NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 18 E 4.2200 8.4449 121.4647 55.8081 31.9513 175.1440 19 L 4.0956 7.6184 119.5375 52.3239 42.9740 176.8396 20 S 4.4373 8.9963 120.3386 57.5848 66.6276 174.0178 21 E 3.8179 8.5531 120.4688 59.7756 29.4290 178.7863 22 A 3.9899 7.8504 120.2625 55.0982 18.6049 179.3068 23 E 3.8118 7.8795 116.8774 59.4227 29.5368 179.2172 24 R 3.7301 7.7227 118.4657 59.6103 30.0282 178.4377 25 K 3.9676 7.9172 118.7925 59.1050 32.2762 178.7865 26 A 3.9893 8.1482 121.4991 54.9104 18.3110 179.7523 27 V 3.2986 7.4923 116.5527 66.2323 31.5374 178.3677 28 Q 4.0447 8.0310 117.5565 58.8091 28.0578 178.5828 29 A 4.0172 8.1850 121.9100 55.4356 18.4220 179.4359 30 M 3.7625 8.0517 116.4882 58.3253 32.2812 178.1633 31 W 4.3711 8.9576 128.8952 60.5391 30.3618 177.7870 32 A 4.1288 8.2823 120.7954 55.2229 17.5676 179.8854 33 R 4.0170 7.5803 115.2045 59.2258 30.4621 178.9167 34 L 4.1732 8.2666 118.9048 58.1765 41.5311 179.0621 35 Y 3.7062 7.9049 117.3481 59.7049 38.7104 177.2280 36 A 4.2023 7.5879 120.4653 54.0367 19.7767 176.9804 37 N 4.9269 8.0697 114.6935 50.4866 37.4478 175.6250 38 S 3.7938 7.5800 116.3513 62.1070 63.0187 176.2887 39 E 3.8323 7.7724 120.4498 59.2945 29.5946 178.7332 40 D 4.2347 7.8489 119.8213 56.7264 40.9347 178.5455 41 V 3.5819 7.7988 118.8412 66.0763 31.6250 178.2724 42 G 3.5921 8.1052 105.2593 48.0338 0.0000 176.1107 43 V 3.6811 7.6495 114.7713 63.7119 31.4675 178.5599 44 A 3.9429 7.9401 120.6861 55.1320 18.2368 179.5042 45 I 3.6249 7.8632 118.4082 64.8388 37.2056 178.7376 46 L 3.9659 7.7434 119.1756 57.4253 41.4281 179.6586 47 V 3.6329 8.4025 118.6899 66.0702 31.5088 177.9965 48 R 3.9117 8.1579 118.4590 59.3329 29.9082 178.1063 49 F 4.4452 8.3290 120.3391 61.7059 39.0140 177.2070 50 F 4.3106 8.4076 117.4370 60.0227 38.4649 178.1553 51 V 3.6676 8.1784 118.1123 65.7986 31.4968 177.2189 52 N 4.4409 7.9448 113.6814 53.3799 40.2492 175.6411 53 F 4.8195 7.8363 119.1263 53.7944 39.8632 173.3229 54 P 4.5756 0.0000 0.0000 65.0167 31.3623 178.4577 55 S 4.1444 8.4433 113.6182 61.7658 62.1181 176.3636 56 A 3.6948 8.2568 123.8641 53.9400 18.1532 178.8272 57 K 4.0115 8.0962 116.5850 58.1420 32.7402 178.8700 58 Q 3.8578 7.6814 119.1558 59.2030 28.4030 177.2545 59 Y 4.5518 7.0328 116.0221 57.4373 38.4596 175.1565 60 F 4.3881 7.5459 120.0376 55.0359 39.7968 175.7878 61 S 4.0491 8.7301 121.4968 61.4856 62.5220 176.2521 62 Q 4.2658 7.9067 118.0354 57.3272 29.1150 176.4187 63 F 5.0271 7.4383 111.3942 56.0023 38.8142 176.5802 64 K 3.8808 7.7066 122.7690 60.1296 32.1524 177.2673 65 H 4.8240 7.9291 113.8459 55.4095 29.2199 173.6254 66 M 4.3568 7.9485 120.3410 55.3079 32.7740 175.3207 67 E 4.4249 8.6569 123.8363 57.5826 32.2100 176.5185 68 D 4.3300 8.0688 118.8915 53.9991 41.9989 174.9961 69 P 4.2783 0.0000 0.0000 66.0244 31.0083 178.3970 70 L 4.0111 7.8722 117.9123 57.3309 41.6299 178.5464 71 E 4.1043 8.0368 118.9802 59.1386 29.8749 178.2809 72 M 3.8334 7.9126 118.8390 58.4153 31.8091 178.3920 73 E 3.9308 7.9266 118.0803 58.7095 29.8570 178.0638 74 R 4.3691 7.2941 115.4269 55.0918 30.8364 176.0745 75 S 4.3857 7.3180 115.6829 56.8553 63.1919 172.6947 76 P 4.2697 0.0000 0.0000 65.9608 31.1417 178.3920 77 Q 4.1197 8.1752 117.7288 58.9545 28.9935 177.9040 78 L 3.7769 7.7266 121.5253 58.3121 42.1432 179.3142 