NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.1725 7.8827 121.4529 60.8348 37.8036 174.2800 17 V 4.1857 8.1192 127.1256 62.5444 32.2021 174.0285 18 G 4.0202 8.4407 116.2999 46.1655 0.0000 170.3943 19 G 4.5053 7.5765 104.5623 44.7046 0.0000 170.5765 20 Y 5.1086 8.2560 116.4904 54.9437 41.4381 175.4074 21 T 4.1796 8.6198 118.0824 64.1872 68.5756 175.3839 22 C 4.2478 8.9743 124.7550 58.2453 40.4835 174.4175 23 G 4.0131 8.0747 108.6998 44.5656 0.0000 177.3168 24 A 3.4702 8.9496 123.1987 52.5215 17.8309 179.5857 25 N 4.4011 8.6402 116.8039 53.7278 40.1637 172.4827 26 T 4.5761 8.3685 111.6490 60.8050 70.8371 174.9231 27 V 3.9615 7.0398 120.6836 60.8152 31.5468 173.9393 28 P 4.2610 0.0000 0.0000 65.4506 32.0713 178.1231 29 Y 5.0378 6.9977 113.3689 56.9983 38.4587 174.6011 30 Q 4.4667 7.0835 122.5854 56.3584 29.8300 175.4661 31 V 4.8085 8.7137 117.7842 59.8792 36.9025 173.8587 32 S 5.0755 9.2060 118.4705 56.7176 64.5487 172.7268 33 L 4.5797 8.3681 127.7353 53.6214 42.8496 175.1837 34 N 5.8717 9.3294 123.1150 50.1962 42.0364 174.5015 *37 S 4.1542 8.1498 117.3391 58.1476 64.0710 172.4498 38 G 4.1939 10.4546 109.5387 46.7058 0.0000 172.2476 39 Y 4.8115 6.6609 114.9894 55.3056 40.9901 173.1036 40 H 4.7087 8.7758 120.6695 56.2621 30.2818 174.5305 41 F 5.0898 7.8561 118.8457 56.4421 39.6858 173.0335 42 C 4.6783 6.6164 115.6843 56.8993 44.7015 171.6998 43 G 4.5996 8.5486 107.5505 46.5441 0.0000 172.2034 44 G 4.6030 7.6540 106.8982 46.1472 0.0000 172.4042 45 S 5.2390 8.2538 115.5282 56.2614 65.6579 173.8606 46 L 4.7050 8.8753 126.8466 54.6630 41.7482 177.5193 47 I 4.0130 8.3407 128.2332 62.2116 37.7854 176.1371 48 N 4.3616 8.4355 118.5768 53.2625 38.7821 177.3132 49 S 3.7669 6.9704 114.8743 58.4737 65.1806 175.3151 50 Q 4.3062 8.1176 118.4279 55.0047 30.3584 174.9092 51 W 5.3955 8.7630 119.6094 54.7673 32.8362 174.8945 52 V 5.0124 9.4079 122.4640 61.2338 34.2102 174.6247 53 V 4.8054 8.8497 128.0239 61.0486 33.8954 175.0168 54 S 4.9572 8.8906 116.6087 57.5655 66.9026 173.0666 55 A 4.2583 8.4085 124.0624 51.4429 18.5372 178.3487 56 A 3.9426 8.5629 126.8067 55.3379 18.3966 178.4303 57 H 4.5083 8.0494 108.9996 56.9013 28.8181 175.3343 58 C 4.6956 8.3143 117.4988 57.3187 40.6182 173.4004 59 Y 4.2394 7.4265 121.6849 57.9984 38.7999 175.3123 60 K 4.3849 7.0147 123.9298 54.7684 36.2632 175.5520 61 S 3.9991 8.3216 116.0631 58.9810 63.9083 174.4401 62 G 3.8352 8.3191 113.2773 46.4216 0.0000 172.2178 63 I 4.3075 7.1096 122.0455 60.8506 40.0113 175.1464 64 Q 4.7228 8.9870 124.1834 54.1328 31.9583 174.6869 65 V 4.3662 8.8388 125.0548 61.9640 33.3860 174.7052 66 R 5.2470 8.7713 127.6827 54.0444 32.0175 176.0793 67 L 4.4593 8.1798 124.7059 52.6889 44.8902 177.1849 *69 G 4.0397 8.2391 106.1203 45.6307 0.0000 173.0270 70 E 4.3408 7.7228 117.9339 55.6455 30.2543 174.7639 71 D 4.8702 8.4007 117.6934 54.5138 44.0453 174.1849 72 N 5.4722 7.9635 116.8805 51.8362 40.8368 175.0171 73 I 4.1467 7.9438 121.5113 60.2324 37.9138 175.5743 74 N 4.9807 7.9547 115.9102 54.6809 45.7800 175.4562 75 V 4.4224 7.8767 116.5722 60.7176 33.7232 176.5805 76 V 4.7087 7.9211 124.9171 62.5362 29.6000 175.9316 77 E 4.2089 8.1921 127.6241 54.9174 27.4525 174.5288 78 G 3.8799 7.3709 108.7012 46.4737 0.0000 171.4334 79 N 4.4573 7.9982 120.5350 52.0728 39.3586 174.8921 80 E 4.5070 8.6763 124.1373 54.6245 32.0459 174.0923 81 Q 4.4434 8.4599 125.2529 54.4794 32.1879 174.0058 82 F 4.9608 9.2033 123.5120 56.2108 40.0218 175.4820 83 I 4.6236 8.7713 125.5558 59.3733 40.2489 175.8642 84 S 4.6844 8.6449 121.5011 58.2557 64.5829 172.7945 85 A 4.4353 7.8894 125.0153 50.9251 19.1141 176.9779 86 S 4.1026 9.3872 120.3766 59.8346 62.4055 173.6270 87 K 4.5658 7.6062 117.1416 54.7434 35.0099 174.9557 88 S 4.9680 8.8255 120.9135 56.8386 63.8717 172.3087 89 I 4.3560 9.0118 125.1748 59.9659 37.7913 175.3458 90 V 4.2588 8.3993 127.4094 62.2641 32.8379 175.1639 