NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 R 5.3475 7.6774 119.1829 55.9044 30.4071 174.2231 -1 G 3.5258 8.1612 109.4784 46.4568 0.0000 174.0424 0 S 4.5759 8.5470 114.8159 60.1638 65.3310 174.4075 1 M 4.0814 8.0275 120.2748 58.6267 32.0505 178.0504 2 A 4.1882 8.0748 120.4848 54.9447 18.6352 178.9219 3 L 3.6189 7.4342 116.1684 58.5281 42.1327 179.5576 4 K 4.0727 8.0797 117.9420 59.1846 32.0838 179.4459 5 R 3.9506 7.8240 118.8410 59.4793 29.9940 178.3135 6 I 3.2675 8.3481 120.2309 64.4556 36.5966 177.2736 7 H 4.5794 8.1080 116.6823 57.4158 29.5364 176.6369 8 K 4.1418 7.5260 120.6817 59.5606 32.4525 177.9098 9 E 4.5403 8.0216 120.5108 58.0990 29.4514 178.5027 10 L 4.3634 8.2335 121.1372 58.2216 42.2734 178.6638 11 N 4.3839 8.0267 115.9023 55.9469 36.9240 177.0058 12 D 4.4080 7.9416 121.4361 57.1270 40.7608 178.6213 13 L 4.1497 8.2233 118.8945 57.6477 41.6659 179.1666 14 A 4.1711 8.1576 120.3492 55.0272 18.5739 179.2219 15 R 4.1358 7.8742 114.6919 57.6185 31.5745 176.3859 16 D 4.6304 7.5234 115.3004 52.2664 41.5904 172.2590 17 P 4.3379 0.0000 0.0000 61.6936 31.6224 174.8081 18 P 4.2729 0.0000 0.0000 62.1222 31.9389 176.3975 19 A 3.9133 8.8465 125.0702 54.1784 18.9813 176.6243 20 Q 3.4587 8.7466 116.2785 56.9010 28.2356 172.4344 21 C 5.1120 8.0212 115.0213 58.2957 30.5211 173.2328 22 S 4.9262 8.9936 117.9777 56.6553 65.2302 172.7824 23 A 5.0934 8.0175 125.6731 51.5102 21.9876 175.5896 24 G 2.7833 8.6925 109.0523 44.1000 0.0000 170.8698 25 P 4.2870 0.0000 0.0000 62.8058 31.7830 177.2838 26 V 3.7405 8.2504 124.6951 60.4892 30.0436 176.0898 27 G 4.0863 8.6388 115.2340 44.2721 0.0000 171.7641 28 D 4.8046 8.7293 124.0013 53.5534 41.1595 174.4435 29 D 4.8540 7.9051 120.3047 52.8376 41.9419 176.7620 30 M 4.3130 8.8876 126.5861 57.7964 32.8242 176.5088 31 F 4.3752 8.9083 115.8732 58.1858 39.7141 174.0941 32 H 5.6726 8.5222 121.3073 54.5636 32.0812 172.5213 33 W 5.4579 9.7061 126.1581 54.9105 32.8761 174.8162 34 Q 5.1200 9.3720 118.2671 54.6096 31.6494 174.2304 35 A 5.1805 9.1468 122.3774 50.7822 23.1212 174.8685 36 T 5.0060 9.0577 118.1443 61.6581 72.1637 173.0107 37 I 4.7602 9.0506 126.4441 59.4181 41.0197 173.9405 38 M 4.8788 8.4040 129.6543 54.2787 32.4297 176.6389 39 G 4.1678 9.2449 111.9441 46.1166 0.0000 171.2480 40 P 4.5118 0.0000 0.0000 62.5601 32.2016 176.9968 41 N 4.4262 8.8449 118.9165 56.2058 39.0798 175.5538 42 D 5.0096 8.0631 116.4916 53.9659 41.7652 175.7843 43 S 4.9537 7.7930 113.0392 55.5000 65.9311 172.8352 44 P 4.3311 0.0000 0.0000 64.9228 31.2082 176.9233 45 Y 4.7890 7.6314 115.4125 56.9758 38.1193 175.2041 46 Q 4.3904 7.2741 121.2462 56.9718 29.4431 177.4156 47 G 4.0161 8.9580 110.9954 45.5611 0.0000 173.6905 48 G 4.1114 7.8780 107.5230 44.8891 0.0000 173.2359 49 V 4.7924 7.7852 121.3222 59.4484 33.6421 174.9144 50 F 4.8315 9.2471 123.9014 55.5667 42.1116 174.4244 51 F 5.4658 9.2041 122.4238 56.4052 41.2910 174.9579 52 L 5.1701 9.2043 120.9354 53.4670 46.3985 175.3382 53 T 4.8477 8.8355 119.0090 62.0396 71.0389 173.6944 54 I 4.8950 8.6699 126.1469 59.7941 41.1444 174.5000 55 H 5.4699 8.5604 122.3741 54.1064 32.3005 172.6860 56 F 4.3648 9.1153 123.7382 55.9531 39.5840 174.4907 57 P 4.5098 0.0000 0.0000 63.0874 31.6437 177.6712 58 T 4.7016 8.6118 114.5837 64.5461 68.0091 175.0233 59 D 4.9601 9.0481 118.3038 54.0353 42.9131 174.2660 60 Y 4.5083 8.4459 118.2065 57.9179 39.1259 174.0479 61 P 3.6851 0.0000 0.0000 62.3528 31.5503 176.9728 62 F 4.5092 7.8701 117.0213 59.1846 39.0373 175.5362 63 K 4.7055 7.8138 119.5921 53.4443 35.6078 174.3035 64 P 2.9700 0.0000 0.0000 60.9927 31.8607 174.3487 65 P 4.1805 0.0000 0.0000 62.4297 