NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2421 7.8827 121.4502 61.2165 38.6040 173.7542 17 V 4.3856 8.7208 126.2957 61.8440 32.7102 174.5947 18 G 4.2672 8.5877 114.2555 46.7914 0.0000 173.5736 19 G 4.2146 7.6737 110.0590 44.7375 0.0000 172.6972 20 Y 4.9498 7.9198 118.1884 55.4036 41.4009 175.1012 21 T 4.1700 8.6306 117.3855 64.3304 68.8966 175.7487 22 C 4.2188 8.6260 125.4185 59.0215 35.6779 175.6732 23 G 3.9459 7.8593 102.8094 45.1712 0.0000 172.7085 24 A 4.2927 8.4519 125.8583 53.7577 18.6502 176.8166 25 N 4.2760 8.9199 119.0148 54.4653 36.1637 175.5314 26 T 4.1062 7.7193 108.4281 63.1352 69.8687 174.9561 27 V 4.0667 7.0916 121.9660 60.4632 31.2258 173.7845 28 P 4.4948 0.0000 0.0000 64.2616 32.1012 178.0665 29 Y 5.2072 6.7889 116.0906 56.7859 38.8518 174.6371 30 Q 4.5475 7.5489 123.7199 56.3232 29.3882 175.5309 31 V 4.8230 9.0449 119.4813 59.6625 35.8495 174.2395 32 S 4.7929 8.7033 117.3219 56.6069 64.6183 172.7195 33 L 4.5969 8.5194 127.7674 53.5041 43.1470 175.0468 34 N 5.7377 9.1388 122.9205 50.0445 41.9477 174.9355 *37 S 4.3468 8.3792 120.2202 58.3057 64.1025 174.6230 38 G 3.9693 9.5602 107.4775 46.0150 0.0000 172.6694 39 Y 4.5215 6.6611 115.0960 56.2626 39.8466 172.4841 40 H 4.5563 8.9443 121.8921 56.2142 30.3312 174.7758 41 F 5.0086 7.9670 120.2210 56.7767 39.5823 173.9170 42 C 4.6805 6.8556 114.9972 56.2364 44.6967 173.3882 43 G 4.2226 8.7931 109.6349 45.7219 0.0000 172.3112 44 G 4.3249 8.1562 105.6226 45.8164 0.0000 172.5787 45 S 5.3941 8.8990 115.6159 56.3037 66.5522 173.7796 46 L 4.7299 9.2437 128.2706 55.0962 42.4230 177.1431 47 I 4.5521 8.6990 119.0243 60.7437 38.7699 174.2667 48 N 4.8066 7.6192 117.5139 52.1544 39.5525 174.9002 49 S 4.3091 8.7174 111.6939 60.6836 63.3093 174.9316 50 Q 4.6707 9.1675 118.9693 55.1984 30.7575 174.9463 51 W 5.6120 8.4087 118.6431 54.9551 33.8657 174.2078 52 V 4.9441 9.2169 123.6899 61.1604 34.4349 174.1019 53 V 4.8526 8.8010 126.9959 61.7030 33.2142 174.7242 54 S 5.6372 9.1759 121.0394 56.3736 66.6496 171.8968 55 A 4.5310 8.4777 121.9478 51.1193 19.4777 178.5140 56 A 3.8162 8.4082 125.4831 55.2836 18.3886 178.9615 57 H 4.5595 8.1953 109.3258 57.4010 28.8099 175.3513 58 C 4.7132 7.7830 117.2738 57.3146 40.3116 173.2061 59 Y 4.3466 7.9076 122.4909 57.6106 38.8052 174.8974 60 K 3.6150 6.9768 123.5163 55.7634 34.9325 174.9592 61 S 4.0895 7.8938 115.5804 59.4747 63.2612 174.1819 62 G 3.7362 8.5168 108.6798 46.5389 0.0000 173.5177 63 I 4.0643 7.6014 120.5566 60.5948 38.6949 174.6369 64 Q 4.6737 8.7952 128.5614 54.2763 31.1766 174.2696 65 V 4.1870 8.7668 127.6172 62.1562 33.2940 174.7034 66 R 5.0885 8.9130 127.4610 54.7497 32.2134 175.0956 67 L 4.7022 9.1279 125.0171 52.8955 44.4915 177.9543 *69 G 4.1467 8.3203 108.0465 45.2292 0.0000 172.7882 70 E 4.3311 8.1763 118.8190 55.7183 29.9636 174.0835 71 D 4.8776 7.9715 118.3419 55.3107 44.6961 174.5323 72 N 5.0502 8.9918 121.9660 53.0492 39.0383 176.1959 73 I 4.0061 8.3745 120.0240 62.4070 37.8950 176.3628 74 N 4.7990 8.6887 118.1235 52.9358 38.9554 174.7017 75 V 4.2911 7.3958 116.7884 60.7851 34.3704 175.1161 76 V 4.0118 8.4881 126.8926 62.9091 30.6999 174.9505 77 E 4.3467 9.7900 127.7830 55.8672 30.6370 177.7960 78 G 3.8723 7.9792 105.4174 46.9175 0.0000 173.7390 79 N 4.6143 8.8571 117.5581 52.5862 36.6671 174.4131 80 E 4.4518 7.7001 117.2104 56.4912 30.6412 176.3437 81 Q 4.4493 9.1023 121.3875 54.2351 32.5413 174.1668 82 F 5.5556 8.8149 123.1072 56.0992 40.7426 175.4238 83 I 4.6847 8.9216 124.8521 59.3003 41.0737 175.3864 84 S 4.5656 8.7601 122.7048 58.2726 64.1029 173.4976 85 A 4.4513 8.6603 126.4509 52.3241 18.1309 177.6089 86 S 4.5137 9.1044 116.9593 59.3476 64.8737 175.0183 87 K 4.7057 7.6853 118.3576 54.5063 36.4984 175.6703 88 S 5.0299 8.9147 119.5188 57.1253 65.7373 173.9342 89 I 4.4022 9.3354 127.9554 59.4097 38.2620 175.1842 90 V 4.0329 8.1964 127.3225 62.2537 32.5802 