91 H 3.8957 8.7162 126.8279 55.2828 30.3696 174.3534 92 P 4.4658 0.0000 0.0000 64.6211 30.9979 176.6548 93 S 4.5948 7.7603 111.8531 58.0911 65.5409 173.2438 94 Y 4.2813 8.2902 123.5532 57.8920 39.0683 174.5292 95 N 4.5819 8.3201 126.0873 51.3085 39.3551 175.2201 96 S 4.6096 7.7549 120.9332 60.2864 62.8396 175.5061 97 N 4.4121 7.7480 118.1087 55.9037 38.8518 176.6032 98 T 3.7046 8.3384 108.7987 62.6391 69.1183 174.6190 99 L 3.7954 7.9501 120.8520 55.6829 39.4674 173.7852 100 N 4.6748 7.8534 116.4135 53.9875 39.8684 174.3048 101 N 5.0071 8.7228 119.3225 54.1787 35.7910 175.6398 102 D 4.6569 8.0100 117.9943 53.3631 39.9196 173.8493 103 I 4.6703 7.2234 121.4093 59.2268 41.9600 172.5675 104 M 5.5051 9.7474 128.5567 53.8890 36.3443 173.4318 105 L 5.4029 9.5621 124.1149 53.1125 45.0768 175.3294 106 I 4.8805 9.4647 124.9075 59.3794 40.2176 174.3029 107 K 3.9228 8.6421 128.5009 54.1054 33.8406 175.1785 108 L 4.3573 8.4272 128.7561 54.3983 41.7605 176.7295 109 K 3.9252 9.0520 126.7013 59.2176 32.3272 176.9138 110 S 4.7194 7.7586 112.7758 55.9658 65.8614 173.5472 111 A 4.3114 8.4285 125.5550 51.7888 18.6137 177.4757 112 A 4.1792 9.1119 125.2616 52.0110 19.5302 178.2568 113 S 4.4822 8.2035 115.1358 56.9276 62.4103 174.3103 114 L 4.4109 8.4706 126.8792 54.7079 41.0812 177.5143 115 N 4.1446 8.1169 115.4574 53.5822 42.3098 175.1279 116 S 4.2734 8.5818 111.5019 61.4215 62.7747 174.7397 117 R 4.0800 6.9291 119.7038 56.8740 30.6492 175.9554 118 V 4.2317 8.8416 116.9408 61.7928 32.8126 175.2068 119 A 5.1818 8.2076 126.9196 50.1655 22.8831 175.0984 120 S 4.9643 8.7324 114.0606 57.9687 64.6257 173.2780 121 I 4.3468 8.2040 121.6185 59.6611 39.3029 175.3431 122 S 4.5599 7.8978 123.1695 57.8913 64.2654 174.0070 123 L 4.2304 8.3107 122.8149 53.4487 42.4468 175.2322 124 P 4.6060 0.0000 0.0000 62.7529 32.4803 175.9067 125 T 4.3186 8.1554 107.0919 62.0992 70.7777 174.3176 *127 S 4.7120 7.6707 115.8128 58.1292 63.9916 174.2267 128 C 4.3330 8.5384 121.0007 56.6270 40.6264 173.5112 129 A 4.1365 8.1391 126.6060 51.9045 18.8681 177.8214 130 S 4.0339 8.3508 119.0499 58.1899 63.7684 173.3784 *132 A 4.2273 8.2929 125.8949 53.4344 19.3093 176.7177 133 G 4.0745 9.0117 110.2774 45.5614 0.0000 174.6092 134 T 3.9695 7.6929 117.3691 63.6876 69.4727 173.3702 135 Q 4.6014 8.5809 127.4625 55.7163 30.2252 175.1830 136 C 5.2691 9.5697 122.9470 55.0532 46.2938 172.2956 137 L 5.1703 9.1589 121.9048 53.6236 44.1458 175.0355 138 I 5.0880 9.1090 127.6063 59.1517 39.6875 174.9318 139 S 4.9124 8.1317 118.6662 56.8354 66.2972 173.1922 140 G 3.7652 7.2963 107.5429 46.5716 0.0000 173.2278 141 W 4.6321 8.7443 117.0924 56.1475 29.5000 176.4273 142 G 4.0980 8.5761 109.2785 44.7810 0.0000 173.0428 143 N 3.9138 8.5849 118.2119 54.2363 39.4047 174.2824 144 T 4.5910 8.1329 112.5181 62.0395 70.3820 175.3459 145 K 4.4827 7.8417 121.0135 55.6988 32.9248 177.0705 146 S 4.1556 8.8412 118.6313 60.8943 63.2649 174.5308 147 S 4.4971 8.0033 118.7266 58.9054 63.9373 174.0962 148 G 4.0059 8.8699 112.3905 45.0474 0.0000 171.9980 149 T 4.3907 8.1029 109.9215 59.8458 70.1988 175.0960 150 S 4.3615 9.2033 121.3034 56.5361 62.8306 170.3430 151 Y 4.4464 8.2332 121.4047 55.7145 37.8499 174.1036 152 P 4.5439 0.0000 0.0000 62.9669 32.3343 176.1755 153 D 4.5739 8.7957 119.4136 56.4579 41.5005 177.1010 154 V 5.3529 7.4479 110.1355 58.8105 33.9504 175.9327 155 L 3.1907 8.4462 124.8521 54.9641 43.1721 175.6958 156 K 4.7649 8.2828 125.4065 54.9019 34.8558 174.7043 157 C 5.1779 8.6368 120.7171 55.1691 41.6197 173.0470 158 L 4.8924 8.4047 122.4679 54.0592 45.3469 174.5787 159 K 4.9851 9.0460 126.1113 56.0253 33.1994 176.1024 160 A 4.6400 9.1827 124.6992 50.9954 23.1617 173.8364 161 P 5.0180 0.0000 0.0000 61.6518 34.5411 174.7033 162 I 4.3063 8.2016 121.6127 60.4462 37.8550 176.2758 163 L 4.6636 8.7298 128.4316 53.8355 42.8952 177.2442 164 S 4.2684 8.5395 115.3301 57.9642 