NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4390 8.3349 115.4132 57.9586 65.1083 174.1629 2 K 4.3140 7.6879 119.9525 53.7083 36.0736 173.4966 3 T 4.4862 8.3563 122.1901 60.9868 68.8377 173.4136 4 G 3.9201 7.8278 109.5243 45.2565 0.0000 171.8826 5 G 4.2909 7.9669 106.0214 46.0595 0.0000 172.8841 6 K 4.9875 8.4348 120.7730 54.6276 36.1689 174.7408 7 I 4.4901 7.9605 126.5184 58.9128 41.6190 173.6323 8 S 4.8350 8.6885 123.1028 56.3041 65.2458 172.4194 9 F 5.1879 8.7443 125.2518 55.8859 41.8144 174.1257 10 Y 5.2766 8.8876 119.6946 56.2677 40.6454 176.8310 11 E 4.3278 9.2504 123.1320 58.5395 30.2107 176.4278 12 D 4.9872 8.0049 117.4133 51.8010 43.9672 175.4741 13 R 4.0644 8.2000 120.4027 56.9079 30.5586 176.4315 14 N 3.8980 8.1991 114.4412 54.4757 36.3068 174.4747 15 F 2.9385 6.8788 111.8604 58.8133 36.6803 175.0893 16 Q 4.6622 7.6399 117.0669 54.8273 31.7796 176.7845 17 G 4.0929 8.5439 106.2051 44.2883 0.0000 172.8499 18 R 4.2063 8.4190 118.3146 56.4618 31.1944 176.3497 19 R 5.1710 8.6376 124.8637 54.7161 33.5144 173.8600 20 Y 4.8235 8.6071 124.6685 55.9918 42.2310 173.4180 21 D 5.2235 7.8720 125.6843 52.5220 43.5061 175.1362 22 C 4.5846 8.5640 122.3699 57.4592 34.8999 173.8186 23 D 5.1536 8.5055 122.6670 53.1721 41.3831 174.5541 24 C 4.9505 7.7388 118.5602 58.1770 34.4508 172.7695 25 D 4.9282 8.7013 121.4806 53.6233 39.5387 175.4636 26 C 4.8242 9.5672 121.2310 57.7026 34.0117 174.6735 27 A 3.7970 9.0972 130.0731 53.7225 18.4397 176.2498 28 D 4.4609 7.8684 114.9736 53.1292 39.8686 174.5220 29 F 4.9049 8.6007 118.8500 56.4798 38.4558 178.1003 30 R 3.6868 7.1615 121.3652 58.6909 29.9036 178.6591 31 S 3.9652 7.6741 112.2874 60.2408 63.0341 174.2582 32 Y 4.3518 7.4290 116.6167 58.1781 38.9641 176.0568 33 L 4.6050 7.2376 119.5291 53.4051 45.8008 176.6008 34 S 4.3011 8.2150 117.7663 59.0753 63.6931 173.9221 35 R 4.3913 7.1930 115.0218 55.9915 31.0694 173.6557 36 C 4.9675 8.8460 116.4046 58.8786 31.5822 173.8542 37 N 5.5443 9.4878 120.7991 52.4336 39.9843 174.5160 38 S 5.1288 7.9086 112.6991 57.6227 66.5792 173.2829 39 I 5.3153 8.7984 120.8620 60.0227 42.1857 173.8732 40 R 5.0036 9.3861 125.5676 54.6092 33.1919 174.1286 41 V 4.2950 8.9893 127.1180 61.3961 32.6124 175.6982 42 E 4.0970 9.0628 130.6583 58.8794 30.0931 176.6926 43 G 4.1813 8.2321 103.4676 46.3265 0.0000 174.3604 44 G 4.3776 9.2087 108.0669 45.3064 0.0000 172.5050 45 T 5.0639 8.0117 113.9364 61.5076 71.6673 173.7662 46 W 5.3175 9.2957 124.3751 54.8381 33.7787 173.8767 47 A 5.3258 9.4662 123.9465 50.4839 21.1803 176.1579 48 V 5.1450 8.9233 115.2599 59.8386 35.2696 174.4733 49 Y 5.2941 9.1668 121.2027 56.1533 40.8607 176.5539 50 E 4.7376 9.1955 123.9572 58.2038 30.4102 177.1049 51 R 4.7608 8.3640 117.3476 52.8885 33.6500 173.0871 52 P 4.2744 0.0000 0.0000 63.7625 31.4166 174.6792 53 N 3.3094 7.9285 113.5205 55.4127 37.8196 173.7837 54 F 3.0716 7.0216 109.9267 58.2608 36.7645 174.8285 55 S 4.8437 7.8650 113.7091 57.1887 66.5604 175.1400 56 G 4.0738 8.6244 107.3202 44.5908 0.0000 172.4236 57 H 4.3425 8.9264 115.7681 56.1113 29.8896 174.4751 58 M 4.7292 8.0662 119.4459 53.5082 33.5353 174.5726 59 Y 4.7963 8.6694 118.6237 56.3707 42.6050 174.1890 60 I 4.7640 8.6735 123.8837 60.1893 39.0760 175.1023 61 L 4.8510 9.3540 127.2791 52.2623 44.0448 174.7331 62 P 4.9138 0.0000 0.0000 61.8009 32.9435 175.9726 63 Q 4.1486 8.9232 118.6412 55.7642 29.9760 177.6466 64 G 4.0373 7.3844 110.1699 45.0858 0.0000 170.3215 65 E 4.9001 7.8607 119.7333 54.3895 31.8417 175.1339 66 Y 4.5098 8.8632 123.6327 55.4829 38.8368 174.4607 67 P 3.5831 0.0000 0.0000 63.5001 31.9753 176.1327 68 E 5.1544 7.5876 117.0035 53.9385 33.5802 175.5465 69 Y 4.5109 9.0739 120.6931 