NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 36 M 4.3944 8.3049 120.3220 55.8274 33.4925 175.2755 37 H 4.8087 8.2968 122.9391 54.3109 29.5877 172.4767 38 T 3.8972 8.6156 116.5616 64.2807 70.0359 173.0265 39 L 4.5210 8.5062 124.8929 53.0430 43.7467 175.6403 40 Y 4.8177 7.9665 119.4736 55.8335 40.0413 175.0319 41 A 4.1620 9.3832 127.6198 51.3884 18.5333 175.4620 42 P 4.4393 0.0000 0.0000 64.7206 31.5091 176.7642 43 G 3.7551 8.8884 111.4365 44.3313 0.0000 173.8234 44 G 3.7815 7.7301 107.5371 45.0579 0.0000 172.2414 45 Y 4.4251 7.9367 115.1467 56.2115 40.3367 176.9531 46 D 4.3636 7.8909 122.5798 53.2516 37.9997 177.2042 47 I 3.5997 7.0290 124.9678 64.8143 37.6674 178.1781 48 M 4.1072 7.8145 118.9397 58.3810 31.8182 178.7957 49 G 3.6593 7.8927 107.1343 47.5111 0.0000 175.3286 50 Y 4.5088 7.9212 119.1630 60.8406 37.8395 178.3663 51 L 4.1615 8.2161 120.2182 57.7607 41.7239 179.6191 52 I 3.7275 8.0066 119.8703 64.3982 36.8594 178.0585 53 Q 4.0460 8.2173 119.3758 59.3952 29.2629 178.4026 54 I 3.9404 8.1784 120.8558 64.8458 37.0297 178.4716 55 M 4.1921 8.1430 117.7957 57.5532 31.8223 177.4972 56 N 4.7600 7.9037 114.6504 51.8241 39.5432 175.4613 57 R 4.0726 7.2285 118.2172 55.4874 30.1362 174.9676 58 P 4.3707 0.0000 0.0000 65.7722 31.7138 176.8857 59 N 4.9491 7.6554 116.2102 49.8331 38.0293 171.9729 60 P 4.3676 0.0000 0.0000 62.9620 32.3164 177.5137 61 Q 4.3003 8.9284 121.4579 56.5767 29.4856 176.2042 62 V 4.4037 7.5652 116.3247 60.7521 34.3846 174.1493 63 E 4.3365 8.8030 126.5302 55.5894 30.1502 175.7876 64 L 4.1818 8.5737 125.1731 54.0817 43.6529 176.9946 65 G 3.9001 8.0000 105.3596 43.4854 0.0000 170.7302 66 P 4.3822 0.0000 0.0000 62.8272 31.7009 176.1837 67 V 4.5882 7.9886 113.4399 59.9434 35.8579 174.5441 68 D 4.7166 8.1120 119.6769 52.8792 41.6431 175.4343 69 T 4.2700 8.5010 108.1073 63.2174 69.0771 175.4058 70 S 4.3062 9.0883 117.7790 60.3553 63.4895 174.1985 71 C 4.5045 7.3846 115.0560 56.6030 31.2662 172.6091 72 A 4.6662 8.4795 122.1328 51.7593 18.9625 176.5843 73 L 5.0184 8.8906 121.8994 55.1059 44.4107 174.8588 74 V 4.7575 8.2811 111.9285 59.6512 36.7081 173.9460 75 L 4.9712 8.8293 124.6582 53.5345 44.8864 175.0417 76 C 5.2632 8.9559 123.4511 57.9968 32.0417 172.5173 77 D 4.9526 8.8280 122.2215 52.9910 41.3591 177.3718 78 L 4.0826 8.6902 127.1947 56.8844 41.8563 178.2357 79 K 4.4796 8.2250 117.0407 55.8640 32.4738 175.9353 80 Q 4.6138 7.4852 117.6027 53.1483 32.1569 174.5856 81 K 3.8465 8.6685 120.6817 58.3039 32.1798 175.6642 82 D 4.2382 8.8073 125.1270 56.4326 39.9510 173.4292 83 T 4.2946 7.8540 105.9782 61.0004 66.0116 169.7304 84 P 4.7425 0.0000 0.0000 62.3752 33.7938 177.4991 85 V 4.0923 8.7664 122.5560 63.3807 32.1704 176.5583 86 V 4.7378 8.6438 119.9722 61.3679 33.2766 175.0815 87 Y 4.5960 7.3606 120.3604 56.4020 42.1702 172.7662 88 A 4.9137 7.3964 127.4012 49.8968 22.1868 175.9381 89 S 4.3306 9.0531 117.6949 57.9172 64.4591 175.3600 90 E 4.0082 9.0815 120.4291 59.7973 29.1230 179.6072 91 A 4.2066 8.1056 120.2462 54.9013 18.4736 179.3875 92 F 4.0995 8.1578 118.9016 61.5887 39.5245 177.3986 93 L 4.0107 8.1621 118.1795 57.9240 41.2003 178.8427 94 Y 4.2702 7.9204 118.7448 60.8643 38.8533 177.1418 95 M 3.7060 7.8914 118.3750 58.5660 32.6381 177.7814 96 T 4.0550 7.7806 109.2905 62.0063 69.1726 176.4872 97 G 3.7964 8.0833 108.9187 45.3747 0.0000 172.7940 98 Y 4.6547 7.4688 117.8566 56.5730 39.7449 175.3733 99 S 4.6681 9.0880 117.5353 56.9258 65.0723 175.1427 100 N 4.3007 8.6939 117.6268 56.3936 38.3982 177.7035 101 A 4.0474 7.4712 119.6556 54.7227 18.5531 178.2514 102 E 4.2035 7.8989 113.9170 57.7422 30.5165 177.7585 103 V 3.9702 7.6423 111.3549 