NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2246 8.2549 119.6989 56.6754 31.9048 172.8561 3 H 4.6679 8.2670 116.7672 55.7150 30.9494 174.2868 4 L 3.8207 9.5525 120.3223 57.0860 42.8845 176.8573 5 K 4.0411 7.7917 115.6322 58.0567 31.9690 176.9177 6 S 4.5585 7.9619 116.1157 57.0213 64.0620 173.8489 7 G 3.7012 8.5209 111.1979 46.2154 0.0000 174.1387 8 R 3.3338 8.8503 120.2668 56.5786 28.8267 176.2118 9 K 3.8783 8.3486 120.3265 57.5881 32.7799 176.4962 10 L 4.1477 7.8672 113.5082 54.7377 44.0670 173.5852 11 N 4.6584 8.6257 124.0286 52.7237 41.2923 174.3575 12 R 3.6907 10.6400 117.7683 56.1288 29.5395 174.9808 13 H 5.0182 7.3804 113.0346 55.0930 32.6956 173.9863 14 S 3.5679 8.2600 111.4836 61.1103 63.4180 176.3660 15 S 4.0278 8.0837 116.7174 61.1083 63.1235 175.6225 16 H 3.8036 8.4080 121.9914 58.7092 29.3034 176.3820 17 R 3.6748 8.4705 120.3259 60.2488 29.9608 177.2890 18 L 3.6116 7.9789 119.9081 56.5807 41.7718 178.6548 19 A 3.8962 8.7614 120.2302 55.6048 18.7794 178.7779 20 L 3.8283 8.7881 119.3504 58.4480 42.0240 178.5619 21 Y 4.1131 7.9578 115.6634 61.3224 37.8591 179.4565 22 R 4.1489 7.8089 118.2276 59.6374 30.2283 179.0119 23 N 4.4831 8.4746 115.6767 55.7262 38.4898 177.1306 24 Q 4.2011 8.2509 119.2449 57.8516 28.8871 177.8479 25 A 4.0969 8.1241 122.4188 54.8195 18.5637 179.3665 26 K 3.8570 8.4939 116.8983 60.0332 32.2715 179.1825 27 S 4.1300 7.8920 114.5696 61.6578 62.5922 176.2670 28 L 3.9736 7.8636 121.7997 58.4966 41.8341 179.0991 29 L 4.1262 8.0668 117.3812 58.6019 41.7546 178.9060 30 T 3.8299 8.2694 113.7618 65.9547 68.7771 175.3682 31 H 4.8141 8.9848 121.2994 55.7785 27.3578 175.2258 32 G 4.3462 8.9420 118.1653 47.2915 0.0000 173.0273 33 R 5.1651 8.1311 117.3455 54.2268 33.9700 175.1047 34 I 4.8055 8.8860 121.8828 59.9204 42.1148 174.2248 35 T 5.1765 8.6293 119.8690 61.3334 71.1364 173.5607 36 T 4.6839 8.1180 115.1248 60.8054 72.2845 172.8702 37 T 4.5679 8.3926 111.1703 61.1103 69.5933 175.1223 38 V 3.7077 8.3794 120.6329 65.6757 31.5778 176.2669 39 P 4.1500 0.0000 0.0000 65.5524 31.1644 178.4282 40 K 3.8571 8.3892 118.4649 59.2982 31.7655 177.7119 41 A 4.0545 7.6614 120.3773 54.2407 19.0107 179.0947 42 K 3.7891 8.3626 115.8972 58.2773 32.7078 177.6886 43 E 4.2943 8.2561 120.1793 57.6628 30.6256 177.0847 44 L 3.6846 7.1821 120.5673 59.1337 42.1155 178.5383 45 R 3.6350 8.1026 112.2151 59.7630 28.7999 177.9421 46 G 3.8255 8.1047 105.0936 47.4211 0.0000 174.2784 47 F 4.1988 7.5429 121.2181 60.9012 39.6642 176.7405 48 V 3.6267 8.3567 117.3623 66.7526 31.3364 177.8876 49 D 4.5005 7.9173 117.8427 57.7803 40.6104 178.6009 50 H 4.0460 7.9156 117.7418 59.7407 29.5968 177.1383 51 L 3.7113 7.4876 118.7367 58.0724 41.5204 179.1386 52 I 3.5415 7.4041 119.6445 64.0714 36.5903 177.4095 53 H 3.7206 8.6493 119.8270 59.2150 29.6493 177.2357 54 L 3.9875 7.9119 122.1515 57.5987 41.7946 177.9515 55 A 3.0470 7.5103 118.4677 52.5996 18.3902 178.9908 56 K 3.9168 7.0951 117.4886 58.7370 32.5798 177.3024 57 R 4.3095 7.1334 115.5530 56.0479 30.8535 176.3369 58 G 4.0129 7.5759 106.7838 47.0457 0.0000 173.8153 59 D 4.1535 7.1384 117.6928 49.7559 41.1733 177.4104 60 L 3.9007 8.5781 123.8765 58.4956 41.8542 177.9563 61 H 4.1702 8.3481 118.2732 58.6903 29.7636 176.3522 62 A 3.9882 8.1471 121.9530 55.6837 18.1421 179.2260 63 R 4.3360 8.0253 116.4457 59.8681 30.0508 178.8308 64 R 4.0273 7.8935 117.2460 58.4257 30.3599 178.6627 65 L 4.2055 7.5069 119.6014 57.4735 41.8113 179.1194 66 V 3.6434 8.0349 118.1469 65.7787 31.1429 177.5141 67 L 4.3384 8.1384 120.4506 56.7387 42.0063 178.5269 68 R 4.1354 8.3654 117.8241 59.6465 30.0622 176.9741 69 D 4.7279 8.1492 118.0275 54.8091 41.0558 176.1237 70 L 4.0771 7.6187 118.4865 55.4274 42.2605 177.9736 71 Q 4.2695 8.6230 124.2350 56.4653 29.7808 174.6685 72 D 4.5604 7.8506 118.1948 54.0164 41.5670 176.5459 73 V 3.5619 8.5856 127.0123 66.0814 31.6719 177.6124 74 K 4.2214 8.1442 117.4482 57.7727 32.3695 177.1583 75 L 4.4020 7.5875 118.5439 57.5141 42.6232 178.2111 76 V 3.6958 7.9061 119.2647 65.7241 30.9271 177.6988 77 R 4.0178 8.5200 117.6687 58.5001 29.8020 179.0676 78 K 4.2839 7.5868 118.4039 60.0578 33.1658 177.2119 79 L 4.1198 8.1633 121.5823 56.2138 41.4622 178.4679 80 F 3.9966 7.7500 119.9752 59.6649 40.7250 176.6241 