NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4048 8.3049 120.3160 55.4323 33.3454 175.4451 2 K 3.9318 8.2188 119.2164 54.1290 31.5889 174.1767 3 R 4.8315 8.5653 123.2647 54.1212 33.9553 174.5457 4 F 4.8973 8.1384 116.0290 56.0475 42.3342 174.3888 5 N 3.9485 8.0990 114.2198 53.1278 40.6314 174.5091 6 V 3.7653 8.4098 127.0531 62.2518 29.4250 175.3559 7 S 4.3439 8.5794 124.2304 61.1634 63.7549 174.6293 8 Y 4.7805 7.9684 117.4210 56.3394 42.0951 174.2317 9 V 4.4369 8.3017 125.3294 61.2597 32.9668 173.0102 10 E 5.1828 9.3354 129.2600 54.5349 30.9714 175.3797 11 V 4.1153 8.3269 127.6440 62.6925 33.6119 174.8170 12 I 4.9447 8.3818 124.5271 59.4825 41.4132 174.1204 13 K 4.6012 9.4356 129.4418 54.7701 34.4040 175.5844 14 N 3.9856 9.7358 126.7257 54.6207 36.3298 175.0596 15 G 3.8511 9.2096 102.7115 45.9886 0.0000 174.1437 16 E 4.4913 7.8407 119.1717 54.4946 33.2170 175.0989 17 T 4.8772 8.9404 120.1975 63.9441 69.0422 173.2727 18 I 4.2123 8.3248 119.3394 62.3541 39.3971 175.3581 19 S 4.9445 7.3474 116.7122 56.4888 67.3393 172.9452 20 S 4.8688 7.9302 111.5820 58.0152 66.9076 175.6578 21 C 5.1296 9.3912 124.5786 57.7427 30.8228 172.5876 22 F 5.1405 8.5845 117.7005 55.6886 40.0315 175.8724 23 Q 4.5471 8.1390 120.3129 53.7020 31.2675 173.7001 24 P 3.7764 0.0000 0.0000 62.7188 32.0545 174.0615 25 F 4.5902 7.9468 115.1881 56.3838 42.2833 173.8471 26 Q 4.0973 8.1161 117.4971 59.3683 25.1899 175.8064 27 K 3.9515 8.1556 109.6194 58.4898 30.7949 174.1265 28 N 4.5666 7.6996 125.9440 56.0735 39.8686 176.4310 29 E 4.6607 7.6104 118.0179 56.0744 30.3745 175.3600 30 N 4.8209 7.8476 113.4432 53.8621 41.8330 173.7455 31 Y 4.5331 7.3119 114.9490 56.3308 42.2411 175.1553 32 G 3.7608 8.7813 114.1317 46.2665 0.0000 171.3979 33 T 4.4514 7.5027 126.5091 64.4590 76.4400 173.8109 34 I 4.0793 7.7026 122.3262 61.3620 38.4321 176.8266 35 T 4.6534 8.0259 127.6825 63.4867 68.2790 172.7435 36 S 5.3655 8.3163 112.1901 60.0058 69.3001 175.1102 37 A 4.6774 7.8764 121.9475 51.3213 18.6374 177.6676 38 N 5.1844 7.8290 114.7052 54.5477 40.1760 174.7024 39 E 4.9060 8.4569 113.7962 56.2930 30.5699 176.7545 40 Q 4.3821 8.3144 119.7442 57.7207 30.7841 176.8190 41 I 3.6119 7.8128 117.7478 61.9227 37.6951 175.2858 42 T 4.4661 8.1168 118.7437 60.2061 68.6499 173.4880 43 P 3.9227 0.0000 0.0000 65.7779 30.9869 179.0735 44 V 3.2115 7.6207 116.6671 65.7733 31.3685 177.9110 45 I 3.4722 8.2491 120.2745 64.3208 36.8217 178.4281 46 F 3.9270 7.7632 118.0666 60.5405 38.9669 177.2964 47 H 4.4431 9.2038 120.5145 58.4347 29.5429 176.5569 48 N 4.4517 8.9924 119.3458 55.6894 38.8066 176.8082 49 L 4.0550 7.9817 120.9306 58.0456 41.7006 178.8949 50 I 4.0008 8.4658 119.7319 65.2286 36.9595 177.8953 51 M 3.6879 7.9124 118.2751 58.7249 32.1543 177.3838 52 D 4.5683 8.6177 116.7585 55.4658 41.6781 176.4783 53 M 4.5380 8.4639 116.9402 57.0700 34.2233 177.7474 54 V 3.5760 7.6287 117.6435 65.5927 31.9233 177.4409 55 L 3.8729 8.7578 119.4367 57.7268 41.6702 177.9462 56 P 4.5753 0.0000 0.0000 63.6906 31.0192 177.5290 57 K 4.5006 8.4124 117.7025 56.3926 33.9451 176.5781 58 V 3.2346 7.1823 118.4963 60.7588 32.9494 175.4993 59 V 4.5664 7.5347 112.0411 59.4233 35.3618 173.6076 60 P 5.1207 0.0000 0.0000 62.1229 31.3269 173.5932 61 I 3.1657 7.5025 122.2748 62.2768 37.1290 173.9325 62 K 4.5259 8.3741 121.6384 56.5893 34.2700 176.2225 63 G 4.5225 7.1502 106.9337 46.0720 0.0000 173.1570 64 N 4.6444 8.0794 115.0856 53.6161 41.1558 171.1731 65 K 3.8411 8.3177 124.6181 56.7393 32.1687 176.2457 66 V 3.1666 7.8461 123.8326 63.6250 29.7174 170.7731 67 T 4.4386 7.6139 116.1883 59.5379 69.5183 173.4917 68 K 4.2268 8.3452 129.1540 55.8263 