79 R 3.9318 8.0839 117.9449 58.8751 29.8381 179.0939 80 K 4.0042 8.5330 120.1696 59.7758 32.1855 178.4283 81 H 4.2086 8.5219 118.4002 59.1737 29.7866 177.0880 82 A 4.0607 8.3307 122.7892 55.2385 18.2356 179.5631 83 S 4.0825 8.2131 111.6758 61.6846 62.4839 176.6600 84 R 4.0627 8.3895 120.9753 58.9259 29.8031 179.2782 85 V 3.6742 8.2286 118.4574 66.4024 31.6625 177.9731 86 M 4.6111 8.4592 118.6573 58.5383 31.7694 179.0846 87 G 3.7945 8.5889 105.7169 47.6657 0.0000 175.7096 88 A 4.0023 8.1182 123.2696 55.0991 18.5084 179.7984 89 L 3.8093 8.0921 117.4138 57.6641 41.5483 179.3432 90 N 4.1020 8.4499 117.1589 56.9199 38.8490 176.8619 91 T 3.7941 7.8419 117.0813 66.6425 68.3332 176.6455 92 V 3.3867 7.3212 118.4456 65.9173 31.5254 177.8663 93 V 3.3658 7.5492 118.1990 66.0643 31.0743 177.9375 94 E 3.9942 7.9276 116.6450 58.2066 29.5180 177.3318 95 N 5.0553 7.6498 116.2549 52.7895 39.2260 176.7442 96 L 4.0351 7.4085 120.0199 57.3030 41.7611 178.2509 97 H 4.4011 8.1335 112.6517 56.5493 29.1005 174.9495 98 D 4.6311 7.5110 120.6452 50.8868 41.1353 173.8870 99 P 4.2077 0.0000 0.0000 64.9969 31.5171 177.5121 100 D 4.4077 7.9249 117.5061 56.7298 40.9210 178.5223 101 K 4.0169 7.9798 120.3674 59.1099 32.1514 179.4393 102 V 3.5730 7.5857 112.6215 64.2799 31.5801 178.3690 103 S 4.2344 7.9645 115.1054 61.6813 62.7015 177.0177 104 S 4.1215 7.9199 116.4564 61.3162 62.8803 176.6542 105 V 3.5606 7.6516 121.5978 65.7712 31.3337 177.9445 106 L 4.0819 8.0795 117.9302 56.8896 41.3895 179.1486 107 A 4.0248 7.8025 121.2375 54.7238 18.5991 179.3875 108 L 3.8925 7.8848 117.5518 57.9499 41.6908 180.0855 109 V 3.6677 7.6934 117.6041 65.8995 31.5012 178.0252 110 G 3.6251 7.9443 105.3841 47.9377 0.0000 175.4788 111 K 3.7373 8.1580 121.4675 58.8291 32.1168 179.1918 112 A 4.0132 7.9894 120.8369 55.7646 18.3130 179.5085 113 H 4.1890 8.5540 114.3997 58.6094 28.6317 178.0800 114 A 3.5469 7.9690 123.0575 54.6328 17.9288 179.1690 115 L 4.1998 7.6809 115.4675 56.8782 42.5651 178.6309 116 K 4.0672 7.9194 116.6520 59.4004 32.0086 177.9373 117 H 4.6454 8.1034 111.9779 54.5606 30.3869 174.3155 118 K 4.5595 7.9692 116.9179 56.2244 29.4545 175.2606 119 V 3.4891 7.7584 117.3309 61.0736 32.8157 175.2833 120 E 4.1429 9.2046 127.5925 55.7313 30.1630 176.4951 121 P 3.9234 0.0000 0.0000 65.3918 31.6839 178.9236 122 V 3.8395 7.6765 120.3772 64.3613 31.0982 177.7151 123 Y 4.2196 7.9041 116.7526 60.5962 37.5456 178.7000 124 F 3.9200 8.3544 119.1790 60.2927 39.0731 177.1579 125 K 3.3890 8.1907 118.7065 59.7035 31.9367 178.6307 126 I 3.5190 7.5629 119.7896 64.0840 36.9013 178.2602 127 L 3.2428 7.9213 121.3833 57.9319 41.7533 179.1150 128 S 4.2073 8.1920 115.3899 61.5687 62.7316 176.9346 129 G 3.5847 8.0609 108.4187 47.7150 0.0000 175.9576 130 V 3.6495 7.6901 120.1288 65.7118 31.4894 178.0305 131 I 3.6702 7.8399 119.6768 64.5191 37.0492 178.0135 132 L 3.8314 8.0814 121.0190 58.0813 41.8259 178.5663 133 E 3.8462 8.0451 119.1910 59.3571 29.5193 179.1144 134 V 3.5074 7.7919 118.1689 65.8467 31.5538 178.1225 135 V 3.4953 7.9590 118.2031 65.8525 31.3549 177.8669 136 A 2.6310 7.6156 120.4298 54.5921 17.8821 179.4767 137 E 3.8613 7.6536 116.0369 59.6982 29.6557 179.2317 138 E 3.8341 8.0034 117.2935 58.0143 29.8461 177.8175 139 F 4.7762 8.0442 117.8458 56.3879 39.8230 177.5009 140 A 