NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5294 8.1633 120.2653 55.3961 34.2275 173.4211 2 N 5.1686 8.4981 116.0232 50.8691 42.4068 171.9932 3 S 4.6341 9.1303 116.6827 56.5329 67.0645 172.3679 4 V 5.3960 7.9591 112.9092 58.9487 35.4224 175.2704 5 T 4.8871 8.6144 118.3758 61.9894 73.4422 172.5504 6 V 4.9960 8.4107 122.1600 61.2482 33.5270 175.0535 7 S 4.7847 9.0416 125.7914 58.4331 63.9529 176.0974 8 H 4.7701 9.0907 115.4228 53.6526 28.0143 172.0245 9 A 2.5888 8.0052 127.5536 52.9584 15.5025 175.4797 10 P 4.4562 0.0000 0.0000 63.2025 32.0199 176.0605 11 Y 4.5720 8.2670 120.4217 58.3583 36.2868 169.0398 12 T 5.1916 7.6131 112.7941 61.7224 72.7515 173.9396 13 I 4.5182 8.6001 125.0825 59.9137 40.4597 174.5926 14 T 4.9465 8.6782 124.8381 62.7752 69.4456 174.1315 15 Y 5.1467 8.5617 124.1762 55.1266 42.0269 174.4173 16 H 4.7743 9.5935 121.9157 56.2524 31.1531 175.9242 17 N 4.6650 8.4067 121.7962 56.2954 38.5375 176.9488 18 D 4.4784 8.5466 119.0032 56.6444 40.7668 177.2579 19 W 4.6891 8.4132 118.1012 56.5913 29.2517 177.6392 20 E 3.9618 8.2294 121.4651 58.7980 28.8700 177.0077 21 P 4.7562 0.0000 0.0000 62.6643 31.1753 177.1309 22 V 4.4028 8.2315 118.3824 62.5709 34.4981 177.2871 23 M 3.8799 7.6374 119.6738 58.0634 31.3390 178.3159 24 S 4.0176 7.9285 112.7873 61.7784 62.6026 176.3323 25 Q 3.6809 7.8683 119.7325 58.2558 28.4151 178.3517 26 L 4.0743 7.7504 121.9283 57.9806 42.0667 178.9712 27 V 3.5915 7.7505 118.2020 66.0733 31.3596 177.5897 28 E 3.9276 7.7816 118.7356 59.3733 29.2588 178.7784 29 F 4.7296 7.8141 116.6249 60.9085 39.3657 176.7921 30 Y 4.3025 8.8200 119.6159 60.6636 38.4064 177.2582 31 N 4.3427 8.4185 117.1766 56.3060 38.8400 176.5300 32 E 4.3425 7.7112 114.6557 57.4365 30.1978 177.3322 33 V 4.2056 7.6034 116.9146 60.4249 33.2299 177.5296 34 A 3.4953 7.8241 123.3734 54.8468 18.0350 179.3709 35 S 3.8052 8.0016 112.3042 61.5847 62.8306 176.4315 36 W 4.1138 8.1951 121.7826 59.0066 29.1050 177.8319 37 L 3.1562 7.2080 120.0372 57.4596 41.3326 178.1667 38 L 4.3055 7.7995 116.0472 55.6270 41.7053 178.7744 39 R 3.9747 7.3310 117.8418 57.9912 30.3698 176.6834 40 D 4.8535 6.8833 116.1220 52.6102 42.5018 176.0930 41 E 4.2864 8.6863 121.8653 57.0414 30.3718 176.1556 42 T 5.2803 8.6501 113.6351 59.9338 72.5363 173.0752 43 S 4.8153 8.8433 117.8667 56.1692 64.6540 172.5267 44 P 5.0415 0.0000 0.0000 61.7651 33.4960 175.6657 45 I 3.8094 8.0902 117.9877 61.0372 37.9768 175.1892 46 P 2.0000 0.0000 0.0000 65.2982 30.8709 178.4476 47 D 4.5382 7.8424 114.9353 55.9553 40.7010 177.4142 48 K 4.5163 7.8754 117.9441 55.4139 33.3651 177.6124 49 F 4.2329 7.2926 118.4538 60.1926 39.0890 176.4604 50 F 4.8275 7.7669 114.0609 57.1044 39.6382 177.3851 51 I 3.9203 7.5622 117.3052 63.5128 37.2764 177.4616 52 Q 4.2376 7.9713 120.7092 58.0511 29.0030 176.5562 53 L 3.4099 7.6560 118.7650 55.5114 41.4195 178.0914 54 K 4.3797 7.7692 118.1150 56.6749 32.6930 176.8673 55 Q 4.4275 7.5611 119.1206 54.2522 29.5326 174.2715 56 P 4.2811 0.0000 0.0000 62.8349 32.2205 175.9557 57 L 4.3378 8.6879 119.1720 55.4555 43.3619 179.3715 58 R 3.9569 8.0324 116.8190 58.4945 29.8185 176.8477 59 N 4.6750 8.0127 113.5214 52.4895 37.9090 174.1881 60 K 4.6869 7.4953 118.7029 55.3099 33.8059 176.2260 61 R 4.6762 8.7247 116.3984 55.5397 31.7950 174.6684 62 V 4.8610 7.5598 120.2010 61.8646 35.1911 172.7146 63 C 5.2090 9.1605 128.5400 57.7390 34.1168 172.3535 64 V 4.9625 8.9266 125.9873 61.5114 33.4794 173.5219 65 C 5.5697 9.6082 129.5216 57.7205 34.1057 173.1681 66 G 4.4717 9.4600 113.3778 44.5025 0.0000 174.1957 67 I 3.4606 8.4060 120.8478 63.7183 39.1128 174.8262 68 D 5.0015 7.2163 118.0906 52.5154 41.8489 173.5752 69 P 4.1477 0.0000 0.0000 62.0872 32.1890 176.3006 70 Y 4.2957 8.1007 119.0414 58.1941 37.8199 175.2534 71 P 4.3779 0.0000 0.0000 65.1158 31.4635 176.2223 72 K 