63.8947 174.6900 165 D 4.3902 9.0253 123.6096 57.7573 40.5781 179.0663 166 S 4.1083 8.0216 114.1073 61.7703 63.2285 176.5855 167 S 4.6280 7.6931 120.5761 60.2117 62.5235 175.9319 168 C 4.3147 8.5423 121.6499 59.7837 40.6875 175.7196 169 K 3.9586 8.6498 120.7022 59.4380 31.6216 179.6004 170 S 4.1304 8.5288 114.8121 61.3518 62.7570 176.4396 171 A 3.8873 7.8300 123.4851 53.5077 19.1493 177.3738 172 Y 4.6282 7.7556 115.9868 54.2008 38.3027 170.8511 173 P 4.4224 0.0000 0.0000 63.1011 31.4872 178.6293 174 G 4.1571 9.0933 115.4088 46.7236 0.0000 174.1830 175 Q 4.0705 8.7453 118.2850 58.8388 28.8372 176.9107 176 I 3.8899 7.5522 118.6658 61.7264 36.9073 176.0050 177 T 4.4591 8.3375 117.0254 60.1532 70.4624 175.4467 178 S 4.3733 8.5451 114.6665 60.2200 63.4117 174.3624 179 N 4.9468 8.0847 118.9029 53.2679 38.5514 173.6571 180 M 5.5766 7.7737 117.3588 53.8671 36.1728 174.8795 181 F 5.0257 8.5614 113.4665 56.3009 41.7405 172.5061 182 C 5.3739 9.0826 118.6751 56.1093 40.6913 172.4088 183 A 5.0012 9.5727 123.1283 50.9235 22.3876 174.5023 184A G 3.7587 7.0657 106.4859 44.4288 0.0000 173.6324 184 Y 4.8164 8.2914 120.2239 55.9478 41.3703 176.2743 185 L 4.0555 8.8085 125.0971 57.7093 42.1828 179.2296 186 E 3.7977 8.3035 118.7865 58.2618 29.7310 176.0729 187 G 3.7924 7.8619 102.7408 44.5758 0.0000 172.5423 188A G 4.0827 9.7515 105.9611 44.7490 0.0000 173.5349 188 K 5.1650 7.4533 117.5311 55.1299 35.6204 175.2831 189 D 4.6099 8.8644 122.9863 53.4740 45.5476 175.3793 190 S 4.6015 8.2439 116.6812 58.7541 64.5283 171.8412 191 C 4.7454 9.5808 119.0903 55.1062 47.4030 172.5654 192 Q 4.2815 8.7158 120.4594 58.1013 28.3196 178.3104 193 G 4.2578 9.2003 110.4813 45.8191 0.0000 173.6949 194 D 4.7724 8.8295 118.9824 54.2734 41.8566 176.7521 195 S 4.4911 7.9341 116.1743 60.2184 63.4842 175.8074 196 G 4.2934 8.4856 110.7147 46.3914 0.0000 173.9882 197 G 4.2240 7.8844 107.4715 45.7605 0.0000 171.0567 198 P 5.0225 0.0000 0.0000 61.9926 33.7672 175.4916 199 V 4.6096 8.3983 120.5655 61.3526 33.9141 173.6719 200 V 5.2515 8.5975 128.3504 60.7240 33.7579 173.7956 201 C 5.0314 8.2565 124.1749 55.2806 43.5981 174.4162 202 S 3.6938 9.6062 121.6757 59.7165 59.6099 173.6841 203 G 3.9112 8.1559 106.8626 45.5356 0.0000 173.5829 204 K 4.8440 7.3939 118.2318 53.6246 34.3408 175.5541 *209 L 4.3037 8.1029 121.9668 55.3687 42.0109 175.9693 210 Q 4.3435 9.0963 126.7359 57.9098 30.4610 176.0298 211 G 5.2134 7.9659 103.9329 46.2453 0.0000 171.7048 212 I 5.1747 8.2400 119.7402 58.8210 40.8761 175.2613 213 V 3.1460 8.4346 126.5494 64.6342 31.7449 174.0457 214 S 4.9361 8.1795 122.3518 58.1507 64.4372 175.1805 215 W 5.1665 7.2471 114.4075 55.0018 32.7624 173.6628 216 G 3.9104 8.3084 106.7854 46.6807 0.0000 172.3109 217 S 4.7463 8.8047 116.4869 57.2054 64.1582 174.2865 *219 G 4.0590 8.2192 115.3496 45.3465 0.0000 172.8975 220 C 4.8533 8.3251 119.0308 56.5885 45.5557 173.8508 221A A 3.9015 9.3218 125.2106 52.9319 16.9185 176.9013 221 Q 4.4154 7.5502 116.3757 56.2166 29.3547 176.0662 222 K 4.3045 8.5403 123.0929 58.0587 32.6846 175.9435 223 N 4.2777 9.3779 121.3314 54.0105 36.8315 175.3640 224 K 4.3334 7.6209 117.3272 53.9002 32.6493 174.2514 225 P 4.6122 0.0000 0.0000 61.6455 32.9575 176.1524 226 G 3.6378 8.3444 107.9434 45.7912 0.0000 172.7502 227 V 4.3441 7.8331 124.5014 61.2137 33.4576 174.2811 228 Y 4.6600 8.3758 124.0336 56.0513 42.4544 174.6767 229 T 4.5431 8.5711 119.1027 63.2649 70.0106 175.1794 230 K 4.7217 9.0986 128.1157 55.7517 29.9969 177.1084 231 V 3.9222 8.8423 124.7293 65.7677 31.3568 174.7116 232 C 4.3701 8.3603 113.6082 58.6476 41.2509 175.4644 233 N 4.1480 8.2028 117.6908 55.1097 38.2923 175.8459 234 Y 4.7439 7.7161 116.5924 57.5818 38.4616 177.2448 235 V 3.6702 7.5387 119.9420 66.4236 31.4398 178.0257 236 S 4.1052 8.0925 113.8867 61.3396 62.7349 176.0089 237 W 4.3025 8.4198 130.4288 60.9128 30.4200 177.2839 238 I 3.1793 