60.7478 37.9718 178.8884 70 Q 3.8155 6.4476 118.9706 58.3280 28.4861 178.6414 71 R 4.1754 7.7007 118.0314 57.6118 29.9354 177.5232 72 W 4.7173 8.3881 127.5603 56.3251 30.6126 175.6509 73 M 3.4366 7.8022 114.6624 56.0125 29.5962 177.2659 74 G 2.1192 6.4005 106.6844 45.0400 0.0000 174.4535 75 L 4.0122 7.7384 123.7983 57.3660 42.5567 175.7668 76 N 4.6680 7.4490 112.7121 53.1309 42.1725 173.5582 77 D 5.0044 8.3866 118.0070 54.9267 41.3908 175.9667 78 R 4.7244 7.9485 119.2367 54.8160 31.0848 175.8156 79 L 5.1835 8.5143 122.7352 53.5551 45.4305 175.9001 80 G 3.9131 9.0008 110.2964 46.4241 0.0000 172.4838 81 S 5.5263 8.2205 113.8228 57.6667 66.1648 172.5555 82 C 5.6591 9.4234 118.0503 57.1411 33.4402 173.0367 83 R 5.1581 9.5459 118.8866 54.4527 34.3750 174.2030 84 A 3.2038 8.2183 124.5577 51.1826 19.2117 176.9049 85 V 3.8392 8.1329 123.5102 62.0112 32.5205 175.1296 86 H 4.7713 8.4889 125.2223 54.5923 29.9551 174.4698 87 L 4.6289 8.3468 124.0963 53.1023 42.9181 175.8865 88 S 4.7696 8.5206 116.8344 56.5077 64.7881 173.0428 89 S 4.9818 8.5522 120.9412 56.8024 65.3088 172.6744 90 G 4.5131 8.5861 112.4760 46.2977 0.0000 172.8343 91 G 3.9076 8.0319 112.3018 45.0674 0.0000 175.0981 92 Q 4.4852 9.4254 122.4217 53.7184 31.3494 173.4708 93 A 4.8492 8.6498 128.4059 51.2749 19.0821 176.0699 94 K 4.8629 8.5856 123.2325 54.5691 36.1149 174.5926 95 I 4.6515 8.5829 125.8915 58.9343 41.7514 173.6849 96 Q 5.1199 8.5634 125.3523 54.4640 31.4475 174.6993 97 V 4.8772 8.6901 115.5007 59.5417 35.5563 174.4896 98 F 5.1692 8.8846 121.9052 55.5643 41.6055 176.2689 99 E 4.1051 9.2564 123.9505 58.3379 29.9810 176.6860 100 K 4.4974 8.7392 118.3543 53.6271 35.2240 175.6120 101 G 3.5354 8.2445 109.0639 46.2029 0.0000 172.4229 102 D 3.7841 7.7779 116.6295 55.6024 39.2684 174.2973 103 F 2.9234 6.6064 111.3593 58.7904 36.9414 174.2663 104 N 5.1515 8.0222 116.7970 52.0092 42.9187 175.7323 105 G 3.6862 8.6600 105.4953 44.2718 0.0000 172.6704 106 Q 4.1455 8.4786 119.2009 56.1951 30.3735 175.6544 107 M 4.6400 8.0619 124.2396 53.7388 34.9287 174.2617 108 Y 4.7097 8.4667 121.6543 56.0989 42.2533 173.8216 109 E 5.1592 9.0017 123.8616 54.8022 32.4266 174.7161 110 T 4.9800 8.9446 120.0716 61.0155 71.4170 173.8475 111 T 4.8052 8.8311 115.1916 61.3762 69.3974 173.3752 112 E 4.8773 8.0627 120.8516 54.2279 32.8006 175.4392 113 D 4.3938 8.4158 119.6565 53.4368 40.2808 175.4383 114 C 4.5610 6.9788 120.1561 56.7764 33.5432 173.1332 115 P 4.1604 0.0000 0.0000 64.4019 31.7030 176.1172 116 S 4.5496 7.5928 114.6528 55.9244 66.1512 174.4495 117 I 4.1049 8.9529 129.9744 64.6885 36.9526 178.3234 118 M 4.3948 8.0126 120.0136 58.0338 31.9390 177.7715 119 E 3.9013 8.0272 118.3890 58.9973 29.9698 178.1072 120 Q 3.7426 7.7496 118.5472 58.2125 29.3226 176.4836 121 F 4.1953 7.9343 114.7042 56.4738 39.8452 175.1228 122 H 4.2754 7.8756 116.6218 56.7991 26.5240 174.2959 123 L 4.8455 7.8342 117.8357 53.2103 43.8102 177.8186 124 R 4.2673 8.6016 121.1416 57.6900 30.8633 176.0319 125 E 4.7906 7.7674 114.7169 54.9990 33.6438 174.0120 126 I 4.7405 8.1036 120.4021 60.3001 39.8109 175.4048 127 H 4.7757 8.4924 119.9564 56.1101 30.4045 174.5039 128 S 4.5169 7.4736 111.6632 57.4871 65.5461 172.7777 129 C 5.2465 7.9071 116.1731 57.4363 32.0195 173.0454 130 K 4.5904 9.0720 123.0954 54.7899 34.3767 174.8216 131 V 4.2144 8.1971 127.1534 59.7803 33.5655 175.9045 132 V 3.7626 7.7013 123.4202 61.6898 32.2514 173.8685 133 E 4.6283 8.4414 126.4341 54.6163 34.0325 175.6679 134 G 4.1380 6.9518 112.3029 45.5822 0.0000 171.4317 135 T 5.3048 7.6684 111.1090 59.2920 70.5918 172.9965 136 W 5.0268 9.2494 127.9778 54.8842 33.5729 174.3461 137 I 5.1050 8.3256 122.5375 59.6448 40.0465 174.6069 138 