33.3175 177.4492 69 M 4.0893 8.2989 125.6494 57.0361 32.0834 177.3013 70 S 3.6058 7.2631 109.7433 59.2425 61.4508 172.0063 71 M 4.3231 7.4944 114.2248 53.7714 33.3862 174.5587 72 N 4.1440 8.1252 114.6677 54.9510 37.0907 173.5354 73 L 4.2141 8.0057 120.7235 57.7150 42.3900 178.1879 74 I 4.7676 7.4850 115.0821 59.7614 41.3281 173.4762 75 D 4.8513 8.3785 121.2117 53.6108 42.9792 175.3173 76 G 3.6933 8.7409 114.8982 45.3883 0.0000 173.2511 77 F 5.4152 7.7219 115.3232 55.8055 43.6961 173.9663 78 D 4.9803 9.5732 120.6746 52.8151 43.3143 175.3848 79 C 4.6528 7.9565 117.4229 56.2487 32.1465 172.8832 80 F 5.3001 9.0190 121.5983 55.4780 43.4698 173.4901 81 Y 5.3667 8.5256 117.9528 55.5935 41.4133 174.1321 82 S 4.9880 9.5042 118.6387 56.4577 65.4278 173.3771 83 T 4.6726 8.7158 117.7492 61.1858 70.0625 173.4905 84 D 4.9699 8.9066 122.7065 55.0006 42.1190 177.2238 85 D 4.3856 8.8122 122.2447 56.6029 41.0870 177.7192 86 H 4.7989 7.9880 112.7973 55.7268 29.6353 174.2345 87 D 4.6307 8.0055 121.1142 52.9830 41.6297 173.3774 88 P 4.4067 0.0000 0.0000 64.5740 31.8932 176.9964 89 K 4.5929 7.7165 117.3039 56.5843 32.7389 176.8145 90 T 4.9393 7.7330 114.8303 62.6549 70.1824 173.4335 91 V 4.2632 9.1378 126.7998 62.9591 34.2324 174.9053 92 Y 4.8104 8.9452 120.1699 56.6423 40.8113 173.5296 93 V 4.9579 8.8357 124.8443 61.4261 33.5944 174.2635 94 C 5.3014 8.9611 122.6060 56.6068 32.7578 172.8747 95 F 6.1822 9.5189 118.6347 55.1734 39.0824 174.9494 96 T 4.8699 7.9326 112.0016 60.6363 71.9865 173.5247 97 L 5.0145 8.3082 120.1643 53.4125 43.3153 178.4054 98 V 4.1578 7.9254 115.0768 64.1843 31.8412 177.7339 99 D 4.4147 7.9251 118.2525 56.8894 40.9517 177.1146 100 I 2.7104 7.5621 121.4636 59.7963 37.4006 175.1031 101 P 4.5016 0.0000 0.0000 62.9109 31.9670 175.8549 102 K 4.4032 8.2808 116.3222 54.9082 31.0788 175.0285 103 I 4.5036 7.0253 119.1017 61.1106 44.3724 175.9484 104 L 2.0000 7.5312 121.7625 56.5736 41.8772 176.6763 105 P 4.1184 0.0000 0.0000 66.1210 30.7703 178.3134 106 I 3.5139 7.0255 118.7516 64.3168 37.1039 178.3058 107 R 4.4001 7.5072 119.7193 57.9967 29.8451 179.0495 108 I 3.6041 7.8103 120.5750 64.2282 37.2110 178.1924 109 L 3.9247 7.7448 119.5792 57.9693 41.7478 179.8871 110 S 4.3259 7.9442 113.7965 61.2331 62.5574 176.8881 111 G 3.5838 8.0593 109.7442 47.7029 0.0000 175.7835 112 L 3.6961 8.4039 122.0089 57.5870 41.3766 179.4202 113 Q 4.1055 7.6403 116.3928 57.9257 28.6925 177.6142 114 E 3.9772 8.9010 121.1890 59.4496 29.9835 175.6027 115 Y 4.5965 7.7776 115.6421 56.6279 40.1983 174.6521 116 E 4.7636 8.9329 117.8927 56.6369 31.1971 175.9862 117 S 4.8973 8.1646 114.9033 56.2761 65.9560 173.2927 118 N 5.0224 7.9438 125.7740 53.8822 38.3659 174.4535 119 A 4.7825 8.4645 118.9232 51.8396 20.1152 177.0097 120 T 4.7348 7.4408 107.6480 61.8216 71.8084 173.6499 121 N 4.9101 8.5952 117.7773 53.0534 38.1050 175.7839 122 E 4.6875 7.8877 115.7878 56.4000 31.4493 175.0291 123 L 4.5092 7.6741 117.2193 55.6976 44.1598 178.2233 124 L 3.8574 8.0640 119.0885 59.1455 40.1335 178.9868 125 S 4.0553 8.2353 114.4193 61.5762 62.3994 176.0467 126 S 3.9957 8.5463 117.1553 61.6740 62.0533 175.7751 127 H 3.8876 7.5719 118.2699 58.5462 28.4050 177.8153 128 V 3.5751 8.0613 120.7081 66.0283 31.3477 178.3392 129 G 3.6053 7.9010 105.0131 47.7271 0.0000 175.8660 130 Q 4.1689 8.6085 120.4793 58.1987 28.6569 178.2812 131 I 4.1174 8.5156 121.3565 62.9480 37.1326 177.8743 132 L 3.9000 7.7359 121.5957 58.2750 41.7427 178.7994 133 D 4.3764 7.8209 117.2227 57.6378 40.6918 178.8193 134 S 4.3096 7.8245 114.3761 60.6801 62.6843 176.1389 135 F 4.0288 8.2493 124.2858 61.6485 38.9950 176.2226 136 H 3.7613 