4.8051 7.3702 115.4348 55.5821 35.5885 174.9906 73 D 4.5241 8.9746 119.0633 55.2346 37.8782 174.7059 74 G 3.8046 8.1006 108.2529 46.1763 0.0000 174.6027 75 T 4.2977 8.6836 112.2262 61.1263 69.8934 175.1667 76 G 3.8556 8.3623 110.3811 45.0796 0.0000 173.4354 77 V 4.1828 7.3589 119.6123 60.4675 31.5927 173.3614 78 P 4.1413 0.0000 0.0000 64.4687 31.4717 177.1296 79 F 3.8972 8.3182 119.9133 57.5727 37.3607 174.6908 80 E 4.2235 8.1920 122.3562 56.1741 29.6372 176.4044 81 S 4.6230 8.5686 120.8004 55.0198 62.8090 171.6293 82 P 4.2217 0.0000 0.0000 64.9606 31.3239 177.0412 83 N 4.6487 8.2002 111.8647 51.7861 38.2720 174.1836 84 F 3.9227 8.5844 120.5764 60.3447 37.9455 174.7642 85 T 4.3276 8.0410 113.9330 62.3555 69.2889 174.8463 86 K 3.9980 7.4378 121.1720 55.6052 33.7601 178.0724 87 K 4.0496 8.4607 122.7015 59.2505 32.0724 180.0630 88 S 4.2006 8.1164 115.3646 61.7841 63.0522 176.3543 89 I 4.0464 7.7207 119.8152 63.7881 37.5640 178.0408 90 K 4.0181 7.6294 118.6352 59.2855 31.3050 179.0768 91 E 4.1017 8.0411 118.8758 59.1206 29.3881 179.4077 92 I 3.7237 8.0147 119.8924 64.2344 37.1144 178.0779 93 A 2.9653 7.8774 121.5752 55.2030 18.0791 179.9463 94 S 4.2098 7.9865 113.5409 61.7977 62.6457 177.1048 95 S 4.0260 7.7047 117.2439 61.5708 62.4208 176.8105 96 I 3.5306 7.4394 122.5793 63.9697 36.8516 178.2309 97 S 4.4290 8.1039 115.7547 61.0070 62.0250 176.3687 98 R 4.1277 7.6250 118.5444 58.0719 29.9710 178.5028 99 L 4.0414 7.2896 120.1367 58.0414 42.2984 178.2610 100 T 4.3551 8.1677 107.5887 61.9530 69.5277 175.7626 101 G 3.8804 8.0340 109.5765 44.9396 0.0000 173.5222 102 V 3.5610 7.7384 119.8021 63.2570 31.4106 175.6615 103 I 4.1739 8.3322 121.0374 62.0262 39.0015 175.8197 104 D 4.6333 7.8891 121.1113 53.3338 41.3722 174.8558 105 Y 4.8282 7.6162 120.2887 56.7816 39.8209 173.7745 106 K 4.3780 9.1342 119.2353 57.4321 34.5750 176.2950 107 G 3.4563 7.6130 105.0268 45.4294 0.0000 171.0870 108 Y 5.1582 8.0449 119.7338 56.1763 41.8775 173.5294 109 N 4.9452 8.5557 124.7735 51.9398 41.7753 175.0074 110 L 4.0670 8.8527 126.0505 56.7104 42.1212 177.5652 111 N 4.5377 8.1464 116.3640 55.0529 39.0788 175.3234 112 I 4.3087 7.5686 109.6545 60.5784 38.1598 174.6827 113 I 4.3375 7.2619 122.5882 59.6493 38.1412 174.8656 114 D 4.4378 9.0952 126.7376 56.0467 41.1796 176.9846 115 G 3.8693 9.0502 112.5906 43.7595 0.0000 172.4269 116 V 4.5892 7.1041 119.6690 61.3114 32.8871 174.9137 117 I 4.5848 8.7263 129.3795 58.6210 39.6687 172.5573 118 P 5.2159 0.0000 0.0000 62.4417 32.5223 175.4569 119 W 5.3438 10.0975 132.6534 55.8022 34.6099 173.1294 120 N 5.0718 7.4191 122.7990 51.6169 39.3948 174.0244 121 Y 4.2777 9.2575 126.4123 60.7900 39.2910 175.7052 122 Y 4.3998 7.8894 117.3428 56.5365 39.6624 176.4218 123 L 3.5127 5.8581 121.9415 54.5881 41.9941 175.9877 124 S 4.8420 6.3682 112.0087 57.8086 65.7242 173.3493 125 C 4.7216 8.6847 113.7217 56.1156 33.4103 173.4194 126 K 4.1206 8.3225 119.3862 56.8218 32.8870 176.0143 127 L 4.0571 8.9546 127.1775 57.2926 42.0695 177.2852 128 G 3.9060 9.6100 114.7906 45.4041 0.0000 172.9382 129 E 4.4712 8.2898 119.1859 53.9867 31.0013 174.9544 130 T 3.9345 8.3144 120.2333 64.9341 69.1416 175.1248 131 K 4.0097 10.0812 124.1693 56.7362 30.5790 178.0173 132 S 4.1285 7.7532 114.5720 60.9563 63.1365 175.3678 133 H 4.8727 8.0500 116.2799 55.2725 28.6628 175.8889 134 A 2.5800 7.3028 125.4724 55.0438 17.7850 179.8970 135 I 3.3155 7.2009 114.8524 64.4645 37.9687 177.1107 136 Y 4.2057 7.1214 116.2608 60.0680 38.1257 177.1874 137 W 4.6218 8.0279 117.8704 58.5041 29.6640 177.6984 138 D 4.2956 7.7985 116.5428 57.5900 40.9819 178.7487 139 K 3.8717 7.6731 117.9950 59.3312 32.2947 179.3038 140 I 4.0170 7.6791 119.6162 64.7685 37.0381 178.3731 141 S 3.9806 8.7691 115.9708 61.3356 62.4925 176.5979 142 K 4.1050 7.8512 121.7337 59.5493 31.8450 178.2342 