F 5.5662 9.3678 124.6393 56.0395 42.4001 174.0456 139 Y 5.2624 9.7492 119.4548 56.3136 40.9114 176.5129 140 E 4.2325 9.2959 124.0993 58.2288 30.6733 176.8026 141 L 4.8622 8.3742 119.0096 51.4883 43.5573 174.1092 142 P 4.6085 0.0000 0.0000 63.5643 31.4862 175.2306 143 N 3.2996 8.3187 113.5292 54.4218 37.9745 173.3976 144 Y 2.8269 6.2768 108.8521 58.8595 35.6863 169.5401 145 R 4.7075 7.8831 117.0600 55.0734 34.5476 176.9810 146 G 4.1280 8.6092 105.9396 44.2804 0.0000 172.8756 147 R 3.9818 8.3759 118.3113 56.5126 31.1967 176.4910 148 Q 5.1011 8.1615 123.4183 54.2632 31.8620 174.4018 149 Y 4.5852 8.9432 119.4764 56.1022 41.6461 174.2128 150 L 5.1160 8.8933 125.8696 53.7672 43.5849 175.0598 151 L 4.6600 9.3462 129.1552 54.6009 44.2196 174.3056 152 D 5.0436 8.3793 123.7530 53.6333 40.0976 178.9981 153 K 4.5321 8.9997 125.5233 56.1554 32.5480 172.4304 154 K 4.3941 7.9606 119.3790 54.5558 35.3348 174.0903 155 E 4.4482 8.1474 120.0322 54.9028 29.8059 175.5218 156 Y 4.6498 8.6900 122.1023 55.7811 38.0103 175.7527 157 R 4.0857 8.4986 125.3723 56.8788 31.2837 175.8647 158 K 4.8292 7.5791 115.9393 53.3067 35.9954 175.0639 159 P 4.2966 0.0000 0.0000 66.0164 31.4170 178.9178 160 V 3.8341 7.7323 117.5350 64.7085 31.3020 176.9484 161 D 4.4330 8.2975 119.0786 56.0603 40.8771 176.7222 162 W 5.0610 8.6637 128.3296 57.1755 30.6110 177.1012 163 G 3.8100 8.4537 104.2360 45.8475 0.0000 173.4271 164 A 4.2448 7.0633 123.0860 50.3375 20.2463 178.4185 165 A 4.3080 8.2604 123.4287 53.3349 19.8096 177.7110 166 S 4.6414 7.2551 111.0551 56.3720 67.1990 172.4147 167 P 4.4411 0.0000 0.0000 62.9801 30.9856 175.2550 168 A 4.5395 7.5043 122.3773 52.1236 18.9082 178.2045 169 I 4.7347 8.1789 123.3538 60.3007 41.2933 174.7134 170 Q 4.7707 9.0328 122.9716 56.3496 31.6280 175.1067 171 S 5.2424 8.2730 112.2424 57.5591 66.2796 172.7106 172 F 5.7487 8.6770 117.4360 56.0788 41.5253 173.3454 173 R 4.7572 9.1420 118.1582 54.7288 34.7797 174.2736 174 R 3.6552 8.0504 121.9575 55.4219 31.3735 175.3804 175 I 4.3197 7.1970 125.4501 60.0307 38.2781 175.6371 176 V 4.2494 8.1480 127.7782 61.6082 34.7770 175.4430 *177 E 4.1720 8.7174 120.0838 56.2417 30.2648 175.4271 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 S 8.33 4.44 0.00 4.00 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 2 K 7.69 4.31 0.00 1.80 1.73 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.35 1.49 7.81 3 T 8.36 4.49 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 1.22 0.00 0.00 4 G 7.83 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 5 G 7.97 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 0.00 0.00 0.00 0.00 6 K 8.43 4.99 0.00 1.79 1.52 0.00 1.45 0.00 0.00 1.48 0.00 0.00 2.70 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.14 1.31 7.81 7 I 7.96 4.49 0.81 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 -0.30 0.64 0.08 0.00 0.00 8 S 8.69 4.83 0.00 3.57 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 F 8.74 5.19 0.00 2.99 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 10 Y 8.89 5.28 0.00 3.12 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 11 E 9.25 4.33 0.00 1.96 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 2.61 2.52 0.00 12 D 8.00 4.99 0.00 2.66 2.63 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 13 R 8.20 4.06 0.00 1.94 1.75 0.00 3.54 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.68 0.00 14 N 8.20 3.90 0.00 2.80 2.85 0.00 0.00 6.98 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 F 6.88 2.94 0.00 2.99 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 16 Q 7.64 4.66 0.00 2.47 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 5.33 0.00 0.00 0.00 0.00 0.00 2.49 2.43 0.00 17 G 8.54 