7.7972 117.2310 59.5694 29.6355 176.7787 137 E 3.8924 7.6933 119.6925 59.7573 29.2019 179.4048 138 E 3.9757 8.1853 118.5266 59.1074 29.3556 179.1522 139 L 3.8372 7.2991 117.8235 57.3928 41.9086 179.3504 140 V 3.7702 8.0946 118.7376 66.0051 31.3669 177.7815 141 E 3.9301 8.1123 117.7519 59.3894 29.4896 177.8816 142 Y 4.1515 8.4816 119.0663 59.4697 39.4898 176.2226 143 R 4.1234 7.6601 120.5037 55.0776 29.8321 175.1904 144 N 4.5120 7.2078 107.2788 53.3459 41.5310 176.2501 145 Q 4.3845 8.1718 118.8311 57.7948 30.2884 177.3418 146 T 4.3994 7.2912 111.2235 60.6351 67.3805 172.5575 147 L 4.6524 7.6602 118.6405 52.4543 44.0839 176.2002 148 N 4.4369 8.2588 118.2578 54.8577 39.5039 175.1104 149 S 4.2504 7.5593 118.3657 59.2612 63.8789 175.6300 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 8.30 4.40 0.00 2.00 2.07 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.55 0.00 2 K 8.22 3.93 0.00 1.72 1.66 0.00 1.29 0.00 0.00 1.01 0.00 0.00 2.60 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.14 1.36 7.81 3 R 8.57 4.83 0.00 1.98 1.91 0.00 3.32 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 4 F 8.14 4.90 0.00 3.01 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 N 8.10 3.95 0.00 2.44 2.39 0.00 0.00 6.56 6.79 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 6 V 8.41 3.77 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 0.82 0.00 0.00 0.81 0.00 0.00 7 S 8.58 4.34 0.00 3.71 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 8 Y 7.97 4.78 0.00 1.58 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.30 4.44 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.90 0.00 0.00 10 E 9.34 5.18 0.00 2.70 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.12 0.00 11 V 8.33 4.12 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 0.40 0.00 0.00 1.03 0.00 0.00 12 I 8.38 4.94 1.84 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.81 0.91 0.00 0.00 13 K 9.44 4.60 0.00 1.66 1.61 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.29 1.59 7.81 14 N 9.74 3.99 0.00 2.84 2.89 0.00 0.00 7.10 7.57 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 15 G 9.21 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 16 E 7.84 4.49 0.00 2.12 1.79 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 2.21 2.26 0.00 17 T 8.94 4.88 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 1.26 0.00 0.00 18 I 8.32 4.21 1.82 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 1.29 0.41 0.87 0.00 0.00 19 S 7.35 4.94 0.00 3.78 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 20 S 7.93 4.87 0.00 3.83 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 C 9.39 5.13 0.00 2.96 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 22 F 8.58 5.14 0.00 2.89 3.17 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 23 Q 8.14 4.55 0.00 2.05 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 6.87 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 24 P 0.00 3.78 0.00 1.96 1.90 0.00 3.72 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 25 F 7.95 4.59 0.00 3.04 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 26 Q 8.12 4.10 0.00 2.28 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.53 0.00 0.00 0.00 0.00 0.00 2.54 2.27 0.00 27 K 8.16 3.95 0.00 2.04 2.26 0.00 1.63 0.00 0.00 1.94 0.00 0.00 2.96 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.41 1.45 7.81 28 N 7.70 4.57 0.00 2.77 2.80 0.00 0.00 7.14 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 29 E 7.61 4.66 0.00 1.93 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 2.20 2.32 0.00 30 N 7.85 4.82 0.00 2.67 2.71 0.00 0.00 6.92 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 