3.9890 8.0247 124.7748 54.5485 18.3234 179.3610 141 S 4.7191 7.9790 108.9273 58.7887 63.1728 173.8134 142 D 4.8923 8.3772 120.7691 54.0838 41.7590 175.0486 143 F 4.9690 8.1978 114.7685 56.1535 39.8032 172.5480 144 P 4.5362 0.0000 0.0000 61.8046 33.7436 174.8477 145 P 4.1469 0.0000 0.0000 65.9879 31.1996 178.1759 146 E 3.8671 8.2061 117.1719 59.9093 29.5180 179.0163 147 T 3.9015 7.6786 114.9588 66.5418 68.6037 176.5039 148 Q 3.6415 7.6718 119.9825 59.0026 28.6868 179.4696 149 R 3.8985 8.2384 118.8740 59.0779 30.1409 178.7234 150 A 3.9145 7.9417 120.5499 55.2323 18.2884 179.8254 151 W 3.8828 8.2061 116.8191 59.7144 29.1340 178.6795 152 A 4.0924 8.3330 120.8401 55.2167 17.8421 179.9014 153 K 3.9514 8.2781 117.0777 59.2493 32.0518 179.4188 154 L 3.8147 7.8214 120.7261 58.0297 42.1244 178.8847 155 R 4.0366 8.3082 118.9442 59.6425 30.0350 178.7829 156 G 3.6762 8.2999 105.4125 47.5293 0.0000 175.5359 157 L 3.9991 8.1068 122.6910 57.9255 42.1002 178.9030 158 I 3.6210 7.8606 119.8978 64.7634 36.5677 177.8177 159 Y 4.1333 7.9655 119.6786 60.5559 38.5764 177.7933 160 S 4.0397 8.1337 116.1967 62.1821 63.0396 176.5384 161 H 4.1144 8.1923 118.5777 58.7743 28.5015 178.1845 162 V 3.4426 7.6705 120.1872 65.8794 31.2426 178.3103 163 T 3.4699 7.8038 115.7028 66.4409 68.1897 176.3489 164 A 3.9265 8.4166 122.7173 55.2053 17.9444 179.5700 165 A 3.8860 7.9358 119.1400 55.4442 18.4416 179.4024 166 Y 3.8428 7.9751 114.9980 61.1475 38.0236 179.1730 167 K 4.0861 8.1867 119.4027 59.5035 31.9850 179.0025 168 E 3.9920 8.3071 118.8197 58.5861 29.5562 178.2788 169 V 4.2090 7.3880 116.3792 61.2872 32.1804 176.6200 170 G 4.0680 7.7644 108.0090 45.3623 0.0000 173.5071 171 W 4.2074 8.2764 134.9265 57.3026 30.6916 175.8704 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 18 E 8.44 4.22 0.00 1.90 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 2.16 2.37 0.00 19 L 7.62 4.10 0.00 1.68 1.51 0.82 0.42 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 20 S 9.00 4.44 0.00 4.02 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 21 E 8.55 3.82 0.00 2.07 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 2.35 2.41 0.00 22 A 7.85 3.99 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 23 E 7.88 3.81 0.00 1.95 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 24 R 7.72 3.73 0.00 2.06 2.04 0.00 3.00 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 25 K 7.92 3.97 0.00 2.05 1.85 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.43 7.81 26 A 8.15 3.99 1.39 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 27 V 7.49 3.30 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 0.28 0.00 0.00 0.23 0.00 0.00 28 Q 8.03 4.04 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 29 A 8.18 4.02 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 30 M 8.05 3.76 0.00 2.36 2.11 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.48 0.00 31 W 8.96 4.37 0.00 3.58 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.28 4.13 1.45 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 0.00 0.00 33 R 7.58 4.02 0.00 2.35 2.33 0.00 3.39 0.00 0.00 3.57 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.91 0.00 34 L 8.27 4.17 0.00 1.63 1.37 1.07 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 35 Y 7.90 3.71 0.00 2.36 