62.5667 33.2157 176.2952 104 L 4.2908 7.4705 118.6647 56.5688 41.7314 177.8864 105 G 4.2086 9.4798 110.7578 46.4529 0.0000 173.0954 106 R 4.6578 7.6040 119.2937 53.9498 32.6605 174.4747 107 N 4.8007 8.4847 121.5289 53.2984 39.9891 175.7696 108 C 4.1966 8.7320 122.3872 61.7736 28.1100 176.0419 109 R 4.0062 8.6380 118.8435 58.5044 28.9477 178.4647 110 F 4.2447 7.8289 114.4675 59.8703 37.5715 176.9689 111 L 4.2402 6.9413 118.4274 56.6267 41.1380 178.1562 112 Q 4.4309 8.0105 117.1090 55.7822 29.4132 175.5533 113 S 4.6520 7.5365 115.0121 55.4177 65.5396 172.7782 114 P 4.2006 0.0000 0.0000 64.8107 31.1115 176.5193 115 D 4.6759 7.6947 116.7393 52.2943 39.5889 176.6084 116 G 4.4449 8.4059 107.0147 45.6770 0.0000 173.8233 117 M 4.4779 8.5487 119.4915 53.1758 32.4111 175.8716 118 V 4.3057 8.0697 123.0754 60.6981 33.9851 175.1745 119 K 4.3140 8.4477 127.1823 54.9417 32.9473 175.1226 120 P 4.4092 0.0000 0.0000 64.1039 31.6752 177.3427 121 K 4.0152 8.7994 119.3758 56.6396 30.2961 176.7330 122 S 4.2424 7.6437 113.3451 58.2428 63.5408 174.2425 123 T 4.2654 8.1299 118.8686 62.2057 68.1572 175.3078 124 R 4.0198 8.4385 126.5551 56.2151 30.5810 177.1821 125 K 4.1529 8.2641 119.7793 57.4121 33.3783 176.5091 126 Y 4.9327 7.6751 114.8528 57.4926 39.5314 175.2010 127 V 4.4255 7.5079 119.2601 60.0594 34.5465 174.9169 128 D 4.3830 8.6482 125.4686 54.6634 41.9587 177.2334 129 S 4.1304 8.7695 123.5373 61.8562 62.8745 176.1829 130 N 4.3119 8.5261 119.6700 56.7274 38.6398 177.1669 131 T 3.8448 8.0596 116.7753 66.7485 68.6145 176.4580 132 I 3.7038 7.6322 121.5200 64.4816 37.0466 178.0926 133 N 4.2970 8.4217 117.9241 56.7828 38.7089 177.1481 134 T 3.8515 8.1084 117.6348 66.7555 68.4742 176.5810 135 M 3.9888 8.0550 120.5597 58.3007 32.0326 178.5352 136 R 3.8544 8.1039 119.0033 59.7098 30.3379 178.7201 137 K 3.9886 8.3129 117.9336 59.1400 31.9110 179.3101 138 A 3.9491 7.9829 121.1775 55.2056 18.4511 179.7128 139 I 3.5622 7.8672 118.3970 64.7479 36.9791 178.4787 140 D 4.4013 7.8791 118.2790 56.6839 40.6808 178.0624 141 R 4.3311 7.6128 115.3146 54.7040 30.9103 175.7028 142 N 3.8477 7.6562 114.5824 54.3160 36.6488 173.7647 143 A 4.7353 7.7454 118.4049 49.8001 21.2165 177.9505 144 E 4.4100 8.6966 121.7466 56.9062 30.4396 176.7013 145 V 4.5541 8.2995 120.5557 60.7867 35.3632 172.6838 146 Q 4.8453 8.4596 122.2092 54.7581 31.8761 174.2615 147 V 4.7020 9.0635 118.5000 60.0641 37.1194 173.6271 148 E 5.3227 8.8495 121.4143 54.7720 31.4202 176.1501 149 V 4.4763 8.8081 124.4721 59.5191 35.0047 175.1118 150 V 3.9259 8.2942 123.5939 62.9847 32.2622 174.5553 151 N 5.0938 8.1762 124.0641 51.4356 43.4620 173.0052 152 F 5.4648 9.0917 117.9937 55.9003 42.8675 175.6892 153 K 4.4835 9.4043 122.8549 55.5663 33.1013 177.9411 154 K 3.3763 8.8715 122.8864 58.7833 31.7969 177.2269 155 N 4.5130 7.9034 112.5677 53.0037 37.2709 175.7369 156 G 3.9520 8.5392 107.8503 45.2516 0.0000 173.6369 157 Q 4.1673 7.8294 122.2993 55.9825 29.9607 175.2540 158 R 4.3825 8.7713 127.5534 56.4656 31.1283 175.1097 159 F 4.8275 8.2723 118.4404 55.9487 41.8030 172.9077 160 V 4.2521 8.3638 120.4638 61.6693 32.5136 174.4029 161 N 5.0197 8.9332 128.2946 52.4286 40.3588 173.7038 162 F 5.1650 9.5179 130.6780 57.2887 39.4704 173.8429 163 L 4.7941 8.8623 129.0803 53.5587 44.1534 174.9876 164 T 4.9936 8.5034 122.3139 61.9572 72.0149 172.7645 165 M 5.3182 9.0372 125.5793 53.5535 35.6383 174.6951 166 I 4.9683 8.7449 123.9804 58.5435 40.7683 173.5068 167 P 4.7490 0.0000 0.0000 62.8572 32.2417 175.7931 168 V 4.5798 9.1101 121.0573 61.3236 34.8243 174.4433 169 R 4.7955 8.6726 126.4094 55.4755 31.4900 176.3420 170 D 5.1127 8.0798 123.1840 52.2653 41.9658 