81 D 4.7600 8.8634 122.6979 49.7303 38.2968 175.9427 82 E 5.9022 7.8925 135.0000 58.4298 27.9228 178.1929 83 I 3.9287 7.4982 119.7147 63.8006 37.9544 178.4225 84 A 3.9537 8.4761 123.7379 54.6273 18.6493 177.6008 85 P 4.1889 0.0000 0.0000 66.0099 31.3714 178.4136 86 R 3.9842 7.0851 112.8963 57.8372 29.8396 176.5451 87 Y 4.9913 8.0027 114.5216 57.5525 39.9987 176.8480 88 R 3.8780 8.2312 122.4370 59.5828 30.1112 178.2291 89 D 4.9556 7.8652 115.3570 54.3444 41.2710 176.4283 90 R 4.6342 7.9741 118.6877 54.7372 32.9326 175.9415 91 Q 4.1678 8.6115 128.6612 54.5665 27.5280 175.0733 92 G 2.9523 7.7062 109.5186 44.8108 0.0000 170.5473 93 G 3.6201 7.5909 102.7084 47.0057 0.0000 174.0463 94 Y 4.2201 6.5942 109.9610 58.1311 38.9149 176.4465 95 T 5.0613 7.4793 112.6093 60.9050 70.8885 172.6604 96 R 4.7281 8.9879 126.1102 54.6607 34.0435 175.0566 97 V 5.3792 8.1005 122.2054 61.4014 33.8870 173.5704 98 L 4.7802 8.3599 128.3149 52.6635 44.1396 176.2373 99 K 4.4466 8.6723 123.5251 56.3937 32.9352 176.9534 100 L 4.5740 8.2434 124.0872 53.6934 43.6740 175.6091 101 A 4.4799 8.3228 122.5064 51.1942 21.0358 172.6781 102 E 3.6602 8.6389 126.6133 55.9616 28.9390 174.7891 103 R 4.5640 8.1786 119.6674 53.8611 32.7951 175.6433 104 R 3.8244 8.4057 119.6879 57.0923 30.9313 175.9002 105 R 4.2555 8.7125 127.2522 55.8130 29.5932 176.7108 106 G 4.9682 8.2249 122.5991 45.3820 0.0000 170.1960 107 D 4.5557 8.5013 120.9901 52.3943 41.1001 177.0228 108 G 3.7912 8.0385 106.8858 46.9172 0.0000 173.6739 109 A 4.7743 7.9302 120.7713 49.0871 21.7427 175.5898 110 P 4.4538 0.0000 0.0000 64.1573 32.4288 175.8255 111 L 4.8859 8.5349 121.6972 53.5502 45.0687 174.5450 112 A 5.1413 8.8062 121.2199 50.9782 23.6524 174.3760 113 L 4.8939 9.0690 120.0006 53.4433 45.1488 175.4270 114 V 4.8352 8.6813 126.3209 61.2773 33.5891 173.9237 115 E 5.0070 9.1725 128.7861 54.1535 33.5032 174.8393 116 L 4.6442 8.2179 122.5560 54.1660 41.9157 176.6602 117 V 3.4910 7.6750 123.2952 62.3925 32.5765 175.6859 118 E 4.3886 8.5914 126.7027 56.9222 29.3461 174.5983 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 2 R 8.25 4.22 0.00 1.79 1.97 0.00 3.20 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 3 H 8.27 4.67 0.00 3.26 3.22 0.00 5.74 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.55 3.82 0.00 1.84 1.77 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.79 4.04 0.00 1.80 1.86 0.00 1.80 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.47 7.81 6 S 7.96 4.56 0.00 3.85 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 7 G 8.52 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 0.00 0.00 0.00 8 R 8.85 3.33 0.00 1.92 2.17 0.00 3.41 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 9 K 8.35 3.88 0.00 1.87 1.86 0.00 1.63 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.79 1.53 7.81 10 L 7.87 4.15 0.00 1.58 1.56 0.91 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.63 4.66 0.00 2.65 2.71 0.00 0.00 7.26 7.65 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 12 R 10.64 3.69 0.00 1.83 1.60 0.00 3.08 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.42 0.00 13 H 7.38 5.02 0.00 3.32 3.40 0.00 5.68 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.26 3.57 0.00 4.06 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 15 S 8.08 4.03 0.00 4.07 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 H 8.41 3.80 0.00 2.85 3.22 0.00 5.71 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 17 R 8.47 3.67 0.00 1.87 1.91 0.00 3.10 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.14 0.00 18 L 7.98 3.61 0.00 1.78 1.69 0.94 1.36 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 19 A 8.76 3.90 1.31 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 0.00 0.00 0.00 20 L 8.79 3.83 0.00 1.77 1.84 0.96 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.96 4.11 0.00 2.53 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 22 R 7.81 4.15 0.00 2.14 2.07 0.00 3.17 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.75 0.00 23 N 8.47 4.48 0.00 2.77 2.88 0.00 0.00 7.11 7.71 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 24 Q 8.25 4.20 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 25 A 8.12 4.10 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.49 3.86 