143 L 4.0797 8.1312 120.4536 58.3789 41.9929 179.0793 144 L 4.2217 8.4452 118.8823 57.9438 41.7354 179.2217 145 L 3.9399 8.4684 120.6147 58.2728 41.8141 178.8522 146 Q 4.1396 8.2116 118.6213 58.6031 28.9436 178.1916 147 H 4.2852 8.1112 119.0697 59.2898 29.8596 177.2290 148 I 3.4060 7.5454 121.8251 64.5279 36.5595 178.1459 149 T 4.0129 7.9701 108.8737 63.3058 68.3746 175.6897 150 K 4.1319 7.5273 120.2113 57.6633 32.3996 176.7322 151 H 4.5453 7.8785 115.4576 57.2860 30.1768 175.9683 152 V 3.9035 7.4076 110.4039 61.4198 32.5239 176.1145 153 S 4.5012 8.7879 118.4023 59.8058 64.6926 174.4018 154 V 4.4480 7.6589 119.4969 60.8886 34.4201 174.0250 155 L 4.7796 9.0746 131.1256 53.8577 43.6303 174.2148 156 Y 5.1167 9.2486 128.6051 56.2523 40.9353 173.7652 157 C 4.0707 8.5205 125.3469 57.7044 30.4956 172.9469 158 L 4.0582 7.8480 124.7850 55.2042 42.2213 177.1673 159 G 4.0991 8.6580 113.8896 45.7189 0.0000 173.4172 160 K 4.0151 8.8256 125.1578 59.6749 32.4595 179.8209 161 T 3.9680 7.7844 107.1897 64.5162 69.1110 175.2521 162 D 4.3986 8.1925 120.9649 56.7284 40.8647 177.0433 163 F 4.5357 7.4887 114.1097 56.3098 40.2065 175.4398 164 S 4.1642 8.1780 113.1205 58.7288 62.8384 175.1611 165 N 4.4095 8.6006 124.3361 52.8130 36.7924 174.4138 166 I 4.0903 8.0149 117.6482 62.5060 37.7390 176.7634 167 R 4.1298 7.7950 117.5611 55.5886 30.0510 175.7623 168 A 4.6898 8.1928 123.9510 49.9683 22.2124 174.6951 169 K 4.0098 8.7116 123.0888 55.9064 31.4290 176.9939 170 L 3.9654 7.7552 121.7629 54.3743 42.1251 176.4380 *174 V 3.7077 8.0447 118.1819 63.0995 31.6971 175.4195 175 T 3.9682 8.0679 123.9656 64.5229 69.2941 173.4624 176 T 5.0452 8.5575 123.4450 61.7608 71.0853 173.7107 177 I 4.3600 9.2074 127.9267 59.7134 39.5970 175.0280 178 V 4.2842 8.4770 128.1520 61.2536 31.5009 175.3085 179 G 3.9934 8.1669 115.3615 44.0408 0.0000 170.2776 180 Y 4.3949 8.3760 117.8930 57.7724 38.3143 176.0233 181 H 4.2969 8.9095 123.4125 55.2376 30.7997 173.8505 182 P 4.2208 0.0000 0.0000 66.1927 31.0834 177.3148 183 A 4.2473 7.8472 119.1606 52.1997 18.7080 178.2171 184 A 4.0919 7.8273 119.1249 54.7622 18.8214 179.2295 *191 K 4.1969 7.8719 112.4671 56.0296 34.3701 175.1278 192 D 4.8497 8.0889 118.7440 52.5889 41.7439 175.3151 193 R 4.0112 8.1576 124.6915 56.0126 32.9036 178.2103 194 S 3.9941 8.0338 114.3277 61.4445 62.6166 176.3287 195 F 4.1510 7.8457 116.8262 59.9560 37.2046 177.3705 196 E 3.3679 6.3431 118.3916 58.8349 29.1454 179.0452 197 I 3.6403 6.9374 119.8902 64.5199 37.1187 178.6062 198 I 3.6985 8.3214 120.9188 64.0246 36.8460 177.6160 199 N 4.2278 7.8605 117.8025 57.3695 38.6389 177.3136 200 V 3.7914 7.5069 113.4114 64.0107 31.3773 178.6093 201 L 4.0394 7.4562 118.1740 57.9673 41.9220 179.2303 202 L 4.2691 8.3341 119.1376 57.6754 41.4902 179.5289 203 E 3.9235 8.1507 118.6144 59.4562 28.6855 178.9935 204 L 4.2281 8.6779 121.0708 58.0280 41.7740 177.8829 205 D 4.4530 7.6787 116.3525 55.1675 41.0480 175.5763 206 N 5.0109 7.5150 115.2278 53.4933 44.0715 174.3405 207 K 4.5233 8.2698 116.9055 53.8395 34.8692 174.9272 208 A 4.4630 8.1297 122.2393 50.5480 19.7164 175.7721 209 P 4.4590 0.0000 0.0000 62.3011 32.1985 176.2943 210 I 3.4893 7.8320 120.4673 61.1772 37.7069 176.2977 211 N 4.6131 8.0461 123.5656 51.8425 37.2685 175.2714 212 W 4.3220 8.4013 124.9451 58.6796 29.9238 178.5497 213 A 4.6530 8.3494 121.0681 54.7258 18.1728 179.3645 214 Q 4.1326 7.9678 114.4957 58.7366 29.0130 178.1680 215 G 3.0798 7.6084 105.2309 47.7886 0.0000 173.5913 216 F 4.6153 7.6504 119.3397 57.7501 39.3698 175.0843 217 I 4.3749 9.0942 124.5448 59.8488 40.2558 175.5074 218 Y 4.5896 8.1286 120.3355 58.4297 38.4977 175.4227 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 M 8.16 4.53 0.00 1.91 2.03 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.51 0.00 2 N 8.50 5.17 0.00 2.57 2.55 0.00 0.00 