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 18 R 8.42 4.21 0.00 1.98 1.96 0.00 3.18 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.71 0.00 19 R 8.64 5.17 0.00 1.91 1.76 0.00 3.37 0.00 0.00 3.12 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.73 0.00 20 Y 8.61 4.82 0.00 3.13 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 7.87 5.22 0.00 2.23 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 C 8.56 4.58 0.00 2.94 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 23 D 8.51 5.15 0.00 2.66 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 C 7.74 4.95 0.00 3.01 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 25 D 8.70 4.93 0.00 2.97 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 26 C 9.57 4.82 0.00 3.03 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 27 A 9.10 3.80 1.19 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 0.00 0.00 0.00 28 D 7.87 4.46 0.00 2.66 2.58 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 29 F 8.60 4.90 0.00 3.04 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 30 R 7.16 3.69 0.00 1.62 1.76 0.00 3.22 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.15 0.00 31 S 7.67 3.97 0.00 3.28 3.51 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 32 Y 7.43 4.35 0.00 2.33 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.24 4.60 0.00 1.90 1.59 1.14 0.81 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 S 8.22 4.30 0.00 3.77 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 35 R 7.19 4.39 0.00 1.88 1.87 0.00 3.01 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.58 0.00 36 C 8.85 4.97 0.00 3.01 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 37 N 9.49 5.54 0.00 2.83 2.99 0.00 0.00 6.27 7.58 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 38 S 7.91 5.13 0.00 3.76 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 39 I 8.80 5.32 1.66 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 1.15 0.70 0.28 0.00 0.00 40 R 9.39 5.00 0.00 2.05 1.86 0.00 2.83 0.00 0.00 3.06 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 41 V 8.99 4.30 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 0.90 0.00 0.00 0.84 0.00 0.00 42 E 9.06 4.10 0.00 1.94 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 2.27 2.37 0.00 43 G 8.23 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.21 4.38 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 45 T 8.01 5.06 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 1.34 0.00 0.00 46 W 9.30 5.32 0.00 3.24 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 47 A 9.47 5.33 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 48 V 8.92 5.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.12 0.00 0.00 49 Y 9.17 5.29 0.00 3.11 3.27 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 50 E 9.20 4.74 0.00 2.26 2.20 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 2.44 2.42 0.00 51 R 8.36 4.76 0.00 2.08 1.78 0.00 3.25 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 52 P 0.00 4.27 0.00 2.05 1.97 0.00 3.87 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 1.92 1.87 0.00 53 N 7.93 3.31 0.00 2.72 2.78 0.00 0.00 7.23 6.98 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 54 F 7.02 3.07 0.00 2.85 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 0.00 0.00 0.00 55 S 7.87 4.84 0.00 3.95 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 56 G 8.62 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 57 H 8.93 4.34 0.00 3.38 3.30 0.00 5.76 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 M 8.07 4.73 0.00 1.32 1.16 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 2.08 2.12 0.00 59 Y 8.67 4.80 0.00 3.56 