31 Y 7.31 4.53 0.00 2.80 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 32 G 8.78 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 33 T 7.50 4.45 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 34 I 7.70 4.08 1.93 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.15 0.77 0.00 0.00 35 T 8.03 4.65 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 1.23 0.00 0.00 36 S 8.32 5.37 0.00 3.98 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 37 A 7.88 4.68 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 38 N 7.83 5.18 0.00 2.79 2.99 0.00 0.00 7.00 7.57 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 39 E 8.46 4.91 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 2.25 2.48 0.00 40 Q 8.31 4.38 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.21 6.92 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 41 I 7.81 3.61 1.89 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 1.33 0.97 -0.09 0.00 0.00 42 T 8.12 4.47 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 43 P 0.00 3.92 0.00 1.82 1.00 0.00 3.59 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.05 0.00 44 V 7.62 3.21 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 0.95 0.00 0.00 0.79 0.00 0.00 45 I 8.25 3.47 1.05 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.51 0.56 0.00 0.00 46 F 7.76 3.93 0.00 3.35 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 47 H 9.20 4.44 0.00 3.21 3.36 0.00 5.64 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 48 N 8.99 4.45 0.00 2.97 2.74 0.00 0.00 7.13 5.85 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 49 L 7.98 4.06 0.00 1.99 1.96 1.02 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 50 I 8.47 4.00 1.97 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 1.71 1.48 0.99 0.00 0.00 51 M 7.91 3.69 0.00 1.94 2.15 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.50 0.00 52 D 8.62 4.57 0.00 2.94 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 53 M 8.46 4.54 0.00 1.93 2.16 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.73 0.00 54 V 7.63 3.58 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 0.94 0.00 0.00 1.08 0.00 0.00 55 L 8.76 3.87 0.00 1.77 1.68 0.88 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.58 0.00 2.01 2.06 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.13 0.00 57 K 8.41 4.50 0.00 1.80 1.71 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.51 7.81 58 V 7.18 3.23 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.44 0.00 0.00 59 V 7.53 4.57 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 0.94 0.00 0.00 1.17 0.00 0.00 60 P 0.00 5.12 0.00 2.22 2.17 0.00 3.56 0.00 0.00 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 61 I 7.50 3.17 1.92 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.40 1.01 0.00 0.00 62 K 8.37 4.53 0.00 1.73 1.84 0.00 1.84 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.42 7.81 63 G 7.15 4.52 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 0.00 0.00 0.00 64 N 8.08 4.64 0.00 2.66 2.78 0.00 0.00 7.24 7.61 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 65 K 8.32 3.84 0.00 1.89 1.86 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.46 7.81 66 V 7.85 3.17 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 0.59 0.00 0.00 0.93 0.00 0.00 67 T 7.61 4.44 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 0.59 0.00 0.00 68 K 8.35 4.23 0.00 1.80 1.46 0.00 1.20 0.00 0.00 1.56 0.00 0.00 2.72 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.95 0.21 7.81 69 M 8.30 4.09 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.81 0.00 70 S 7.26 3.61 0.00 4.19 