0.00 1.82 1.94 0.00 1.72 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.85 7.81 27 S 7.89 4.13 0.00 4.05 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 28 L 7.86 3.97 0.00 1.87 1.93 0.95 1.09 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 29 L 8.07 4.13 0.00 1.88 1.71 0.93 1.04 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 30 T 8.27 3.83 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 0.97 0.00 0.00 31 H 8.98 4.81 0.00 3.19 2.56 0.00 5.69 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 32 G 8.94 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 0.00 0.00 0.00 0.00 33 R 8.13 5.17 0.00 1.64 1.80 0.00 3.23 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 34 I 8.89 4.81 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.35 0.92 0.00 0.00 35 T 8.63 5.18 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 1.28 0.00 0.00 36 T 8.12 4.68 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 37 T 8.39 4.57 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 1.21 0.00 0.00 38 V 8.38 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 0.89 0.00 0.00 0.99 0.00 0.00 39 P 0.00 4.15 0.00 2.20 2.07 0.00 3.67 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 2.11 2.13 0.00 40 K 8.39 3.86 0.00 1.80 1.84 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.64 1.52 7.81 41 A 7.66 4.05 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 K 8.36 3.79 0.00 1.73 1.88 0.00 1.67 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.56 7.81 43 E 8.26 4.29 0.00 2.16 1.64 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 2.29 2.16 0.00 44 L 7.18 3.68 0.00 1.80 1.62 1.00 0.82 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 45 R 8.10 3.64 0.00 2.04 2.04 0.00 3.20 0.00 0.00 3.31 8.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.71 0.00 46 G 8.10 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 0.00 0.00 0.00 47 F 7.54 4.20 0.00 2.86 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.36 3.63 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 0.96 0.00 0.00 1.00 0.00 0.00 49 D 7.92 4.50 0.00 3.00 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 50 H 7.92 4.05 0.00 3.19 3.38 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 51 L 7.49 3.71 0.00 1.59 1.51 0.29 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.40 3.54 1.87 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.75 -0.11 0.00 0.00 53 H 8.65 3.72 0.00 3.33 3.31 0.00 5.58 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.91 3.99 0.00 1.69 1.55 0.89 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 55 A 7.51 3.05 0.48 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 56 K 7.10 3.92 0.00 1.57 1.83 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.96 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.27 1.44 7.81 57 R 7.13 4.31 0.00 2.27 1.92 0.00 3.21 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 1.68 1.73 0.00 58 G 7.58 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 59 D 7.14 4.15 0.00 3.00 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 60 L 8.58 3.90 0.00 1.67 1.68 0.89 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.35 4.17 0.00 3.28 3.26 0.00 5.96 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 62 A 8.15 3.99 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 0.00 0.00 0.00 0.00 0.00 63 R 8.03 4.34 0.00 1.76 2.06 0.00 2.85 0.00 0.00 3.07 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.54 0.00 64 R 7.89 4.03 0.00 1.96 2.00 0.00 3.22 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 65 L 7.51 4.21 0.00 1.78 1.67 0.70 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.03 3.64 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 0.87 0.00 0.00 0.80 0.00 0.00 67 L 8.14 4.34 0.00 1.97 1.79 1.02 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 68 R 8.37 4.14 0.00 1.93 2.00 0.00 3.22 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.97 0.00 69 D 8.15 4.73 0.00 2.67 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 70 L 7.62 4.08 0.00 1.72 1.64 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.62 4.27 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.98 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 72 D 7.85 4.56 0.00 2.76 