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 60 I 8.67 4.76 1.99 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 1.39 0.84 0.99 0.00 0.00 61 L 9.35 4.85 0.00 1.50 1.52 0.23 -0.07 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 62 P 0.00 4.91 0.00 2.18 2.15 0.00 4.00 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.11 0.00 63 Q 8.92 4.15 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.13 0.00 0.00 0.00 0.00 0.00 2.62 2.51 0.00 64 G 7.38 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 65 E 7.86 4.90 0.00 1.81 1.71 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 2.35 2.35 0.00 66 Y 8.86 4.51 0.00 3.33 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 P 0.00 3.58 0.00 1.98 1.76 0.00 3.63 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.28 0.00 68 E 7.59 5.15 0.00 1.85 1.56 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 2.22 2.16 0.00 69 Y 9.07 4.51 0.00 3.49 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 70 Q 6.45 3.82 0.00 1.71 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.87 0.00 0.00 0.00 0.00 0.00 1.94 1.16 0.00 71 R 7.70 4.18 0.00 2.21 2.16 0.00 3.26 0.00 0.00 3.15 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 72 W 8.39 4.72 0.00 2.93 3.27 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 73 M 7.80 3.44 0.00 1.99 1.77 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 74 G 6.40 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 0.00 0.00 0.00 75 L 7.74 4.01 0.00 1.51 1.58 0.91 0.85 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 76 N 7.45 4.67 0.00 2.68 2.63 0.00 0.00 6.79 8.02 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 77 D 8.39 5.00 0.00 2.63 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 78 R 7.95 4.72 0.00 1.90 1.88 0.00 3.25 0.00 0.00 3.32 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 79 L 8.51 5.18 0.00 1.84 1.81 0.58 1.18 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 80 G 9.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.22 5.53 0.00 3.89 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 C 9.42 5.66 0.00 3.28 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 83 R 9.55 5.16 0.00 1.73 1.63 0.00 2.21 0.00 0.00 2.30 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.45 0.00 84 A 8.22 3.20 -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 85 V 8.13 3.84 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 0.76 0.00 0.00 0.94 0.00 0.00 86 H 8.49 4.77 0.00 3.16 3.14 0.00 5.74 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.35 4.63 0.00 1.63 1.59 0.93 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 88 S 8.52 4.77 0.00 4.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.55 4.98 0.00 3.85 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 90 G 8.59 4.51 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 0.00 0.00 0.00 91 G 8.03 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 92 Q 9.43 4.49 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.92 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 93 A 8.65 4.85 1.67 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 0.00 0.00 94 K 8.59 4.86 0.00 1.85 1.61 0.00 1.83 0.00 0.00 1.79 0.00 0.00 2.78 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.63 7.81 95 I 8.58 4.65 0.71 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.91 0.92 0.00 0.00 96 Q 8.56 5.12 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.47 0.00 0.00 0.00 0.00 0.00 2.26 2.43 0.00 97 V 8.69 4.88 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 0.62 0.00 0.00 0.77 0.00 0.00 98 F 8.88 5.17 0.00 3.00 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 99 E 9.26 4.11 0.00 2.10 