6.57 6.68 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 3 S 9.13 4.63 0.00 3.54 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 4 V 7.96 5.40 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.93 0.00 0.00 5 T 8.61 4.89 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 1.24 0.00 0.00 6 V 8.41 5.00 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 0.92 0.00 0.00 0.99 0.00 0.00 7 S 9.04 4.78 0.00 4.04 4.03 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 8 H 9.09 4.77 0.00 3.32 3.33 0.00 5.51 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.01 2.59 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.46 0.00 2.24 2.18 0.00 4.00 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 11 Y 8.27 4.57 0.00 3.27 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 T 7.61 5.19 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 13 I 8.60 4.52 1.76 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.21 0.78 0.00 0.00 14 T 8.68 4.95 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 1.24 0.00 0.00 15 Y 8.56 5.15 0.00 3.01 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 16 H 9.59 4.77 0.00 3.67 3.67 0.00 5.78 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.41 4.67 0.00 2.64 2.84 0.00 0.00 7.27 8.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 D 8.55 4.48 0.00 2.53 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 0.00 0.00 0.00 0.00 19 W 8.41 4.69 0.00 3.72 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 20 E 8.23 3.96 0.00 2.44 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 2.41 2.46 0.00 21 P 0.00 4.76 0.00 2.09 2.06 0.00 3.67 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 22 V 8.23 4.40 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 1.11 0.00 0.00 0.86 0.00 0.00 23 M 7.64 3.88 0.00 1.42 1.76 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.36 0.00 24 S 7.93 4.02 0.00 3.84 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 25 Q 7.87 3.68 0.00 1.99 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.69 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 26 L 7.75 4.07 0.00 1.90 1.77 1.19 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 27 V 7.75 3.59 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.92 0.00 0.00 28 E 7.78 3.93 0.00 1.93 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 2.30 2.32 0.00 29 F 7.81 4.73 0.00 3.36 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 30 Y 8.82 4.30 0.00 3.18 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 N 8.42 4.34 0.00 2.81 2.89 0.00 0.00 7.10 7.79 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 32 E 7.71 4.34 0.00 2.11 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.27 0.00 33 V 7.60 4.21 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 0.67 0.00 0.00 0.88 0.00 0.00 34 A 7.82 3.50 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.00 3.81 0.00 3.43 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 36 W 8.20 4.11 0.00 3.05 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 37 L 7.21 3.16 0.00 0.77 1.42 0.44 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 38 L 7.80 4.31 0.00 1.59 1.62 1.14 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.33 3.97 0.00 1.79 1.96 0.00 2.95 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.76 0.00 40 D 6.88 4.85 0.00 2.92 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 41 E 8.69 4.29 0.00 1.95 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 2.42 2.33 0.00 42 T 8.65 5.28 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 43 S 8.84 4.82 0.00 3.99 3.78 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 44 P 0.00 5.04 0.00 2.25 2.10 0.00 4.03 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.98 0.00 45 I 8.09 3.81 1.82 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 1.39 