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 73 V 8.59 3.56 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 0.91 0.00 0.00 0.94 0.00 0.00 74 K 8.14 4.22 0.00 1.76 1.95 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.43 7.81 75 L 7.59 4.40 0.00 2.01 1.80 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 76 V 7.91 3.70 2.25 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 0.87 0.00 0.00 1.13 0.00 0.00 77 R 8.52 4.02 0.00 1.90 1.96 0.00 3.17 0.00 0.00 3.27 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.87 0.00 78 K 7.59 4.28 0.00 1.84 1.94 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.56 7.81 79 L 8.16 4.12 0.00 1.67 1.54 0.63 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 80 F 7.75 4.00 0.00 3.11 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 81 D 8.86 4.76 0.00 2.75 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 E 7.89 5.90 0.00 2.06 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 0.00 2.04 2.03 0.00 83 I 7.50 3.93 1.98 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 1.45 0.98 1.00 0.00 0.00 84 A 8.48 3.95 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 85 P 0.00 4.19 0.00 2.12 2.10 0.00 3.61 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.18 0.00 86 R 7.09 3.98 0.00 0.92 1.43 0.00 2.94 0.00 0.00 3.11 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 87 Y 8.00 4.99 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 88 R 8.23 3.88 0.00 1.93 2.00 0.00 3.42 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 89 D 7.87 4.96 0.00 2.74 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 90 R 7.97 4.63 0.00 2.09 2.18 0.00 3.79 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 91 Q 8.61 4.17 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.52 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 92 G 7.71 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 0.00 0.00 0.00 93 G 7.59 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 6.59 4.22 0.00 2.70 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 0.00 0.00 0.00 0.00 95 T 7.48 5.06 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 1.22 0.00 0.00 96 R 8.99 4.73 0.00 1.88 1.71 0.00 3.12 0.00 0.00 3.09 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 97 V 8.10 5.38 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 0.97 0.00 0.00 0.91 0.00 0.00 98 L 8.36 4.78 0.00 1.62 1.54 0.92 0.96 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 99 K 8.67 4.45 0.00 1.64 1.73 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.46 7.81 100 L 8.24 4.57 0.00 1.55 1.61 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.32 4.48 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 0.00 102 E 8.64 3.66 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.28 0.00 103 R 8.18 4.56 0.00 1.95 1.93 0.00 3.04 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 104 R 8.41 3.82 0.00 2.04 2.04 0.00 3.08 0.00 0.00 3.17 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 105 R 8.71 4.26 0.00 1.73 1.89 0.00 3.38 0.00 0.00 3.23 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.89 0.00 106 G 8.22 4.97 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 0.00 107 D 8.50 4.56 0.00 2.75 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 0.00 108 G 8.04 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.93 4.77 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.45 0.00 2.12 2.22 0.00 3.67 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.02 0.00 111 L 8.53 4.89 0.00 1.60 1.61 0.92 1.02 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 0.00 112 A 8.81 5.14 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 0.00 113 L 9.07 4.89 0.00 1.68 1.61 0.97 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.68 4.84 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 0.97 0.00 0.00 0.92 0.00 0.00 115 E 9.17 5.01 0.00 2.04 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 2.22 2.27 0.00 116 L 8.22 4.64 0.00 1.70 1.78 0.99 0.93 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 0.00 117 V 7.67 3.49 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 0.84 0.00 0.00 0.97 0.00 0.00 118 E 8.59 4.39 0.00 2.12 1.78 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 2.22 2.36 0.00