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 2.36 2.36 0.00 100 K 8.74 4.50 0.00 1.82 1.63 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.35 7.81 101 G 8.24 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 0.00 102 D 7.78 3.78 0.00 3.11 2.69 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 0.00 103 F 6.61 2.92 0.00 2.80 1.60 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 0.00 104 N 8.02 5.15 0.00 2.88 2.71 0.00 0.00 7.27 7.31 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 0.00 105 G 8.66 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 0.00 0.00 0.00 106 Q 8.48 4.15 0.00 2.20 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.31 7.09 0.00 0.00 0.00 0.00 0.00 1.88 2.16 0.00 107 M 8.06 4.64 0.00 1.53 0.67 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 108 Y 8.47 4.71 0.00 2.83 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 0.00 109 E 9.00 5.16 0.00 1.93 1.83 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 2.38 2.22 0.00 110 T 8.94 4.98 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 111 T 8.83 4.81 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 112 E 8.06 4.88 0.00 2.08 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 2.28 2.29 0.00 113 D 8.42 4.39 0.00 2.57 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 C 6.98 4.56 0.00 2.76 2.05 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 0.00 115 P 0.00 4.16 0.00 2.01 2.05 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.90 0.00 116 S 7.59 4.55 0.00 3.76 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 0.00 117 I 8.95 4.10 2.04 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.10 1.08 0.00 0.00 118 M 8.01 4.39 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.49 0.00 119 E 8.03 3.90 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 2.24 2.36 0.00 120 Q 7.75 3.74 0.00 1.85 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.51 0.00 0.00 0.00 0.00 0.00 1.16 1.77 0.00 121 F 7.93 4.20 0.00 2.98 2.60 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 0.00 122 H 7.88 4.28 0.00 3.35 3.38 0.00 5.61 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 L 7.83 4.85 0.00 1.76 1.61 0.96 1.10 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 0.00 124 R 8.60 4.27 0.00 1.84 2.01 0.00 3.23 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 125 E 7.77 4.79 0.00 1.95 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 2.21 2.35 0.00 126 I 8.10 4.74 1.87 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 1.24 0.64 0.89 0.00 0.00 127 H 8.49 4.78 0.00 2.96 3.31 0.00 5.89 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 S 7.47 4.52 0.00 3.40 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 C 7.91 5.25 0.00 2.82 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 0.00 130 K 9.07 4.59 0.00 1.72 1.61 0.00 1.21 0.00 0.00 1.53 0.00 0.00 2.81 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.21 1.24 7.81 131 V 8.20 4.21 1.37 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 0.43 0.00 0.00 -0.71 0.00 0.00 132 V 7.70 3.76 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.84 0.00 0.00 133 E 8.44 4.63 0.00 2.30 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 0.00 2.68 2.58 0.00 134 G 6.95 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 0.00 0.00 0.00 0.00 135 T 7.67 5.30 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 1.26 0.00 0.00 136 W 9.25 5.03 0.00 3.29 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 0.00 137 I 8.33 5.11 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.82 0.31 0.00 0.00 138 F 9.37 5.57 0.00 3.49 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 0.00 139 Y 9.75 5.26 0.00 3.04 