8.4917 119.6864 64.5486 36.4907 178.1291 239 K 3.6717 8.2904 119.0011 59.6668 31.8742 179.2057 240 Q 3.7854 8.2345 119.7081 59.4950 29.1637 178.0616 241 T 3.5424 7.4549 116.9961 66.6115 68.0998 176.5051 242 I 2.6191 6.7270 119.9400 64.0521 37.1750 178.2927 243 A 4.0747 7.3984 119.3418 54.3524 18.2074 178.7889 244 S 4.5472 7.6207 111.5714 58.7088 63.8792 174.0251 245 N 4.6972 7.9403 123.1145 53.2954 38.7094 174.3061 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 4.17 1.81 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 1.38 1.14 0.89 0.00 0.00 17 V 8.12 4.19 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 1.04 0.00 0.00 0.97 0.00 0.00 18 G 8.44 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 19 G 7.58 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 20 Y 8.26 5.11 0.00 3.03 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 21 T 8.62 4.18 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 22 C 8.97 4.25 0.00 2.81 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.07 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 24 A 8.95 3.47 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.64 4.40 0.00 2.61 2.68 0.00 0.00 6.64 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 26 T 8.37 4.58 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 1.23 0.00 0.00 27 V 7.04 3.96 1.70 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 0.49 0.00 0.00 0.73 0.00 0.00 28 P 0.00 4.26 0.00 2.25 2.31 0.00 3.47 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 2.15 2.04 0.00 29 Y 7.00 5.04 0.00 3.24 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.08 4.47 0.00 1.73 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.71 0.00 0.00 0.00 0.00 0.00 1.85 2.36 0.00 31 V 8.71 4.81 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 0.92 0.00 0.00 1.02 0.00 0.00 32 S 9.21 5.08 0.00 3.40 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.37 4.58 0.00 0.67 1.01 0.74 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.33 5.87 0.00 2.57 2.70 0.00 0.00 6.77 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 *37 S 8.15 4.15 0.00 3.61 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 10.45 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 0.00 0.00 0.00 0.00 39 Y 6.66 4.81 0.00 3.08 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 40 H 8.78 4.71 0.00 2.97 3.22 0.00 5.87 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.86 5.09 0.00 3.09 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 42 C 6.62 4.68 0.00 2.02 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 8.55 4.60 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 44 G 7.65 4.60 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 45 S 8.25 5.24 0.00 3.92 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 46 L 8.88 4.70 0.00 1.79 1.67 1.09 1.38 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 47 I 8.34 4.01 1.95 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.72 0.90 0.00 0.00 48 N 8.44 4.36 0.00 2.93 2.95 0.00 0.00 6.08 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 6.97 3.77 0.00 4.09 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.12 4.31 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.86 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 51 W 8.76 5.40 0.00 3.34 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 52 V 9.41 5.01 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 1.04 0.00 0.00 0.97 0.00 0.00 53 V 8.85 4.81 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 0.72 0.00 0.00 1.06 0.00 0.00 54 S 8.89 4.96 0.00 3.87 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 55 A 8.41 4.26 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 56 A 8.56 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.05 4.51 0.00 3.36 3.41 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 8.31 4.70 0.00 3.10 