176.5891 171 E 4.0463 8.9382 117.5364 59.6692 29.4990 178.2104 172 T 3.9953 8.1420 108.1652 62.6170 69.1860 175.8906 173 G 3.8951 8.4233 110.5607 45.1019 0.0000 172.8950 174 E 4.4844 7.5211 118.8235 53.9030 31.8859 175.1068 175 Y 4.4527 8.1688 119.1972 59.0196 38.4434 176.2661 176 R 4.3410 9.1312 123.6914 56.3905 33.4184 174.0088 177 Y 5.3213 7.6626 114.3209 56.0215 43.0215 174.1826 178 S 4.9239 8.8147 113.7940 56.9494 66.0700 171.9875 179 M 4.7543 9.2283 127.3190 53.7105 34.3685 174.4746 180 G 4.2914 8.6240 113.4115 44.3269 0.0000 172.0309 181 F 5.3642 9.2835 122.7185 55.7037 41.6123 174.4290 182 Q 5.0209 8.6871 122.9875 54.8963 30.7094 175.3026 183 C 4.7606 8.9371 121.9279 57.7234 35.1493 173.6562 184 E 4.3598 8.9674 125.9538 56.5860 29.3041 175.9981 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 36 M 8.30 4.39 0.00 1.95 2.00 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 2.45 2.66 0.00 37 H 8.30 4.81 0.00 3.18 3.23 0.00 5.99 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.62 3.90 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 0.95 0.00 0.00 39 L 8.51 4.52 0.00 1.50 1.51 0.93 1.00 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 40 Y 7.97 4.82 0.00 3.14 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 9.38 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.44 0.00 2.18 2.10 0.00 3.72 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 43 G 8.89 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 44 G 7.73 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 0.00 0.00 0.00 45 Y 7.94 4.43 0.00 2.76 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 46 D 7.89 4.36 0.00 2.44 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 47 I 7.03 3.60 1.55 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 -0.36 0.75 0.00 0.00 48 M 7.81 4.11 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.57 0.00 49 G 7.89 3.66 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 0.00 50 Y 7.92 4.51 0.00 3.10 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 51 L 8.22 4.16 0.00 1.92 1.80 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.01 3.73 2.08 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 1.43 1.05 0.94 0.00 0.00 53 Q 8.22 4.05 0.00 2.24 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 54 I 8.18 3.94 2.14 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.19 0.95 0.00 0.00 55 M 8.14 4.19 0.00 2.00 2.15 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.56 0.00 56 N 7.90 4.76 0.00 2.85 2.86 0.00 0.00 7.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 R 7.23 4.07 0.00 2.00 2.12 0.00 3.16 0.00 0.00 3.42 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.60 0.00 58 P 0.00 4.37 0.00 2.21 2.24 0.00 3.75 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.01 0.00 59 N 7.66 4.95 0.00 2.72 2.80 0.00 0.00 6.91 8.02 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 60 P 0.00 4.37 0.00 2.17 2.07 0.00 3.85 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 1.99 1.99 0.00 61 Q 8.93 4.30 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.62 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 62 V 7.57 4.40 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 0.84 0.00 0.00 0.93 0.00 0.00 63 E 8.80 4.34 0.00 1.99 1.87 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 2.29 2.35 0.00 64 L 8.57 4.18 0.00 1.41 1.49 0.65 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.00 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 0.00 0.00 0.00 66 P 0.00 4.38 0.00 2.19 2.07 0.00 3.70 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 1.98 1.99 0.00 67 V 7.99 4.59 