175.0783 91 H 3.7737 8.8137 127.1642 56.3244 29.8707 174.2205 92 P 4.2721 0.0000 0.0000 65.5024 31.3649 177.1246 93 S 4.6234 7.9471 111.7363 58.1433 62.6570 173.4059 94 Y 4.3899 8.0868 123.6443 57.8402 39.1334 174.4730 95 N 4.7765 8.3897 125.6287 51.4921 40.3181 175.0871 96 S 3.9068 7.8713 119.3963 59.0851 63.8594 174.8497 97 N 4.4211 8.6694 119.2612 55.5388 38.8026 176.3595 98 T 3.8775 7.8405 105.0753 61.1627 69.6331 174.8603 99 L 3.7744 7.6655 120.3964 55.3664 40.1100 173.9659 100 N 4.3682 7.7790 117.7595 54.9946 39.3669 174.5881 101 N 4.7958 8.7535 120.6512 54.3263 35.8644 175.5433 102 D 4.6760 7.9741 117.2282 53.3063 39.3150 174.5427 103 I 4.7739 7.1013 120.8108 59.2771 42.3724 172.9518 104 M 5.4548 9.0835 127.2578 54.0149 36.1511 173.3309 105 L 5.3295 9.1878 125.4004 53.2395 44.5936 175.2928 106 I 4.9003 9.1572 124.6328 59.4159 40.1729 174.3437 107 K 3.7212 8.3977 128.7946 54.5229 33.5231 175.6105 108 L 4.4395 8.3066 127.9232 54.1560 41.9049 177.1784 109 K 4.0446 8.8339 124.6597 58.9970 32.6091 177.1255 110 S 4.7027 7.7588 112.8032 55.9762 66.7258 173.2500 111 A 4.4136 8.3544 123.9216 51.7452 18.7802 177.5774 112 A 4.2372 8.7187 123.5757 52.0525 19.5716 177.3743 113 S 4.4906 8.9265 115.6927 57.0116 62.8695 174.0513 114 L 4.4944 8.5198 128.2689 54.5582 42.4183 176.1798 115 N 4.8514 8.9093 119.4011 52.1727 39.9098 175.0056 116 S 4.2185 8.7150 111.8357 60.9424 63.0606 174.9427 117 R 4.3257 8.6629 118.6221 56.0637 30.9000 176.3347 118 V 4.4254 7.8358 117.2489 60.9896 33.1177 173.4657 119 A 5.1853 8.7275 128.5909 50.0716 22.8162 175.2587 120 S 4.9897 8.7894 114.8065 58.1231 64.5660 173.0984 121 I 4.4118 8.2501 121.9789 59.1245 39.5541 175.5385 122 S 4.3657 8.4056 124.5185 58.4443 63.9388 173.9514 123 L 4.1996 8.3868 123.5930 53.5223 42.3445 175.3271 124 P 4.4913 0.0000 0.0000 63.0735 32.2545 176.2944 125 T 4.1481 8.2341 108.8517 62.5642 69.9539 174.6781 *127 S 4.8275 7.5631 114.6099 57.8689 64.0391 174.0767 128 C 4.3557 8.4225 117.9513 56.9056 40.5454 173.6928 129 A 4.3890 8.0438 125.1682 51.4834 19.6366 177.0002 130 S 4.5072 7.8429 113.1913 56.3942 65.3473 173.4113 *132 A 4.3410 8.2315 123.4110 53.4750 19.2122 177.4337 133 G 3.9688 9.1946 111.0273 45.3262 0.0000 174.1951 134 T 3.9327 7.6470 117.5686 64.0608 69.3440 173.5500 135 Q 4.6367 8.6087 125.2833 55.6754 30.0222 175.7746 136 C 5.1993 9.2603 119.7104 55.1993 46.2969 172.4462 137 L 5.0937 9.1334 122.8630 53.6940 43.6753 175.0157 138 I 5.2792 9.1361 127.6732 58.8556 39.9427 174.9431 139 S 4.8670 8.5309 119.3750 56.5160 66.5200 173.3242 140 G 3.7429 7.4161 109.1455 46.1816 0.0000 173.0897 141 W 4.4454 8.5312 116.7481 56.2871 29.2096 176.9809 142 G 4.1440 8.4829 109.4308 44.5899 0.0000 173.4199 143 N 3.7724 8.7547 118.5565 54.1421 38.9802 174.6248 144 T 5.1112 8.1437 112.9480 60.5004 69.5786 174.3062 145 K 4.6141 7.7665 121.4872 54.8191 34.7306 176.2559 146 S 4.4231 8.5762 116.3935 59.7865 63.7295 174.9943 147 S 4.4943 7.8240 115.1073 55.5262 63.1420 172.1758 148 G 3.8540 7.6561 110.9823 43.8151 0.0000 170.0564 149 T 4.7054 8.1719 114.7996 60.7712 70.7870 174.8952 150 S 4.4581 9.7198 123.8547 57.6396 65.8087 171.9372 151 Y 5.0312 8.6888 125.5462 55.6459 39.4958 174.2974 152 P 4.7258 0.0000 0.0000 62.2498 33.1700 175.8067 153 D 4.6007 8.7388 118.5829 56.4284 41.3842 177.1454 154 V 5.4887 7.3976 109.7821 58.5039 34.4357 175.8113 155 L 3.1481 8.3923 124.3317 54.9549 43.0386 175.9958 156 K 4.9074 8.1164 124.7261 54.8815 35.3193 174.5357 157 C 5.2574 8.4463 119.2317 55.2193 42.2349 173.0508 158 L 4.9641 8.4646 122.4271 53.8957 45.4815 174.6212 159 K 5.0879 9.0594 125.7884 55.7514 33.3977 176.1275 160 A 4.7529 8.9901 125.9131 50.0511 23.0654 173.6122 161 P 5.0307 0.0000 0.0000 61.8067 33.8825 175.3176 162 I 4.3583 8.3291 122.9411 61.5662 37.9818 175.9606 163 L 4.7861 8.7504 127.6101 53.4544 43.1130 176.9991 164 S 4.3542 8.4542 