0.68 0.83 0.00 0.00 46 P 0.00 2.00 0.00 1.85 1.67 0.00 3.42 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 47 D 7.84 4.54 0.00 2.58 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 48 K 7.88 4.52 0.00 1.82 1.77 0.00 1.92 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.56 7.81 49 F 7.29 4.23 0.00 2.73 1.93 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 50 F 7.77 4.83 0.00 3.04 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 51 I 7.56 3.92 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.63 0.94 0.00 0.00 52 Q 7.97 4.24 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.07 0.00 0.00 0.00 0.00 0.00 2.71 2.96 0.00 53 L 7.66 3.41 0.00 1.70 1.17 0.81 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 54 K 7.77 4.38 0.00 1.96 1.94 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.68 1.62 7.81 55 Q 7.56 4.43 0.00 2.49 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.90 0.00 0.00 0.00 0.00 0.00 2.50 2.57 0.00 56 P 0.00 4.28 0.00 2.06 1.77 0.00 3.77 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 1.96 1.98 0.00 57 L 8.69 4.34 0.00 0.97 0.92 -0.70 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 58 R 8.03 3.96 0.00 1.74 1.96 0.00 3.18 0.00 0.00 3.27 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 59 N 8.01 4.68 0.00 2.90 3.00 0.00 0.00 6.20 6.99 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 60 K 7.50 4.69 0.00 1.80 1.70 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 3.34 0.00 0.00 0.00 0.00 1.39 1.45 7.81 61 R 8.72 4.68 0.00 1.80 2.04 0.00 2.69 0.00 0.00 3.04 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.69 0.00 62 V 7.56 4.86 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 1.22 0.00 0.00 1.11 0.00 0.00 63 C 9.16 5.21 0.00 3.04 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 64 V 8.93 4.96 2.17 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 0.72 0.00 0.00 1.22 0.00 0.00 65 C 9.61 5.57 0.00 3.12 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 G 9.46 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 67 I 8.41 3.46 1.32 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.55 0.80 0.00 0.00 68 D 7.22 5.00 0.00 2.61 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 69 P 0.00 4.15 0.00 1.98 1.86 0.00 3.55 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.78 0.00 70 Y 8.10 4.30 0.00 2.88 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 71 P 0.00 4.38 0.00 2.23 2.35 0.00 3.81 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.05 0.00 72 K 7.37 4.81 0.00 1.71 1.70 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.34 1.43 7.81 73 D 8.97 4.52 0.00 2.81 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 74 G 8.10 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 T 8.68 4.30 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 1.27 0.00 0.00 76 G 8.36 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 V 7.36 4.18 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.97 0.00 0.00 78 P 0.00 4.14 0.00 2.29 1.90 0.00 3.96 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.82 0.00 79 F 8.32 3.90 0.00 3.32 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 8.19 4.22 0.00 2.10 2.06 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 2.43 2.34 0.00 81 S 8.57 4.62 0.00 3.81 3.78 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 82 P 0.00 4.22 0.00 2.12 2.18 0.00 3.77 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 83 N 8.20 4.65 0.00 2.87 2.96 0.00 0.00 5.99 7.43 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 84 F 8.58 3.92 0.00 3.10 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 T 8.04 4.33 4.39 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 1.11 0.00 0.00 86 K 7.44 4.00 0.00 1.27 0.83 0.00 1.08 0.00 0.00 1.47 0.00 0.00 2.73 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.05 