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 0.44 0.00 0.00 0.85 0.00 0.00 68 D 8.11 4.72 0.00 2.89 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 69 T 8.50 4.27 4.33 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 0.00 0.00 0.00 1.24 0.00 0.00 70 S 9.09 4.31 0.00 4.01 4.08 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 71 C 7.38 4.50 0.00 3.37 3.10 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 72 A 8.48 4.67 1.47 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 73 L 8.89 5.02 0.00 1.38 1.54 0.95 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.28 4.76 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 0.63 0.00 0.00 75 L 8.83 4.97 0.00 1.55 1.24 0.77 0.45 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 76 C 8.96 5.26 0.00 2.85 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 D 8.83 4.95 0.00 2.88 2.60 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 0.00 0.00 0.00 78 L 8.69 4.08 0.00 1.70 1.66 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 79 K 8.22 4.48 0.00 1.75 1.75 0.00 1.47 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.38 7.81 80 Q 7.49 4.61 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.96 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 81 K 8.67 3.85 0.00 1.68 1.76 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.53 7.81 82 D 8.81 4.24 0.00 2.82 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 7.85 4.29 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 1.20 0.00 0.00 84 P 0.00 4.74 0.00 2.19 2.17 0.00 3.98 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 2.08 1.94 0.00 85 V 8.77 4.09 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 0.93 0.00 0.00 0.94 0.00 0.00 86 V 8.64 4.74 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 0.88 0.00 0.00 0.27 0.00 0.00 87 Y 7.36 4.60 0.00 2.83 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 88 A 7.40 4.91 1.09 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 89 S 9.05 4.33 0.00 4.04 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 90 E 9.08 4.01 0.00 2.08 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 0.00 2.41 2.42 0.00 91 A 8.11 4.21 1.48 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 92 F 8.16 4.10 0.00 3.29 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 L 8.16 4.01 0.00 1.95 1.96 0.95 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 7.92 4.27 0.00 2.95 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 95 M 7.89 3.71 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.07 0.00 96 T 7.78 4.05 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.57 0.00 0.00 97 G 8.08 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 98 Y 7.47 4.65 0.00 3.16 2.89 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 99 S 9.09 4.67 0.00 3.99 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 0.00 100 N 8.69 4.30 0.00 2.74 2.85 0.00 0.00 6.69 7.67 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 0.00 101 A 7.47 4.05 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 E 7.90 4.20 0.00 2.23 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 2.35 2.32 0.00 103 V 7.64 3.97 2.35 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 1.22 0.00 0.00 1.13 0.00 0.00 104 L 7.47 4.29 0.00 1.69 1.57 0.91 0.70 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 0.00 105 G 9.48 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 R 7.60 4.66 0.00 1.97 1.87 0.00 2.61 0.00 0.00 2.93 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 107 N 8.48 4.80 0.00 3.05 2.71 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 0.00 108 C 8.73 4.20 0.00 2.93 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 