114.8165 58.1057 64.0697 174.8530 165 D 4.4108 8.9381 122.0055 58.0258 40.5075 179.3269 166 S 4.0962 8.0507 112.6657 61.6065 62.4524 176.2408 167 S 4.1484 8.0551 117.5576 61.4256 62.5204 175.6999 168 C 4.2731 8.4590 121.4605 59.9246 41.0500 176.0200 169 K 3.9900 8.3948 120.0375 59.4641 31.3495 179.6423 170 S 4.1533 8.3931 115.1943 61.3121 62.7522 176.1450 171 A 4.0269 7.8029 122.9420 53.8635 19.8356 177.3966 172 Y 4.9388 7.8616 114.1702 55.6141 38.6091 173.0518 173 P 4.6157 0.0000 0.0000 63.4030 32.3970 177.4139 174 G 4.0055 8.9851 108.4305 46.4399 0.0000 173.8665 175 Q 4.4896 8.1642 116.5634 55.1346 30.6931 175.5804 176 I 4.3835 7.8477 119.2101 59.8680 37.7373 175.6140 177 T 4.4607 8.2678 116.4618 60.0798 70.2467 175.7858 178 S 4.2659 8.5264 115.5194 60.7916 63.1718 174.5564 179 N 4.9869 7.9241 117.4292 53.3220 38.3813 173.8973 180 M 5.5691 7.9380 116.9606 53.6801 36.0639 174.4828 181 F 5.1476 8.9028 115.9462 55.6252 42.3355 172.5789 182 C 5.4191 8.9242 115.8833 55.8215 37.8087 172.7937 183 A 5.0192 9.3842 122.6326 51.1083 22.4069 174.4358 184 G 3.8104 7.3599 106.3296 44.3979 0.0000 174.9114 184A Y 4.6027 8.4301 122.4613 56.4053 40.8884 175.8385 185 L 4.1639 8.6502 126.1977 56.9992 41.9847 178.7671 186 E 4.1216 8.2222 114.9906 56.6751 30.0245 177.5486 187 G 3.9231 7.6610 105.1477 46.0559 0.0000 173.5126 188 G 3.9938 9.5502 106.7610 44.6749 0.0000 173.4389 188A K 4.9439 7.3502 117.5359 55.2214 35.4977 175.0657 189 D 4.6599 8.9135 123.5623 53.7474 45.6704 174.8564 190 S 4.9351 8.1581 114.8248 58.1924 65.1360 171.5808 191 C 4.7666 8.9449 118.2527 55.7009 45.5371 172.3854 192 Q 4.3802 8.5636 119.0577 57.9280 28.6117 177.4771 193 G 4.2674 9.2447 109.7756 45.8457 0.0000 174.1851 194 D 4.6538 8.4801 118.4853 55.4476 41.5905 176.5924 195 S 4.4759 8.0975 115.3852 60.4755 63.5238 175.5857 196 G 4.0854 8.7480 112.4598 46.4162 0.0000 173.7136 197 G 4.4752 7.8613 107.5725 44.8469 0.0000 171.1653 198 P 5.1108 0.0000 0.0000 62.4254 33.3594 175.7020 199 V 4.5072 8.6693 122.2280 61.4359 33.7482 174.0076 200 V 4.8953 8.7329 128.8900 61.2182 34.1923 173.6883 201 C 4.9774 9.0097 124.9135 55.4313 43.7135 174.5009 202 S 3.4244 9.8329 121.0927 59.6908 60.0496 173.5112 203 G 3.9284 8.5597 105.1434 45.4985 0.0000 174.0223 204 K 4.7175 7.5425 117.9731 53.0957 35.1560 175.4852 *209 L 4.3821 8.2312 122.9717 55.4613 41.9135 175.6335 210 Q 4.4637 8.8043 125.5865 56.5887 30.7454 175.8392 211 G 5.2782 8.0724 104.3999 45.4584 0.0000 171.4106 212 I 5.2578 8.1752 120.2184 58.7864 40.8942 175.1657 213 V 3.8521 8.7300 127.3168 64.1921 31.8197 174.1954 214 S 4.8743 8.4849 120.5118 58.5532 64.2608 173.8394 215 W 4.8928 7.3135 113.9979 55.7466 31.9236 172.2363 216 G 3.9730 8.3640 106.8524 46.3843 0.0000 172.7562 217 S 4.6262 8.5696 115.3800 56.9665 62.8291 172.7889 *219 G 4.4727 8.0924 117.7475 45.6741 0.0000 171.2411 220 C 4.8245 8.1088 115.9628 56.2573 44.8476 173.9286 221 A 3.9620 9.3854 126.6226 53.2681 16.6446 176.8789 221A Q 4.6778 7.3076 118.0053 55.8744 30.0141 175.8634 222 K 4.1679 8.4985 122.0240 58.2112 32.6148 176.0089 223 N 4.2607 9.2347 121.2785 54.0307 36.8187 175.3477 224 K 4.2295 7.6072 117.5931 53.6762 32.4976 173.9444 225 P 4.6470 0.0000 0.0000 61.8307 33.2561 176.6348 226 G 3.6681 8.5431 107.1207 45.9267 0.0000 172.8322 227 V 4.4171 7.5079 121.1496 60.6290 34.0961 174.0543 228 Y 4.9841 7.9645 124.4926 55.8724 41.9418 175.0981 229 T 4.2735 8.4881 120.5129 63.8507 69.8879 174.0349 230 K 5.0645 9.3261 128.5600 55.4179 31.4786 177.1427 231 V 3.9599 8.9271 126.6630 65.7227 31.3969 174.9066 232 C 4.5407 8.3188 112.7430 58.1727 41.5299 174.8469 233 N 4.2353 8.1840 117.4402 54.6068 38.5183 175.5586 234 Y 4.7321 8.1235 117.6257 57.4090 38.8094 177.3250 235 V 3.6852 7.8606 121.2545 66.3442 31.5871 178.0579 236 S 4.1200 8.0728 114.3463 61.1349 62.6881 176.1156 237 W 4.1884 8.3289 130.6270 60.5927 30.4056 