32.6948 176.0580 66 K 4.1305 8.7373 123.9006 55.7283 32.6040 175.1625 67 V 4.8592 8.0924 127.2122 60.9851 33.5068 174.5460 68 A 4.8163 8.5708 128.0541 50.2939 23.3617 174.8525 69 F 4.6173 9.2323 119.9654 57.7659 39.6844 176.7087 70 T 4.4569 9.3130 120.2651 64.7678 69.8985 175.2840 71 T 4.6785 8.2671 117.6196 62.0026 69.8296 175.2311 72 R 4.1040 8.6521 126.1507 56.5951 30.8392 175.3732 73 I 4.8829 8.0961 122.2479 60.2675 40.7432 174.0175 74 Y 3.6144 8.6317 127.8791 56.2118 37.3792 173.7201 75 H 4.7215 7.5196 124.4149 53.3107 33.2960 171.7763 76 P 4.2164 0.0000 0.0000 64.7192 31.7213 177.2056 77 N 4.9431 7.9641 115.9900 52.5149 38.9651 174.1275 78 I 5.3699 7.5677 119.2443 59.8785 39.9074 174.7637 79 N 4.7263 8.4368 125.7406 52.0001 39.2366 175.5238 80 S 4.2132 8.5929 111.4386 61.8478 63.2585 174.6665 81 N 4.4909 8.1309 115.7436 53.6071 38.6371 175.8274 82 G 4.3869 7.9882 107.0929 46.1053 0.0000 173.6255 83 S 4.4881 7.8832 116.2107 59.0602 64.0250 173.0967 84 I 4.7326 8.3391 124.4491 60.0203 38.8533 175.7434 85 C 4.4851 8.9255 129.2241 57.6180 30.6479 170.8004 86 L 4.7070 7.8372 123.6287 52.4409 44.6136 176.7106 87 D 4.4238 8.9379 126.4419 57.5208 40.8962 178.6649 88 I 3.8938 7.7322 117.8007 63.0855 38.1168 176.6493 89 L 4.5580 7.7796 118.2687 55.0533 42.0490 176.4526 90 R 4.6305 7.6066 120.0510 57.0043 36.9633 175.9841 91 S 4.3457 9.1020 113.0253 62.1210 63.5177 176.7339 92 Q 4.6448 8.2638 118.3621 55.9461 28.6167 175.7885 93 W 4.5455 7.6775 126.8434 56.3899 31.7255 175.3855 94 S 4.2214 6.1681 116.3566 55.8191 64.8064 173.2839 95 P 4.1522 0.0000 0.0000 64.5527 31.1033 177.2462 96 A 3.9772 7.0470 119.1355 52.8285 18.4578 177.3634 97 L 4.2792 6.8924 116.6178 53.8308 43.0915 176.3578 98 T 4.9152 7.7448 109.5371 59.2934 73.3743 174.7105 99 I 3.8397 8.4925 120.7416 63.6174 37.9848 178.1918 100 S 4.1598 7.9406 115.0156 61.7114 62.8872 176.7668 101 K 4.0484 7.7333 121.4186 58.5952 31.6875 179.6171 102 V 3.6387 7.9163 118.8687 65.7533 31.4290 178.1384 103 L 3.9396 8.0363 118.7856 57.7850 41.5461 179.2902 104 L 3.9875 7.8098 118.7687 58.0490 41.6725 179.6097 105 S 4.2091 8.2280 114.3646 60.8065 62.2621 176.3920 106 I 3.7367 7.6955 122.5157 64.6040 37.1231 178.0638 107 C 4.1087 8.5773 118.1718 62.8487 27.5639 176.4210 108 S 4.2720 8.2082 115.9145 61.1401 62.5677 176.2159 109 L 4.0160 7.5519 122.9704 57.9671 41.7984 178.7330 110 L 3.8472 7.6168 118.2756 57.5147 41.5349 178.6286 111 C 4.6452 7.4336 114.5892 60.8672 29.2694 173.6280 112 D 4.6652 8.3173 119.7313 51.6953 41.4044 172.7594 113 P 4.5002 0.0000 0.0000 62.3300 32.4121 177.4476 114 N 4.7897 8.0671 117.7103 50.6829 37.3996 173.9353 115 P 4.3792 0.0000 0.0000 64.3359 31.8052 178.0825 116 D 4.5636 7.9796 118.8302 56.1072 41.4035 176.1327 117 D 4.8727 7.8716 118.4676 50.5165 38.8038 172.4584 118 P 4.5621 0.0000 0.0000 63.1129 32.6109 177.0760 119 L 4.3125 9.0779 124.7460 55.7592 42.8628 176.8675 120 V 4.3117 7.0884 117.2513 59.0760 32.0504 172.8852 121 P 4.2136 0.0000 0.0000 65.3965 31.3491 177.1485 122 E 3.9478 8.1545 117.1807 59.4819 29.3145 178.8412 123 I 3.6932 7.6054 119.1096 64.1368 36.9515 178.0996 124 A 4.0286 7.5602 120.4772 55.1364 18.3188 179.1857 125 R 4.0006 8.0304 118.2170 59.1437 30.2974 178.4370 126 I 3.7514 7.9671 112.9842 64.1541 37.1430 177.4051 127 Y 4.0586 7.6738 120.7077 60.3697 38.6921 177.0251 128 K 3.9253 8.2795 119.0736 58.3953 32.4261 178.4559 129 T 4.3943 7.7592 107.9985 62.0574 71.4182 174.6596 130 D 4.7119 7.9497 120.4158 51.3285 41.7283 175.0319 131 R 3.8761 7.9835 123.4984 59.4500 30.3986 177.0764 132 E 3.9759 8.1957 117.7668 59.4858 29.4794 179.1635 133 K 4.0060 