0.00 109 R 8.64 4.01 0.00 2.18 2.27 0.00 2.98 0.00 0.00 3.24 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.70 0.00 110 F 7.83 4.24 0.00 3.50 3.34 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 0.00 111 L 6.94 4.24 0.00 1.53 1.77 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 8.01 4.43 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.61 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 113 S 7.54 4.65 0.00 3.86 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 0.00 114 P 0.00 4.20 0.00 1.98 1.40 0.00 3.51 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 1.75 1.27 0.00 115 D 7.69 4.68 0.00 2.84 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 0.00 116 G 8.41 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.55 4.48 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.83 0.00 118 V 8.07 4.31 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 0.87 0.00 0.00 1.07 0.00 0.00 119 K 8.45 4.31 0.00 1.83 1.71 0.00 1.76 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.53 1.41 7.81 120 P 0.00 4.41 0.00 2.04 2.00 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 121 K 8.80 4.02 0.00 1.92 1.98 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.35 7.81 122 S 7.64 4.24 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 0.00 123 T 8.13 4.27 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 1.18 0.00 0.00 124 R 8.44 4.02 0.00 1.78 1.96 0.00 3.25 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 125 K 8.26 4.15 0.00 1.39 1.64 0.00 1.32 0.00 0.00 1.48 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.34 0.43 7.81 126 Y 7.68 4.93 0.00 3.23 3.24 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 0.00 127 V 7.51 4.43 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 0.82 0.00 0.00 1.08 0.00 0.00 128 D 8.65 4.38 0.00 2.75 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 0.00 129 S 8.77 4.13 0.00 3.90 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 0.00 130 N 8.53 4.31 0.00 2.84 2.98 0.00 0.00 7.22 6.81 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 0.00 131 T 8.06 3.84 4.43 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 1.26 0.00 0.00 132 I 7.63 3.70 1.98 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 1.40 0.83 0.91 0.00 0.00 133 N 8.42 4.30 0.00 2.91 2.93 0.00 0.00 7.24 6.76 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 0.00 134 T 8.11 3.85 4.41 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 0.00 0.00 1.21 0.00 0.00 135 M 8.05 3.99 0.00 2.05 2.21 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.52 0.00 136 R 8.10 3.85 0.00 1.92 2.10 0.00 3.08 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 137 K 8.31 3.99 0.00 1.82 1.82 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.63 7.81 138 A 7.98 3.95 1.42 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 0.00 0.00 139 I 7.87 3.56 1.96 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 1.47 1.06 0.86 0.00 0.00 140 D 7.88 4.40 0.00 2.79 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 0.00 141 R 7.61 4.33 0.00 1.76 1.91 0.00 3.37 0.00 0.00 3.20 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.74 0.00 142 N 7.66 3.85 0.00 2.66 2.06 0.00 0.00 6.72 6.88 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 0.00 143 A 7.75 4.74 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 0.00 0.00 0.00 0.00 0.00 144 E 8.70 4.41 0.00 1.85 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 145 V 8.30 4.55 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.92 0.00 0.00 146 Q 8.46 4.85 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.84 0.00 0.00 0.00 0.00 0.00 1.83 