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 E 9.30 4.23 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 141 L 8.37 4.86 0.00 1.84 1.53 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 142 P 0.00 4.61 0.00 2.10 2.13 0.00 3.85 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.95 0.00 143 N 8.32 3.30 0.00 2.67 2.71 0.00 0.00 7.07 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 Y 6.28 2.83 0.00 3.02 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 0.00 0.00 0.00 145 R 7.88 4.71 0.00 1.95 1.81 0.00 3.10 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 146 G 8.61 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 R 8.38 3.98 0.00 1.83 1.80 0.00 2.96 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.26 0.00 148 Q 8.16 5.10 0.00 1.67 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.61 0.00 0.00 0.00 0.00 0.00 2.37 2.21 0.00 149 Y 8.94 4.59 0.00 2.92 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 0.00 150 L 8.89 5.12 0.00 1.77 1.74 1.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 151 L 9.35 4.66 0.00 1.96 1.60 0.07 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 152 D 8.38 5.04 0.00 3.00 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 0.00 153 K 9.00 4.53 0.00 1.68 1.70 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.40 7.81 154 K 7.96 4.39 0.00 1.58 1.00 0.00 1.67 0.00 0.00 1.44 0.00 0.00 2.55 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.80 1.20 7.81 155 E 8.15 4.45 0.00 1.89 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 156 Y 8.69 4.65 0.00 2.80 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 0.00 157 R 8.50 4.09 0.00 1.83 1.88 0.00 3.11 0.00 0.00 3.32 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.60 0.00 158 K 7.58 4.83 0.00 1.81 1.63 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.35 7.81 159 P 0.00 4.30 0.00 2.17 2.27 0.00 3.69 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 2.05 1.94 0.00 160 V 7.73 3.83 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 1.25 0.00 0.00 0.92 0.00 0.00 161 D 8.30 4.43 0.00 2.80 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 0.00 162 W 8.66 5.06 0.00 3.11 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 0.00 163 G 8.45 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 0.00 0.00 0.00 164 A 7.06 4.24 0.69 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 0.00 0.00 165 A 8.26 4.31 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 0.00 166 S 7.26 4.64 0.00 3.76 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 0.00 167 P 0.00 4.44 0.00 1.99 2.06 0.00 3.62 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 2.10 1.85 0.00 168 A 7.50 4.54 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 0.00 169 I 8.18 4.73 2.03 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 1.59 0.90 1.29 0.00 0.00 170 Q 9.03 4.77 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.65 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 171 S 8.27 5.24 0.00 3.95 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 0.00 172 F 8.68 5.75 0.00 2.66 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 R 9.14 4.76 0.00 1.72 1.54 0.00 2.21 0.00 0.00 2.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.08 0.00 174 R 8.05 3.66 0.00 0.96 1.45 0.00 3.20 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.96 0.00 175 I 7.20 4.32 1.84 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 1.08 0.78 0.91 0.00 0.00 176 V 8.15 4.25 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 0.86 0.00 0.00 0.86 0.00 0.00 *177 E 8.72 4.17 0.00 1.78 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.39 0.00 * Residues marked with a * may have inaccurate shift predictions.