 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 0.00 183 A 9.15 5.06 1.27 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 0.00 184 G 7.00 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 0.00 0.00 0.00 184A Y 8.35 4.69 0.00 3.07 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.65 4.23 0.00 1.75 1.74 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.36 4.32 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 187 G 8.09 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 0.00 0.00 0.00 188 G 9.14 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 0.00 0.00 0.00 0.00 188A K 7.20 5.28 0.00 1.38 1.64 0.00 0.73 0.00 0.00 1.91 0.00 0.00 2.53 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.31 0.97 7.81 189 D 8.28 4.60 0.00 2.78 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.80 4.80 0.00 3.99 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 9.20 4.73 0.00 2.92 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.64 4.36 0.00 2.32 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.11 0.00 0.00 0.00 0.00 0.00 2.54 2.45 0.00 193 G 9.30 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.37 4.68 0.00 3.02 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 8.06 4.51 0.00 3.97 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 8.89 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 0.00 197 G 7.93 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 0.00 198 P 0.00 5.14 0.00 2.29 2.34 0.00 3.69 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 199 V 8.47 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 0.84 0.00 0.00 0.64 0.00 0.00 200 V 8.77 4.80 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 0.87 0.00 0.00 0.62 0.00 0.00 201 C 8.65 5.08 0.00 2.79 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 0.00 202 S 9.77 3.63 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 3.92 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 0.00 204 K 7.57 4.71 0.00 1.72 1.63 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.40 7.81 *209 L 8.23 4.34 0.00 1.49 1.64 0.96 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 8.66 4.41 0.00 1.99 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.40 0.00 0.00 0.00 0.00 0.00 2.43 2.34 0.00 211 G 8.03 5.33 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 0.00 212 I 8.21 5.25 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.98 0.99 0.00 0.00 213 V 8.95 3.82 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 1.01 0.00 0.00 1.12 0.00 0.00 214 S 8.43 4.82 0.00 3.90 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 0.00 215 W 7.20 4.87 0.00 3.32 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 8.44 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 0.00 0.00 0.00 217 E 8.31 4.47 0.00 2.19 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 2.74 2.71 0.00 *219 G 7.99 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.26 4.79 0.00 2.91 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 0.00 221 A 8.95 3.77 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 221A Q 7.79 4.67 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 7.01 0.00 0.00 0.00 0.00 0.00 2.56 2.31 0.00 222 K 8.43 4.23 0.00 1.73 1.74 0.00 1.91 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.59 7.81 223 N 9.34 4.40 0.00 2.90 2.97 0.00 0.00 6.77 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 0.00 224 K 7.72 4.54 0.00 1.84 1.75 0.00 1.81 0.00 0.00 1.82 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.60 1.53 7.81 225 P 0.00 4.62 0.00 2.07 2.08 0.00 3.83 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.97 0.00 226 G 8.34 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 0.44 0.00 0.00 -0.33 0.00 0.00 228 Y 8.02 4.85 0.00 1.43 2.30 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 0.00 229 T 8.48 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 0.00 230 K 9.40 4.92 0.00 2.14 1.93 0.00 1.72 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.55 1.62 7.81 231 V 8.79 3.95 2.42 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 1.13 0.00 0.00 1.11 0.00 0.00 232 C 8.36 4.55 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 7.99 4.27 0.00 2.44 2.38 0.00 0.00 6.81 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 0.00 234 Y 8.16 4.81 0.00 3.21 3.28 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 0.00 235 V 7.98 3.68 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 1.08 0.00 0.00 236 S 8.09 4.07 0.00 3.97 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 0.00 237 W 8.34 4.19 0.00 3.54 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 0.00 238 I 8.29 3.05 2.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.90 0.73 0.00 0.00 239 K 8.06 3.76 0.00 1.90 1.77 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.58 7.81 240 Q 8.06 3.90 0.00 1.99 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 241 T 7.27 3.58 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 242 I 6.99 2.73 0.60 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.46 -0.64 0.00 0.00 243 A 7.46 4.04 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 S 7.48 4.60 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 0.00 245 N 7.77 4.71 0.00 3.12 2.97 0.00 0.00 6.77 7.44 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 * Residues marked with a * may have inaccurate shift predictions.