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 59 Y 7.43 4.24 0.00 2.95 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.01 4.38 0.00 1.45 1.28 0.00 0.61 0.00 0.00 0.94 0.00 0.00 2.19 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.04 1.08 7.81 61 S 8.32 4.00 0.00 3.93 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 62 G 8.32 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 0.00 0.00 0.00 63 I 7.11 4.31 1.83 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.63 0.97 0.00 0.00 64 Q 8.99 4.72 0.00 1.94 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.89 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 65 V 8.84 4.37 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 0.90 0.00 0.00 0.88 0.00 0.00 66 R 8.77 5.25 0.00 1.35 1.53 0.00 2.65 0.00 0.00 2.80 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.81 0.00 67 L 8.18 4.46 0.00 1.63 1.63 0.97 1.07 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 8.24 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 70 E 7.72 4.34 0.00 2.48 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 2.41 2.02 0.00 71 D 8.40 4.87 0.00 2.69 2.59 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 72 N 7.96 5.47 0.00 2.76 2.71 0.00 0.00 6.95 7.94 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 73 I 7.94 4.15 1.36 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.08 -0.60 0.00 0.00 74 N 7.95 4.98 0.00 2.94 2.83 0.00 0.00 6.96 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 75 V 7.88 4.42 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 0.77 0.00 0.00 0.99 0.00 0.00 76 V 7.92 4.71 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 0.89 0.00 0.00 0.96 0.00 0.00 77 E 8.19 4.21 0.00 2.04 1.94 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 2.52 2.50 0.00 78 G 7.37 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 0.00 0.00 0.00 79 N 8.00 4.46 0.00 3.00 2.82 0.00 0.00 6.54 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 8.68 4.51 0.00 2.06 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 2.45 2.95 0.00 81 Q 8.46 4.44 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.69 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 82 F 9.20 4.96 0.00 2.76 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 83 I 8.77 4.62 1.85 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 1.24 0.77 0.88 0.00 0.00 84 S 8.64 4.68 0.00 3.75 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 85 A 7.89 4.44 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 86 S 9.39 4.10 0.00 3.71 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 87 K 7.61 4.57 0.00 1.62 1.71 0.00 1.45 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.49 7.81 88 S 8.83 4.97 0.00 3.89 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 89 I 9.01 4.36 2.12 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.75 1.13 0.00 0.00 90 V 8.40 4.26 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 0.70 0.00 0.00 0.85 0.00 0.00 91 H 8.72 3.90 0.00 2.77 3.02 0.00 5.65 0.00 0.00 0.00 0.00 6.70 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 4.47 0.00 2.18 2.18 0.00 2.79 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 1.56 1.93 0.00 93 S 7.76 4.59 0.00 3.90 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 94 Y 8.29 4.28 0.00 3.11 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 95 N 8.32 4.58 0.00 2.58 2.46 0.00 0.00 6.59 6.93 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 96 S 7.75 4.61 0.00 3.95 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 97 N 7.75 4.41 0.00 2.82 2.75 0.00 0.00 6.95 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 98 T 8.34 3.70 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 99 L 7.95 3.80 0.00 1.34 1.82 0.53 1.11 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 0.00 100 N 7.85 4.67 0.00 2.83 2.64 0.00 0.00 7.27 6.43 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 