177.7357 238 I 3.2401 8.5847 119.8630 64.3839 36.5727 178.6321 239 K 3.7768 8.1114 119.2182 59.4935 31.7182 179.5405 240 Q 3.8767 8.3034 118.7571 59.0588 28.3377 179.0403 241 T 3.5674 7.3472 116.1597 66.5045 68.6948 176.6459 242 I 2.7828 7.2494 121.7341 63.9497 36.7194 178.4048 243 A 4.0293 7.7835 120.7613 54.1565 18.2045 178.7186 244 S 4.4666 7.3893 113.1383 59.4923 63.5757 174.7326 *245 N 4.6183 7.8583 125.3072 52.9070 38.1812 178.7740 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 4.24 1.79 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.89 0.86 0.00 0.00 17 V 8.72 4.39 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.94 0.00 0.00 18 G 8.59 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 19 G 7.67 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 0.00 0.00 0.00 20 Y 7.92 4.95 0.00 2.97 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 21 T 8.63 4.17 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 1.24 0.00 0.00 22 C 8.63 4.22 0.00 2.73 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 7.86 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 0.00 0.00 0.00 24 A 8.45 4.29 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.92 4.28 0.00 2.87 2.92 0.00 0.00 7.15 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 7.72 4.11 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 1.22 0.00 0.00 27 V 7.09 4.07 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 0.31 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.49 0.00 2.37 2.41 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.99 0.00 29 Y 6.79 5.21 0.00 3.21 3.40 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 30 Q 7.55 4.55 0.00 1.80 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.73 0.00 0.00 0.00 0.00 0.00 1.97 2.53 0.00 31 V 9.04 4.82 2.22 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 0.79 0.00 0.00 0.98 0.00 0.00 32 S 8.70 4.79 0.00 3.04 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 33 L 8.52 4.60 0.00 0.40 0.90 0.77 0.18 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 34 N 9.14 5.74 0.00 2.38 2.43 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 8.38 4.35 0.00 3.70 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 38 G 9.56 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.66 4.52 0.00 3.04 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 40 H 8.94 4.56 0.00 2.86 3.17 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.97 5.01 0.00 2.97 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 42 C 6.86 4.68 0.00 2.13 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 43 G 8.79 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 44 G 8.16 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.90 5.39 0.00 3.82 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.24 4.73 0.00 1.87 1.68 1.08 1.07 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 8.70 4.55 1.90 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 1.58 0.94 0.95 0.00 0.00 48 N 7.62 4.81 0.00 3.00 3.01 0.00 0.00 6.01 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 8.72 4.31 0.00 4.21 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 9.17 4.67 0.00 2.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 51 W 8.41 5.61 0.00 3.35 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 52 V 9.22 4.94 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 1.07 0.00 0.00 0.98 0.00 0.00 53 V 8.80 4.85 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 1.02 0.00 0.00 1.02 0.00 0.00 54 S 9.18 5.64 0.00 3.91 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 55 A 8.48 4.53 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 56 A 8.41 3.82 0.17 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 57 H 8.20 4.56 0.00 3.41 3.57 0.00 5.56 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.78 4.71 0.00 3.22 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 