8.3062 119.0655 59.2151 32.1517 178.2838 134 Y 4.0686 8.0723 120.1564 60.8695 38.6796 177.9105 135 N 4.3853 8.8107 117.6979 56.2514 38.5241 177.4606 136 R 3.8460 7.6281 119.5820 59.3970 30.1955 179.0824 137 I 3.4023 7.4840 118.9558 64.1937 36.8825 178.1894 138 A 3.6286 7.4211 121.6016 55.3963 17.8336 180.0106 139 R 4.4243 7.7012 116.6090 58.5495 30.3697 178.6994 140 E 4.0521 8.2239 119.3596 59.2835 29.7826 178.8581 141 W 4.2376 8.8024 119.3576 60.3085 28.9808 178.6764 142 T 4.1985 8.0291 115.7529 66.4572 67.5942 176.4089 143 Q 3.9605 7.9663 121.0152 58.4539 29.2317 177.3995 144 K 3.9740 7.6471 117.2694 57.3843 32.4486 176.9657 145 Y 4.7103 7.7917 114.2044 58.1788 40.6058 176.1344 146 A 4.2608 7.9207 119.8971 51.9772 20.3995 176.1664 147 M 4.1040 7.8403 120.4873 55.4846 32.2199 175.5813 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 7.68 5.35 0.00 2.08 2.15 0.00 3.76 0.00 0.00 4.01 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.85 0.00 -1 G 8.16 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 0.00 0.00 0.00 0 S 8.55 4.58 0.00 3.93 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1 M 8.03 4.08 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.84 0.00 2 A 8.07 4.19 1.54 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 0.00 0.00 3 L 7.43 3.62 0.00 2.02 1.98 0.99 0.55 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 4 K 8.08 4.07 0.00 2.04 1.86 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.51 7.81 5 R 7.82 3.95 0.00 2.08 2.13 0.00 3.15 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.91 0.00 6 I 8.35 3.27 1.62 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.36 0.17 0.00 0.00 7 H 8.11 4.58 0.00 3.15 3.26 0.00 5.59 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.53 4.14 0.00 2.05 1.96 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.58 7.81 9 E 8.02 4.54 0.00 2.31 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 0.00 2.36 2.42 0.00 10 L 8.23 4.36 0.00 2.40 1.89 0.78 0.41 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 11 N 8.03 4.38 0.00 3.08 3.28 0.00 0.00 7.06 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 12 D 7.94 4.41 0.00 3.01 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 L 8.22 4.15 0.00 2.03 1.85 1.24 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.16 4.17 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 15 R 7.87 4.14 0.00 1.93 1.98 0.00 3.25 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 16 D 7.52 4.63 0.00 2.68 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 17 P 0.00 4.34 0.00 2.09 2.08 0.00 3.75 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.28 0.00 18 P 0.00 4.27 0.00 2.21 2.10 0.00 3.83 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 2.19 2.02 0.00 19 A 8.85 3.91 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 Q 8.75 3.46 0.00 2.36 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 21 C 8.02 5.11 0.00 2.89 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 22 S 8.99 4.93 0.00 3.87 3.71 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 23 A 8.02 5.09 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 24 G 8.69 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.29 0.00 1.91 1.75 0.00 2.74 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 26 V 8.25 3.74 1.90 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 0.67 0.00 0.00 0.81 0.00 0.00 27 G 8.64 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 28 D 8.73 4.80 0.00 2.62 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 29 D 7.91 4.85 0.00 2.75 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 30 M 8.89 4.31 