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 71 M 7.49 4.32 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 72 N 8.13 4.14 0.00 2.87 2.82 0.00 0.00 7.16 7.80 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 73 L 8.01 4.21 0.00 1.79 1.88 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 74 I 7.48 4.77 2.11 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.53 1.37 0.00 0.00 75 D 8.38 4.85 0.00 2.61 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.74 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 F 7.72 5.42 0.00 3.34 3.53 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 78 D 9.57 4.98 0.00 2.79 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 C 7.96 4.65 0.00 2.35 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 80 F 9.02 5.30 0.00 2.76 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 81 Y 8.53 5.37 0.00 3.01 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 82 S 9.50 4.99 0.00 3.87 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 83 T 8.72 4.67 4.35 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 1.36 0.00 0.00 84 D 8.91 4.97 0.00 3.41 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 85 D 8.81 4.39 0.00 2.61 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 H 7.99 4.80 0.00 3.21 3.31 0.00 5.56 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.01 4.63 0.00 2.86 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 P 0.00 4.41 0.00 2.10 2.15 0.00 3.74 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 89 K 7.72 4.59 0.00 1.88 2.06 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.40 7.81 90 T 7.73 4.94 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 1.16 0.00 0.00 91 V 9.14 4.26 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 1.12 0.00 0.00 0.96 0.00 0.00 92 Y 8.95 4.81 0.00 3.16 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 93 V 8.84 4.96 2.41 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 1.28 0.00 0.00 1.11 0.00 0.00 94 C 8.96 5.30 0.00 3.07 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 95 F 9.52 6.18 0.00 3.03 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 96 T 7.93 4.87 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 1.15 0.00 0.00 97 L 8.31 5.01 0.00 1.52 1.64 0.99 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.93 4.16 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 0.94 0.00 0.00 0.90 0.00 0.00 99 D 7.93 4.41 0.00 2.55 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 0.00 100 I 7.56 2.71 1.81 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 0.24 0.57 1.00 0.00 0.00 101 P 0.00 4.50 0.00 2.30 2.22 0.00 3.64 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.28 0.00 102 K 8.28 4.40 0.00 1.83 1.80 0.00 1.91 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.30 1.50 7.81 103 I 7.03 4.50 1.87 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 1.25 1.31 1.05 0.00 0.00 104 L 7.53 2.00 0.00 0.35 1.27 0.34 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 105 P 0.00 4.12 0.00 1.27 1.79 0.00 3.39 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.32 0.00 106 I 7.03 3.51 1.88 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 1.52 0.95 0.84 0.00 0.00 107 R 7.51 4.40 0.00 1.75 2.01 0.00 3.50 0.00 0.00 3.33 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.08 0.00 108 I 7.81 3.60 1.86 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.83 0.85 0.00 0.00 109 L 7.74 3.92 0.00 1.61 1.60 1.03 0.82 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 0.00 110 S 7.94 4.33 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 0.00 111 G 8.06 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 