7.91 4.35 0.00 2.92 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 60 K 6.98 3.61 0.00 1.46 1.33 0.00 0.61 0.00 0.00 1.14 0.00 0.00 2.19 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.72 0.97 7.81 61 S 7.89 4.09 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 62 G 8.52 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 0.00 0.00 0.00 63 I 7.60 4.06 1.87 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.65 0.94 0.00 0.00 64 Q 8.80 4.67 0.00 2.02 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.93 0.00 0.00 0.00 0.00 0.00 2.11 2.22 0.00 65 V 8.77 4.19 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 0.94 0.00 0.00 0.89 0.00 0.00 66 R 8.91 5.09 0.00 1.60 1.86 0.00 2.64 0.00 0.00 2.50 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.16 0.00 67 L 9.13 4.70 0.00 1.65 1.64 1.05 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.32 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 70 E 8.18 4.33 0.00 2.09 1.88 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 2.36 2.05 0.00 71 D 7.97 4.88 0.00 2.74 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.99 5.05 0.00 2.82 2.85 0.00 0.00 7.18 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 73 I 8.37 4.01 1.42 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.54 -0.44 0.00 0.00 74 N 8.69 4.80 0.00 2.80 2.88 0.00 0.00 6.62 7.26 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 75 V 7.40 4.29 2.11 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.49 4.01 2.07 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 0.82 0.00 0.00 0.96 0.00 0.00 77 E 9.79 4.35 0.00 2.06 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 2.28 2.45 0.00 78 G 7.98 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.86 4.61 0.00 2.92 3.15 0.00 0.00 7.03 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.70 4.45 0.00 1.54 1.66 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 2.45 2.47 0.00 81 Q 9.10 4.45 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 82 F 8.81 5.56 0.00 2.80 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.92 4.68 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.81 0.94 0.00 0.00 84 S 8.76 4.57 0.00 3.75 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 85 A 8.66 4.45 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 9.10 4.51 0.00 3.75 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.69 4.71 0.00 1.59 1.70 0.00 1.62 0.00 0.00 1.88 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.32 7.81 88 S 8.91 5.03 0.00 4.05 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 89 I 9.34 4.40 2.06 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 1.24 0.88 1.07 0.00 0.00 90 V 8.20 4.03 1.95 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 0.67 0.00 0.00 0.75 0.00 0.00 91 H 8.81 3.77 0.00 3.00 3.02 0.00 5.65 0.00 0.00 0.00 0.00 6.67 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 4.27 0.00 2.08 2.15 0.00 3.38 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 2.23 0.00 93 S 7.95 4.62 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 94 Y 8.09 4.39 0.00 3.01 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.39 4.78 0.00 2.58 2.44 0.00 0.00 6.66 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 96 S 7.87 3.91 0.00 3.95 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 97 N 8.67 4.42 0.00 2.70 2.77 0.00 0.00 6.92 7.40 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 98 T 7.84 3.88 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 1.09 0.00 0.00 99 L 7.67 3.77 0.00 1.58 1.88 0.78 0.91 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 0.00 100 N 7.78 4.37 0.00 2.81 2.67 0.00 0.00 7.25 6.75 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 0.00 101 N 8.75 4.80 0.00 2.96 2.68 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 7.97 4.68 0.00 3.07 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.10 