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.55 0.00 31 F 8.91 4.38 0.00 3.25 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 32 H 8.52 5.67 0.00 3.43 3.32 0.00 5.73 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.71 5.46 0.00 3.32 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 34 Q 9.37 5.12 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.77 0.00 0.00 0.00 0.00 0.00 2.14 2.34 0.00 35 A 9.15 5.18 1.24 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 0.00 0.00 0.00 36 T 9.06 5.01 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 1.10 0.00 0.00 37 I 9.05 4.76 1.88 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.40 1.13 0.00 0.00 38 M 8.40 4.88 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.50 0.00 39 G 9.24 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 0.00 0.00 0.00 0.00 40 P 0.00 4.51 0.00 2.29 2.08 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.15 0.00 41 N 8.84 4.43 0.00 2.72 2.88 0.00 0.00 6.90 8.47 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 42 D 8.06 5.01 0.00 2.72 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 43 S 7.79 4.95 0.00 4.24 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 44 P 0.00 4.33 0.00 1.82 2.26 0.00 3.85 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 2.05 0.00 45 Y 7.63 4.79 0.00 3.24 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 46 Q 7.27 4.39 0.00 2.41 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.72 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 47 G 8.96 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 7.88 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 0.00 0.00 0.00 0.00 49 V 7.79 4.79 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 0.53 0.00 0.00 0.48 0.00 0.00 50 F 9.25 4.83 0.00 3.18 3.45 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 51 F 9.20 5.47 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 52 L 9.20 5.17 0.00 1.37 1.32 0.16 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.84 4.85 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 1.18 0.00 0.00 54 I 8.67 4.90 1.94 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 1.09 0.67 0.24 0.00 0.00 55 H 8.56 5.47 0.00 3.01 3.13 0.00 5.63 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 9.12 4.36 0.00 2.56 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 57 P 0.00 4.51 0.00 2.31 2.19 0.00 3.75 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 2.41 2.20 0.00 58 T 8.61 4.70 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 59 D 9.05 4.96 0.00 2.74 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 60 Y 8.45 4.51 0.00 3.18 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 61 P 0.00 3.69 0.00 1.81 1.34 0.00 3.33 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 1.48 0.00 62 F 7.87 4.51 0.00 3.55 3.25 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 63 K 7.81 4.71 0.00 1.75 1.62 0.00 1.78 0.00 0.00 1.81 0.00 0.00 3.05 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.70 7.81 64 P 0.00 2.97 0.00 1.60 0.71 0.00 3.49 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 65 P 0.00 4.18 0.00 1.37 1.16 0.00 2.69 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 66 K 8.74 4.13 0.00 1.89 1.71 0.00 1.38 0.00 0.00 1.51 0.00 0.00 2.82 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.38 7.81 67 V 8.09 4.86 1.97 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 0.70 0.00 0.00 0.73 0.00 0.00 68 A 8.57 4.82 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 69 F 9.23 4.62 0.00 3.24 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 70 T 9.31 4.46 4.55 