0.00 101 N 8.72 5.01 0.00 2.95 2.65 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 8.01 4.66 0.00 2.95 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.22 4.67 1.22 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.04 0.11 0.00 0.00 104 M 9.75 5.51 0.00 2.10 1.84 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.66 0.00 105 L 9.56 5.40 0.00 1.67 1.80 0.05 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.46 4.88 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.93 0.86 0.00 0.00 107 K 8.64 3.92 0.00 0.79 1.04 0.00 1.01 0.00 0.00 1.26 0.00 0.00 2.70 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.77 0.21 7.81 108 L 8.43 4.36 0.00 1.46 1.60 0.97 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 109 K 9.05 3.93 0.00 1.71 1.89 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.42 7.81 110 S 7.76 4.72 0.00 3.83 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 0.00 111 A 8.43 4.31 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 0.00 112 A 9.11 4.18 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 0.00 113 S 8.20 4.48 0.00 4.04 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 0.00 114 L 8.47 4.41 0.00 1.68 1.67 0.96 1.17 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 0.00 115 N 8.12 4.14 0.00 2.92 3.02 0.00 0.00 6.98 8.30 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 0.00 116 S 8.58 4.27 0.00 4.01 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 6.93 4.08 0.00 2.01 1.98 0.00 3.32 0.00 0.00 3.16 7.72 0.00 0.00 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0.00 1.20 0.00 0.00 *127 S 7.67 4.71 0.00 3.88 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 0.00 128 C 8.54 4.33 0.00 2.90 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 0.00 129 A 8.14 4.14 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.35 4.03 0.00 3.85 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 *132 A 8.29 4.23 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.01 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 7.69 3.97 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 135 Q 8.58 4.60 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 136 C 9.57 5.27 0.00 2.75 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 0.00 137 L 9.16 5.17 0.00 1.73 1.54 1.03 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.11 5.09 1.86 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.59 0.99 0.00 0.00 139 S 8.13 4.91 0.00 3.57 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.30 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 0.00 0.00 0.00 141 W 8.74 4.63 0.00 3.19 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 0.00 142 G 8.58 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.58 3.91 0.00 1.98 2.58 0.00 0.00 7.12 8.31 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 0.00 144 T 8.13 4.59 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 145 K 7.84 4.48 0.00 1.85 1.90 0.00 1.72 0.00 0.00 1.87 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.39 7.81 146 S 8.84 4.16 0.00 3.99 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 0.00 147 S 8.00 4.50 0.00 3.84 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 0.00 148 G 8.87 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 8.10 4.39 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 1.26 0.00 0.00 150 S 9.20 4.36 0.00 3.72 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.23 4.45 0.00 3.06 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 P 0.00 4.54 0.00 2.47 2.11 0.00 4.08 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.10 0.00 153 D 8.80 4.57 0.00 2.83 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.45 5.35 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 1.10 0.00 0.00 0.98 0.00 0.00 155 L 8.45 3.19 0.00 1.20 1.23 -0.61 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.28 4.76 0.00 1.67 1.51 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.49 7.81 157 C 8.64 5.18 0.00 1.23 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.40 4.89 0.00 1.74 1.46 1.19 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.05 4.99 0.00 1.82 1.81 0.00 1.92 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.65 1.45 7.81 160 A 9.18 4.