4.77 1.39 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.26 0.16 0.00 0.00 104 M 9.08 5.45 0.00 2.14 1.82 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.63 0.00 105 L 9.19 5.33 0.00 1.81 1.90 0.27 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.16 4.90 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 0.91 0.92 0.00 0.00 107 K 8.40 3.72 0.00 0.79 1.01 0.00 1.23 0.00 0.00 1.33 0.00 0.00 2.66 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.68 0.21 7.81 108 L 8.31 4.44 0.00 1.44 1.57 0.90 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 8.83 4.04 0.00 1.81 1.80 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.39 7.81 110 S 7.76 4.70 0.00 3.82 3.67 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 0.00 111 A 8.35 4.41 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 8.72 4.24 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 0.00 113 S 8.93 4.49 0.00 3.88 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 0.00 114 L 8.52 4.49 0.00 1.70 1.61 0.96 1.09 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 0.00 115 N 8.91 4.85 0.00 2.88 2.92 0.00 0.00 6.52 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 0.00 116 S 8.72 4.22 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 8.66 4.33 0.00 1.89 2.02 0.00 3.16 0.00 0.00 3.16 7.32 0.00 0.00 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0.00 1.20 0.00 0.00 *127 S 7.56 4.83 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 8.42 4.36 0.00 2.94 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 0.00 129 A 8.04 4.39 1.04 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 0.00 130 S 7.84 4.51 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 *132 A 8.23 4.34 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 0.00 133 G 9.19 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.65 3.93 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 1.15 0.00 0.00 135 Q 8.61 4.64 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 136 C 9.26 5.20 0.00 2.75 3.02 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 0.00 137 L 9.13 5.09 0.00 1.77 1.59 0.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.14 5.28 1.87 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.73 0.98 0.00 0.00 139 S 8.53 4.87 0.00 3.51 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.42 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 0.00 0.00 0.00 141 W 8.53 4.45 0.00 3.05 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.48 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 0.00 143 N 8.75 3.77 0.00 2.30 2.61 0.00 0.00 7.10 7.33 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 0.00 144 T 8.14 5.11 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 145 K 7.77 4.61 0.00 1.65 1.68 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.29 1.32 7.81 146 S 8.58 4.42 0.00 4.25 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 7.82 4.49 0.00 3.80 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 0.00 148 G 7.66 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 0.00 0.00 0.00 149 T 8.17 4.71 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 150 S 9.72 4.46 0.00 3.82 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 0.00 151 Y 8.69 5.03 0.00 2.93 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 0.00 152 P 0.00 4.73 0.00 2.46 2.10 0.00 4.20 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 2.04 0.00 153 D 8.74 4.60 0.00 2.80 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 0.00 154 V 7.40 5.49 2.28 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 1.12 0.00 0.00 0.96 0.00 0.00 155 L 8.39 3.15 0.00 1.23 1.22 -0.78 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.12 4.91 0.00 1.64 1.49 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.46 7.81 157 C 8.45 5.26 0.00 1.37 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.46 