0.21 7.81 87 K 8.46 4.05 0.00 1.80 1.87 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.48 7.81 88 S 8.12 4.20 0.00 4.26 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 89 I 7.72 4.05 2.42 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 1.98 1.71 1.05 0.00 0.00 90 K 7.63 4.02 0.00 1.88 1.72 0.00 1.34 0.00 0.00 1.43 0.00 0.00 2.85 0.00 0.00 2.75 0.00 0.00 0.00 0.00 0.30 0.94 7.81 91 E 8.04 4.10 0.00 2.16 2.06 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 2.48 2.53 0.00 92 I 8.01 3.72 1.92 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.88 0.84 0.00 0.00 93 A 7.88 2.97 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 7.99 4.21 0.00 3.87 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 95 S 7.70 4.03 0.00 3.81 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 96 I 7.44 3.53 1.31 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.44 0.83 0.00 0.00 97 S 8.10 4.43 0.00 4.20 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 98 R 7.63 4.13 0.00 1.74 1.94 0.00 3.18 0.00 0.00 3.14 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 99 L 7.29 4.04 0.00 1.69 1.74 0.62 0.91 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 0.00 100 T 8.17 4.36 4.37 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 0.00 0.00 0.00 1.37 0.00 0.00 101 G 8.03 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 0.00 102 V 7.74 3.56 1.62 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 0.41 0.00 0.00 0.95 0.00 0.00 103 I 8.33 4.17 1.89 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 1.42 0.80 0.96 0.00 0.00 104 D 7.89 4.63 0.00 2.71 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 0.00 105 Y 7.62 4.83 0.00 2.99 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 0.00 106 K 9.13 4.38 0.00 1.77 1.87 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.38 1.39 7.81 107 G 7.61 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 Y 8.04 5.16 0.00 2.70 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 0.00 109 N 8.56 4.95 0.00 2.73 2.46 0.00 0.00 6.93 6.73 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 0.00 110 L 8.85 4.07 0.00 1.74 1.77 0.52 1.40 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 0.00 111 N 8.15 4.54 0.00 2.83 2.87 0.00 0.00 7.03 8.34 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 0.00 112 I 7.57 4.31 1.83 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.76 0.89 0.00 0.00 113 I 7.26 4.34 1.69 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 1.32 0.80 0.61 0.00 0.00 114 D 9.10 4.44 0.00 2.59 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 0.00 115 G 9.05 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 0.00 116 V 7.10 4.59 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 0.90 0.00 0.00 0.33 0.00 0.00 117 I 8.73 4.58 1.92 0.00 0.00 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 1.42 1.65 1.00 0.00 0.00 118 P 0.00 5.22 0.00 2.59 2.20 0.00 3.93 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 2.17 2.17 0.00 119 W 10.10 5.34 0.00 3.44 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 0.00 120 N 7.42 5.07 0.00 1.97 2.40 0.00 0.00 6.92 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 Y 9.26 4.28 0.00 2.81 2.62 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 0.00 122 Y 7.89 4.40 0.00 2.70 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 0.00 123 L 5.86 3.51 0.00 0.27 0.20 0.20 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 124 S 6.37 4.84 0.00 3.89 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 0.00 125 C 8.68 4.72 0.00 3.10 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 0.00 126 K 8.32 4.12 0.00 1.69 1.81 0.00 1.85 0.00 0.00 1.61 0.00 0.00 3.17 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.60 1.48 7.81 127 L 8.95 4.06 0.00 1.64 1.64 1.