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.02 0.00 2.08 2.18 0.00 3.18 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 1.96 1.98 0.00 162 I 8.20 4.31 1.73 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.47 0.68 0.00 0.00 163 L 8.73 4.66 0.00 1.55 1.63 0.95 0.78 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 0.00 164 S 8.54 4.27 0.00 4.01 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 0.00 165 D 9.03 4.39 0.00 2.83 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 0.00 166 S 8.02 4.11 0.00 4.10 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 7.69 4.63 0.00 4.05 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.54 4.31 0.00 3.13 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.65 3.96 0.00 1.92 1.91 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.30 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.62 7.81 170 S 8.53 4.13 0.00 4.02 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 0.00 171 A 7.83 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.76 4.63 0.00 3.19 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.42 0.00 2.26 2.29 0.00 4.14 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.01 0.00 174 G 9.09 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 0.00 175 Q 8.75 4.07 0.00 2.48 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.92 0.00 0.00 0.00 0.00 0.00 2.44 2.66 0.00 176 I 7.55 3.89 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.90 1.00 0.00 0.00 177 T 8.34 4.46 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 0.00 178 S 8.55 4.37 0.00 4.00 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 0.00 179 N 8.08 4.95 0.00 3.00 3.10 0.00 0.00 6.63 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.77 5.58 0.00 1.89 2.02 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 2.66 2.60 0.00 181 F 8.56 5.03 0.00 3.01 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 0.00 182 C 9.08 5.37 0.00 2.99 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 0.00 183 A 9.57 5.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A G 7.07 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Y 8.29 4.82 0.00 3.11 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 0.00 185 L 8.81 4.06 0.00 1.75 1.75 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.30 3.80 0.00 1.95 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 0.00 2.30 2.31 0.00 187 G 7.86 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 188A G 9.75 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 0.00 188 K 7.45 5.16 0.00 2.12 1.96 0.00 1.41 0.00 0.00 1.74 0.00 0.00 2.69 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.55 1.44 7.81 189 D 8.86 4.61 0.00 2.77 2.55 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 0.00 0.00 0.00 0.00 190 S 8.24 4.60 0.00 3.95 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 0.00 191 C 9.58 4.75 0.00 2.94 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 0.00 192 Q 8.72 4.28 0.00 2.35 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.66 0.00 0.00 0.00 0.00 0.00 2.57 2.57 0.00 193 G 9.20 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 0.00 0.00 0.00 0.00 194 D 8.83 4.77 0.00 2.91 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 7.93 4.49 0.00 3.93 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.49 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 0.00 197 G 7.88 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 0.00 0.00 0.00 198 P 0.00 5.02 0.00 2.29 2.34 0.00 3.85 