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 36 A 7.59 4.20 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 N 8.07 4.93 0.00 2.74 2.84 0.00 0.00 6.53 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 S 7.58 3.79 0.00 3.32 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 39 E 7.77 3.83 0.00 2.12 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 0.00 2.27 2.28 0.00 40 D 7.85 4.23 0.00 2.63 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 41 V 7.80 3.58 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 1.03 0.00 0.00 0.87 0.00 0.00 42 G 8.11 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 0.00 0.00 0.00 43 V 7.65 3.68 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 0.78 0.00 0.00 0.89 0.00 0.00 44 A 7.94 3.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.86 3.62 2.03 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.78 0.85 0.00 0.00 46 L 7.74 3.97 0.00 1.75 1.83 1.01 0.46 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 47 V 8.40 3.63 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 0.96 0.00 0.00 0.96 0.00 0.00 48 R 8.16 3.91 0.00 2.01 2.12 0.00 3.18 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 49 F 8.33 4.45 0.00 3.02 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 50 F 8.41 4.31 0.00 3.16 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 51 V 8.18 3.67 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 0.80 0.00 0.00 1.00 0.00 0.00 52 N 7.94 4.44 0.00 2.55 2.16 0.00 0.00 6.85 7.26 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 53 F 7.84 4.82 0.00 2.80 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 54 P 0.00 4.58 0.00 2.29 2.34 0.00 3.86 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.88 0.00 55 S 8.44 4.14 0.00 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 0.00 56 A 8.26 3.69 1.23 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 0.00 0.00 57 K 8.10 4.01 0.00 1.78 2.17 0.00 1.49 0.00 0.00 1.79 0.00 0.00 3.19 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.56 1.48 7.81 58 Q 7.68 3.86 0.00 1.97 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 6.92 0.00 0.00 0.00 0.00 0.00 1.39 1.24 0.00 59 Y 7.03 4.55 0.00 2.37 2.57 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 0.00 0.00 0.00 0.00 60 F 7.55 4.39 0.00 1.67 1.72 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 61 S 8.73 4.05 0.00 3.95 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Q 7.91 4.27 0.00 2.23 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.43 0.00 0.00 0.00 0.00 0.00 2.43 2.36 0.00 63 F 7.44 5.03 0.00 2.96 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 64 K 7.71 3.88 0.00 1.62 1.99 0.00 1.40 0.00 0.00 1.55 0.00 0.00 2.80 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.26 0.90 7.81 65 H 7.93 4.82 0.00 3.16 3.31 0.00 5.69 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 M 7.95 4.36 0.00 2.04 2.12 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 2.63 2.50 0.00 67 E 8.66 4.42 0.00 1.96 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 2.20 2.26 0.00 68 D 8.07 4.33 0.00 2.78 2.57 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 0.00 0.00 0.00 0.00 69 P 0.00 4.28 0.00 2.28 2.28 0.00 3.73 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.04 0.00 70 L 7.87 4.01 0.00 1.92 1.75 0.95 0.82 