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 128 G 9.61 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 0.00 129 E 8.29 4.47 0.00 1.96 1.84 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 2.21 2.24 0.00 130 T 8.31 3.93 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 1.23 0.00 0.00 131 K 10.08 4.01 0.00 1.93 1.93 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.36 7.81 132 S 7.75 4.13 0.00 3.91 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 0.00 133 H 8.05 4.87 0.00 3.59 3.64 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.30 2.58 0.96 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 0.00 0.00 135 I 7.20 3.32 1.50 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.33 -0.22 0.00 0.00 136 Y 7.12 4.21 0.00 2.65 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 W 8.03 4.62 0.00 3.38 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 0.00 138 D 7.80 4.30 0.00 2.73 2.47 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 0.00 139 K 7.67 3.87 0.00 1.12 0.74 0.00 1.36 0.00 0.00 1.07 0.00 0.00 2.99 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.29 7.81 140 I 7.68 4.02 2.44 0.00 0.00 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 2.03 0.85 1.41 0.00 0.00 141 S 8.77 3.98 0.00 3.61 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 0.00 142 K 7.85 4.10 0.00 2.10 1.93 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.58 1.68 7.81 143 L 8.13 4.08 0.00 2.18 2.19 1.08 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 144 L 8.45 4.22 0.00 2.07 2.08 1.31 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 145 L 8.47 3.94 0.00 2.15 2.00 1.04 1.13 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 0.00 146 Q 8.21 4.14 0.00 2.37 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.72 0.00 0.00 0.00 0.00 0.00 2.59 2.52 0.00 147 H 8.11 4.29 0.00 3.34 3.47 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 I 7.55 3.41 1.82 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.33 0.74 0.00 0.00 149 T 7.97 4.01 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 0.00 150 K 7.53 4.13 0.00 1.71 1.71 0.00 1.62 0.00 0.00 1.66 0.00 0.00 3.02 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.39 1.59 7.81 151 H 7.88 4.55 0.00 3.04 3.31 0.00 5.65 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 V 7.41 3.90 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.95 0.00 0.00 153 S 8.79 4.50 0.00 3.86 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 0.00 154 V 7.66 4.45 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 1.18 0.00 0.00 0.96 0.00 0.00 155 L 9.07 4.78 0.00 1.78 1.52 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 156 Y 9.25 5.12 0.00 3.04 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 C 8.52 4.07 0.00 2.17 1.18 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 0.00 158 L 7.85 4.06 0.00 1.64 1.61 1.09 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 159 G 8.66 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 0.00 160 K 8.83 4.02 0.00 1.76 1.66 0.00 1.49 0.00 0.00 1.81 0.00 0.00 3.26 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.02 1.14 7.81 161 T 7.78 3.97 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 1.19 0.00 0.00 162 D 8.19 4.40 0.00 2.71 2.48 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 0.00 163 F 7.49 4.54 0.00 3.28 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.18 4.16 0.00 3.89 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 N 8.60 4.41 0.00 2.90 2.91 0.00 0.00 7.16 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 I 8.01 4.09 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 1.49 0.79 0.94 0.00 0.00 167 R 7.80 4.13 0.00 1.88 1.93 0.00 3.00 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.67 0.00 168 A 8.19 4.69 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 0.00 