2.01 0.00 147 V 9.06 4.70 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 0.69 0.00 0.00 0.92 0.00 0.00 148 E 8.85 5.32 0.00 1.86 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 2.39 2.39 0.00 149 V 8.81 4.48 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.87 0.00 0.00 150 V 8.29 3.93 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 0.34 0.00 0.00 0.84 0.00 0.00 151 N 8.18 5.09 0.00 1.44 2.26 0.00 0.00 6.41 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 0.00 152 F 9.09 5.46 0.00 3.09 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 0.00 153 K 9.40 4.48 0.00 1.68 1.75 0.00 1.51 0.00 0.00 1.35 0.00 0.00 2.19 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.21 1.46 7.81 154 K 8.87 3.38 0.00 0.79 1.36 0.00 1.47 0.00 0.00 1.46 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.21 0.92 7.81 155 N 7.90 4.51 0.00 2.83 2.83 0.00 0.00 6.18 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 G 8.54 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 Q 7.83 4.17 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.05 0.00 0.00 0.00 0.00 0.00 2.47 2.37 0.00 158 R 8.77 4.38 0.00 1.94 1.80 0.00 3.32 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 1.40 1.03 0.00 159 F 8.27 4.83 0.00 3.04 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 V 8.36 4.25 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 0.80 0.00 0.00 0.87 0.00 0.00 161 N 8.93 5.02 0.00 2.60 2.66 0.00 0.00 6.35 7.75 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 0.00 162 F 9.52 5.17 0.00 2.94 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 0.00 163 L 8.86 4.79 0.00 1.91 1.46 nan 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 164 T 8.50 4.99 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 0.00 165 M 9.04 5.32 0.00 1.88 1.89 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.43 0.00 166 I 8.74 4.97 2.03 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 1.44 1.18 0.97 0.00 0.00 167 P 0.00 4.75 0.00 1.00 1.58 0.00 3.63 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.68 0.00 168 V 9.11 4.58 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 0.28 0.00 0.00 0.97 0.00 0.00 169 R 8.67 4.80 0.00 1.68 1.72 0.00 3.10 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.25 0.00 170 D 8.08 5.11 0.00 3.09 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 0.00 171 E 8.94 4.05 0.00 2.04 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 0.00 2.41 2.30 0.00 172 T 8.14 4.00 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 1.25 0.00 0.00 173 G 8.42 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 0.00 0.00 0.00 174 E 7.52 4.48 0.00 1.94 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 2.16 2.18 0.00 175 Y 8.17 4.45 0.00 2.97 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 R 9.13 4.34 0.00 1.69 1.49 0.00 2.75 0.00 0.00 2.94 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.50 0.00 177 Y 7.66 5.32 0.00 2.76 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 0.00 178 S 8.81 4.92 0.00 3.82 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 0.00 179 M 9.23 4.75 0.00 2.04 1.80 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.35 0.00 180 G 8.62 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 0.00 0.00 0.00 0.00 181 F 9.28 5.36 0.00 2.84 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 0.00 182 Q 8.69 5.02 0.00 2.18 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.62 0.00 0.00 0.00 0.00 0.00 2.65 2.48 0.00 183 C 8.94 4.76 0.00 3.13 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 E 8.97 4.36 0.00 1.87 1.77 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 2.31 1.92 0.00