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 1.30 0.00 0.00 71 T 8.27 4.68 4.75 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 1.39 0.00 0.00 72 R 8.65 4.10 0.00 1.42 1.31 0.00 2.21 0.00 0.00 2.62 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.46 0.00 73 I 8.10 4.88 1.77 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.96 0.33 0.00 0.00 74 Y 8.63 3.61 0.00 1.72 2.43 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 75 H 7.52 4.72 0.00 2.83 2.86 0.00 5.98 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.22 0.00 2.07 2.16 0.00 2.96 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.46 0.00 77 N 7.96 4.94 0.00 2.80 2.81 0.00 0.00 6.93 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 78 I 7.57 5.37 1.66 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.73 0.79 0.00 0.00 79 N 8.44 4.73 0.00 2.90 2.98 0.00 0.00 5.95 7.37 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 80 S 8.59 4.21 0.00 4.03 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 81 N 8.13 4.49 0.00 2.76 2.92 0.00 0.00 7.04 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 82 G 7.99 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 0.00 0.00 0.00 0.00 83 S 7.88 4.49 0.00 3.94 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 84 I 8.34 4.73 1.89 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.81 0.95 0.00 0.00 85 C 8.93 4.49 0.00 2.95 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 86 L 7.84 4.71 0.00 1.71 1.47 0.92 1.23 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 87 D 8.94 4.42 0.00 2.84 2.74 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 88 I 7.73 3.89 1.92 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.98 1.01 0.00 0.00 89 L 7.78 4.56 0.00 1.95 1.63 0.89 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 90 R 7.61 4.63 0.00 1.72 1.65 0.00 3.25 0.00 0.00 3.23 7.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 91 S 9.10 4.35 0.00 4.09 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 92 Q 8.26 4.64 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.02 6.94 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 93 W 7.68 4.55 0.00 3.48 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 6.17 4.22 0.00 3.57 3.19 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 95 P 0.00 4.15 0.00 1.76 1.50 0.00 3.55 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 96 A 7.05 3.98 1.08 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 97 L 6.89 4.28 0.00 0.49 1.21 0.56 0.44 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 98 T 7.74 4.92 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 1.20 0.00 0.00 99 I 8.49 3.84 1.85 0.00 0.00 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 1.68 1.18 0.99 0.00 0.00 100 S 7.94 4.16 0.00 4.16 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 7.73 4.05 0.00 2.03 1.90 0.00 1.61 0.00 0.00 1.54 0.00 0.00 2.87 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.46 1.44 7.81 102 V 7.92 3.64 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 1.21 0.00 0.00 103 L 8.04 3.94 0.00 1.97 1.72 1.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.81 3.99 0.00 1.90 1.74 0.94 0.87 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 0.00 105 S 8.23 4.21 0.00 3.98 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 0.00 106 I 7.70 3.74 1.97 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 1.52 0.69 0.92 0.00 0.00 107 C 8.58 4.11 0.00 3.06 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 0.00 108 S 8.21 4.27 0.00 4.07 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 L 7.55 4.02 0.00 1.78 1.88 0.92 0.96 