169 K 8.71 4.01 0.00 1.79 1.88 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.59 7.81 170 L 7.76 3.97 0.00 1.62 1.68 0.92 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 *174 V 8.04 3.71 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 0.79 0.00 0.00 0.95 0.00 0.00 175 T 8.07 3.97 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 0.00 176 T 8.56 5.05 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 1.15 0.00 0.00 177 I 9.21 4.36 2.30 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.72 1.16 0.00 0.00 178 V 8.48 4.28 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.82 0.00 0.00 179 G 8.17 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 0.00 180 Y 8.38 4.39 0.00 2.84 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 0.00 181 H 8.91 4.30 0.00 3.23 3.23 0.00 5.88 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 0.00 182 P 0.00 4.22 0.00 2.25 2.22 0.00 3.37 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.00 0.00 183 A 7.85 4.25 1.40 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 0.00 0.00 184 A 7.83 4.09 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *191 K 7.87 4.20 0.00 1.83 1.95 0.00 1.33 0.00 0.00 1.45 0.00 0.00 2.27 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.30 7.81 192 D 8.09 4.85 0.00 2.73 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 0.00 193 R 8.16 4.01 0.00 1.70 1.63 0.00 3.11 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.50 0.00 194 S 8.03 3.99 0.00 4.00 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 0.00 195 F 7.85 4.15 0.00 3.14 3.37 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 0.00 0.00 0.00 0.00 196 E 6.34 3.37 0.00 1.37 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 1.47 1.62 0.00 197 I 6.94 3.64 1.84 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 1.35 1.35 0.85 0.00 0.00 198 I 8.32 3.70 1.94 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.69 0.93 0.00 0.00 199 N 7.86 4.23 0.00 2.82 3.13 0.00 0.00 7.20 8.91 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 0.00 200 V 7.51 3.79 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.08 0.00 0.00 201 L 7.46 4.04 0.00 1.75 1.74 0.93 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 202 L 8.33 4.27 0.00 1.86 1.74 0.95 0.82 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 0.00 203 E 8.15 3.92 0.00 2.15 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 2.62 2.55 0.00 204 L 8.68 4.23 0.00 1.84 1.81 0.93 0.21 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 0.00 205 D 7.68 4.45 0.00 3.02 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 0.00 206 N 7.52 5.01 0.00 2.96 2.85 0.00 0.00 6.77 7.01 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 0.00 207 K 8.27 4.52 0.00 1.67 1.76 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.77 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.47 7.81 208 A 8.13 4.46 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 0.00 209 P 0.00 4.46 0.00 2.18 2.08 0.00 3.75 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 210 I 7.83 3.49 0.66 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.20 -0.73 0.00 0.00 211 N 8.05 4.61 0.00 2.73 2.64 0.00 0.00 7.21 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 W 8.40 4.32 0.00 3.48 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 0.00 213 A 8.35 4.65 1.59 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 0.00 0.00 214 Q 7.97 4.13 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 215 G 7.61 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 0.00 0.00 0.00 216 F 7.65 4.62 0.00 3.02 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 I 9.09 4.37 1.78 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 1.18 0.62 0.91 0.00 0.00 218 Y 8.13 4.59 0.00 2.87 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.