0.00 0.00 0.00 112 L 8.40 3.70 0.00 1.72 1.86 1.08 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 7.64 4.11 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.57 7.01 0.00 0.00 0.00 0.00 0.00 2.14 2.02 0.00 114 E 8.90 3.98 0.00 1.99 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.21 0.00 115 Y 7.78 4.60 0.00 2.83 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.93 4.76 0.00 1.98 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 2.23 2.33 0.00 117 S 8.16 4.90 0.00 3.87 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 0.00 118 N 7.94 5.02 0.00 2.98 2.99 0.00 0.00 6.18 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 0.00 119 A 8.46 4.78 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 T 7.44 4.73 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 1.21 0.00 0.00 121 N 8.60 4.91 0.00 2.72 2.85 0.00 0.00 7.01 7.63 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 0.00 122 E 7.89 4.69 0.00 1.89 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 2.19 2.21 0.00 123 L 7.67 4.51 0.00 1.78 1.53 0.92 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 124 L 8.06 3.86 0.00 1.97 1.96 1.09 0.74 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 0.00 125 S 8.24 4.06 0.00 4.07 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 0.00 126 S 8.55 4.00 0.00 3.87 3.55 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 0.00 127 H 7.57 3.89 0.00 2.90 2.60 0.00 5.70 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 8.06 3.58 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 0.90 0.00 0.00 0.95 0.00 0.00 129 G 7.90 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 0.00 0.00 0.00 130 Q 8.61 4.17 0.00 2.21 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.72 0.00 0.00 0.00 0.00 0.00 2.42 2.61 0.00 131 I 8.52 4.12 1.94 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.92 0.95 0.00 0.00 132 L 7.74 3.90 0.00 1.96 1.70 0.86 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 133 D 7.82 4.38 0.00 2.77 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 0.00 134 S 7.82 4.31 0.00 4.16 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 0.00 135 F 8.25 4.03 0.00 3.15 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 0.00 136 H 7.80 3.76 0.00 3.15 3.26 0.00 5.68 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 0.00 137 E 7.69 3.89 0.00 2.04 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 2.33 2.52 0.00 138 E 8.19 3.98 0.00 1.91 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 2.28 2.56 0.00 139 L 7.30 3.84 0.00 1.60 1.53 0.29 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 140 V 8.09 3.77 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 0.93 0.00 0.00 0.92 0.00 0.00 141 E 8.11 3.93 0.00 2.24 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 2.31 2.45 0.00 142 Y 8.48 4.15 0.00 2.89 3.17 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 0.00 143 R 7.66 4.12 0.00 2.07 1.93 0.00 3.52 0.00 0.00 3.18 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.84 0.00 144 N 7.21 4.51 0.00 2.64 2.69 0.00 0.00 7.09 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 0.00 145 Q 8.17 4.38 0.00 1.90 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.57 0.00 0.00 0.00 0.00 0.00 2.23 2.36 0.00 146 T 7.29 4.40 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 1.14 0.00 0.00 147 L 7.66 4.65 0.00 1.57 1.49 0.75 0.99 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 0.00 148 N 8.26 4.44 0.00 2.66 2.76 0.00 0.00 6.84 7.62 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 0.00 149 S 7.56 4.25 0.00 3.82 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00