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 0.00 110 L 7.62 3.85 0.00 1.73 1.44 -0.47 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.43 4.65 0.00 3.16 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 0.00 112 D 8.32 4.67 0.00 2.53 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 0.00 113 P 0.00 4.50 0.00 1.65 1.69 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.15 0.00 114 N 8.07 4.79 0.00 2.87 2.76 0.00 0.00 6.57 8.03 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 0.00 115 P 0.00 4.38 0.00 2.31 2.51 0.00 3.85 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 2.09 2.33 0.00 116 D 7.98 4.56 0.00 2.69 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 D 7.87 4.87 0.00 2.69 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 0.00 118 P 0.00 4.56 0.00 2.17 2.06 0.00 3.78 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 1.97 1.93 0.00 119 L 9.08 4.31 0.00 1.51 1.79 0.91 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.09 4.31 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 0.88 0.00 0.00 0.91 0.00 0.00 121 P 0.00 4.21 0.00 2.18 2.11 0.00 3.64 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 122 E 8.15 3.95 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.51 0.00 123 I 7.61 3.69 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 0.79 0.27 0.31 0.00 0.00 124 A 7.56 4.03 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 0.00 125 R 8.03 4.00 0.00 1.94 2.09 0.00 3.14 0.00 0.00 3.25 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 126 I 7.97 3.75 2.03 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.93 1.03 0.00 0.00 127 Y 7.67 4.06 0.00 2.96 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 0.00 128 K 8.28 3.93 0.00 1.84 1.79 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.44 1.71 7.81 129 T 7.76 4.39 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 1.20 0.00 0.00 130 D 7.95 4.71 0.00 2.66 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 0.00 131 R 7.98 3.88 0.00 1.73 1.83 0.00 2.80 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.23 0.00 132 E 8.20 3.98 0.00 2.10 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 2.40 2.44 0.00 133 K 8.31 4.01 0.00 2.09 2.00 0.00 1.69 0.00 0.00 1.55 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.60 7.81 134 Y 8.07 4.07 0.00 3.36 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 N 8.81 4.39 0.00 2.98 2.89 0.00 0.00 7.07 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 R 7.63 3.85 0.00 1.98 1.91 0.00 3.11 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 137 I 7.48 3.40 0.81 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.54 -0.53 0.00 0.00 138 A 7.42 3.63 0.76 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 0.00 139 R 7.70 4.42 0.00 1.95 1.96 0.00 3.10 0.00 0.00 2.98 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.55 0.00 140 E 8.22 4.05 0.00 2.08 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 0.00 2.36 2.33 0.00 141 W 8.80 4.24 0.00 3.56 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 T 8.03 4.20 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 1.41 0.00 0.00 143 Q 7.97 3.96 0.00 2.01 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.91 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 144 K 7.65 3.97 0.00 0.79 0.81 0.00 1.48 0.00 0.00 1.56 0.00 0.00 3.09 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.02 1.29 7.81 145 Y 7.79 4.71 0.00 3.15 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 0.00 146 A 7.92 4.26 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 M 7.84 4.10 0.00 2.02 2.10 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.50 0.00