4.96 0.00 1.73 1.47 1.02 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.06 5.09 0.00 1.81 1.82 0.00 1.90 0.00 0.00 1.83 0.00 0.00 2.82 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.65 1.48 7.81 160 A 8.99 4.75 1.20 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 0.00 161 P 0.00 5.03 0.00 2.03 2.30 0.00 3.11 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.75 0.00 162 I 8.33 4.36 1.91 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 1.16 0.76 0.83 0.00 0.00 163 L 8.75 4.79 0.00 1.56 1.60 0.92 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.45 4.35 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 8.94 4.41 0.00 2.72 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 0.00 166 S 8.05 4.10 0.00 3.90 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 0.00 167 S 8.06 4.15 0.00 4.07 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 0.00 168 C 8.46 4.27 0.00 3.16 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 0.00 169 K 8.39 3.99 0.00 1.94 1.89 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.66 7.81 170 S 8.39 4.15 0.00 3.79 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 0.00 171 A 7.80 4.03 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 0.00 172 Y 7.86 4.94 0.00 3.08 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 0.00 173 P 0.00 4.62 0.00 2.22 2.10 0.00 3.58 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.95 0.00 174 G 8.99 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 0.00 0.00 0.00 175 Q 8.16 4.49 0.00 2.51 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.36 6.68 0.00 0.00 0.00 0.00 0.00 2.25 2.56 0.00 176 I 7.85 4.38 1.98 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 1.87 0.95 1.00 0.00 0.00 177 T 8.27 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 1.25 0.00 0.00 178 S 8.53 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 0.00 179 N 7.92 4.99 0.00 3.14 3.13 0.00 0.00 6.57 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 0.00 180 M 7.94 5.57 0.00 1.83 2.00 0.00 0.00 0.00 0.00 0.00 2.24 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 8.90 5.15 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 8.92 5.42 0.00 2.98 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 0.00 183 A 9.38 5.02 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 0.00 184 G 7.36 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 184A Y 8.43 4.60 0.00 3.01 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 0.00 185 L 8.65 4.16 0.00 1.73 1.72 0.91 0.84 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 0.00 186 E 8.22 4.12 0.00 2.10 2.11 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 2.31 2.26 0.00 187 G 7.66 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 0.00 188 G 9.55 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188A K 7.35 4.94 0.00 1.43 1.67 0.00 1.32 0.00 0.00 0.61 0.00 0.00 2.38 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.34 1.24 7.81 189 D 8.91 4.66 0.00 2.78 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.16 4.94 0.00 4.09 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 8.94 4.77 0.00 2.98 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.56 4.38 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.15 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 193 G 9.24 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.48 4.65 0.00 2.96 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 0.00 195 S 8.10 4.48 0.00 3.96 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.75 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 0.00 197 G 7.86 4.48 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 0.00 0.00 0.00 198 P 0.00 5.11 0.00 2.35 2.39 0.00 3.84 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 2.19 2.21 0.00 199 V 8.67 4.51 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.45 