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 2.19 2.21 0.00 199 V 8.40 4.61 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 0.98 0.00 0.00 0.61 0.00 0.00 200 V 8.60 5.25 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 0.93 0.00 0.00 0.62 0.00 0.00 201 C 8.26 5.03 0.00 2.79 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.61 3.69 0.00 3.97 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 8.16 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.39 4.84 0.00 1.87 1.67 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.41 7.81 *209 L 8.10 4.30 0.00 1.51 1.65 0.90 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 9.10 4.34 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.34 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 211 G 7.97 5.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.24 5.17 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.83 1.00 0.00 0.00 213 V 8.43 3.15 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 0.83 0.00 0.00 1.21 0.00 0.00 214 S 8.18 4.94 0.00 3.92 3.62 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 0.00 215 W 7.25 5.17 0.00 3.37 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 0.00 216 G 8.31 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 0.00 217 S 8.80 4.75 0.00 4.04 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 *219 G 8.22 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.33 4.85 0.00 2.95 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A A 9.32 3.90 1.41 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 0.00 221 Q 7.55 4.42 0.00 2.40 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 222 K 8.54 4.30 0.00 1.79 1.72 0.00 1.94 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.69 7.81 223 N 9.38 4.28 0.00 2.82 2.82 0.00 0.00 6.76 7.49 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 0.00 224 K 7.62 4.33 0.00 1.87 1.81 0.00 1.55 0.00 0.00 1.24 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.53 7.81 225 P 0.00 4.61 0.00 2.02 2.02 0.00 3.92 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.12 0.00 226 G 8.34 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.83 4.34 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 0.21 0.00 0.00 -0.57 0.00 0.00 228 Y 8.38 4.66 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.57 4.54 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 230 K 9.10 4.72 0.00 2.09 1.87 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.66 7.81 231 V 8.84 3.92 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 1.13 0.00 0.00 1.10 0.00 0.00 232 C 8.36 4.37 0.00 3.19 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 0.00 233 N 8.20 4.15 0.00 2.34 2.42 0.00 0.00 6.96 7.23 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 0.00 234 Y 7.72 4.74 0.00 3.13 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 0.00 235 V 7.54 3.67 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 1.13 0.00 0.00 1.12 0.00 0.00 236 S 8.09 4.11 0.00 3.99 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 0.00 237 W 8.42 4.30 0.00 3.52 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.49 3.18 2.04 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.03 0.76 0.00 0.00 239 K 8.29 3.67 0.00 1.87 1.80 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.58 7.81 240 Q 8.23 3.79 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 241 T 7.45 3.54 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 0.78 0.00 0.00 242 I 6.73 2.62 1.54 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 -0.30 -0.36 0.58 0.00 0.00 243 A 7.40 4.07 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 0.00 244 S 7.62 4.55 0.00 3.78 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 0.00 245 N 7.94 4.70 0.00 3.23 2.98 0.00 0.00 6.82 7.02 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 * Residues marked with a * may have inaccurate shift predictions.