0.00 0.00 200 V 8.73 4.90 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 0.83 0.00 0.00 0.61 0.00 0.00 201 C 9.01 4.98 0.00 2.75 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 9.83 3.42 0.00 3.96 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 0.00 203 G 8.56 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.54 4.72 0.00 1.72 1.64 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.40 7.81 *209 L 8.23 4.38 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 1.54 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.80 4.46 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.45 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 211 G 8.07 5.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.18 5.26 1.91 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 1.28 0.78 0.93 0.00 0.00 213 V 8.73 3.85 2.32 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 0.94 0.00 0.00 1.15 0.00 0.00 214 S 8.48 4.87 0.00 3.90 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 0.00 215 W 7.31 4.89 0.00 3.31 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 0.00 216 G 8.36 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 S 8.57 4.63 0.00 4.25 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 *219 G 8.09 4.47 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 0.00 0.00 0.00 220 C 8.11 4.82 0.00 2.95 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 0.00 221 A 9.39 3.96 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 7.31 4.68 0.00 2.32 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.90 0.00 0.00 0.00 0.00 0.00 2.51 2.47 0.00 222 K 8.50 4.17 0.00 1.72 1.72 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.66 7.81 223 N 9.23 4.26 0.00 2.81 2.80 0.00 0.00 6.76 7.50 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 0.00 224 K 7.61 4.23 0.00 1.73 1.80 0.00 1.98 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.27 1.43 7.81 225 P 0.00 4.65 0.00 2.12 2.10 0.00 3.52 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 226 G 8.54 3.67 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 0.00 227 V 7.51 4.42 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 0.30 0.00 0.00 -0.79 0.00 0.00 228 Y 7.96 4.98 0.00 1.43 2.32 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 0.00 229 T 8.49 4.27 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 1.11 0.00 0.00 230 K 9.33 5.06 0.00 2.15 1.95 0.00 1.82 0.00 0.00 1.88 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.63 7.81 231 V 8.93 3.96 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.09 0.00 0.00 232 C 8.32 4.54 0.00 3.17 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 0.00 233 N 8.18 4.24 0.00 2.45 2.43 0.00 0.00 6.81 7.30 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 0.00 234 Y 8.12 4.73 0.00 3.19 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 0.00 235 V 7.86 3.69 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 1.16 0.00 0.00 1.06 0.00 0.00 236 S 8.07 4.12 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 8.33 4.19 0.00 3.50 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 0.00 238 I 8.58 3.24 2.08 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.10 0.78 0.00 0.00 239 K 8.11 3.78 0.00 1.72 1.76 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.66 7.81 240 Q 8.30 3.88 0.00 1.98 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 241 T 7.35 3.57 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 0.77 0.00 0.00 242 I 7.25 2.78 1.35 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.24 0.00 0.00 243 A 7.78 4.03 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 0.00 244 S 7.39 4.47 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 *245 N 7.86 4.62 0.00 2.87 3.02 0.00 0.00 6.77 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 * Residues marked with a * may have inaccurate shift predictions.