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 71 E 8.04 4.10 0.00 2.06 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 2.37 2.44 0.00 72 M 7.91 3.83 0.00 1.97 2.15 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.30 0.00 73 E 7.93 3.93 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.31 0.00 74 R 7.29 4.37 0.00 1.87 1.92 0.00 3.19 0.00 0.00 3.26 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 75 S 7.32 4.39 0.00 3.84 3.72 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 76 P 0.00 4.27 0.00 2.24 2.12 0.00 3.68 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 2.14 2.16 0.00 77 Q 8.18 4.12 0.00 2.28 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.87 2.67 0.00 78 L 7.73 3.78 0.00 0.74 1.52 0.84 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 79 R 8.08 3.93 0.00 2.02 1.96 0.00 3.34 0.00 0.00 3.07 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 80 K 8.53 4.00 0.00 1.92 2.10 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.51 7.81 81 H 8.52 4.21 0.00 3.66 3.51 0.00 5.64 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 82 A 8.33 4.06 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 0.00 0.00 83 S 8.21 4.08 0.00 3.94 4.14 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 84 R 8.39 4.06 0.00 2.03 2.00 0.00 3.40 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.83 0.00 85 V 8.23 3.67 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 1.25 0.00 0.00 86 M 8.46 4.61 0.00 2.26 2.29 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.89 0.00 87 G 8.59 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 88 A 8.12 4.00 1.45 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 0.00 0.00 89 L 8.09 3.81 0.00 1.82 1.41 1.04 0.34 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 90 N 8.45 4.10 0.00 3.40 3.15 0.00 0.00 7.11 6.56 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 91 T 7.84 3.79 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 1.18 0.00 0.00 92 V 7.32 3.39 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 0.61 0.00 0.00 0.88 0.00 0.00 93 V 7.55 3.37 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 0.00 0.00 0.60 0.00 0.00 0.02 0.00 0.00 94 E 7.93 3.99 0.00 1.98 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 2.56 2.44 0.00 95 N 7.65 5.06 0.00 2.81 2.69 0.00 0.00 6.88 8.09 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 96 L 7.41 4.04 0.00 1.54 1.62 0.68 0.78 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 97 H 8.13 4.40 0.00 3.24 3.36 0.00 5.46 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 D 7.51 4.63 0.00 2.40 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 99 P 0.00 4.21 0.00 2.16 2.05 0.00 3.58 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.13 0.00 100 D 7.92 4.41 0.00 2.65 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 0.00 101 K 7.98 4.02 0.00 1.94 1.73 0.00 1.49 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.48 7.81 102 V 7.59 3.57 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 0.84 0.00 0.00 0.76 0.00 0.00 103 S 7.96 4.23 0.00 4.02 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 0.00 104 S 7.92 4.12 0.00 4.05 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 0.00 105 V 7.65 3.56 2.03 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 1.00 0.00 0.00 0.96 0.00 0.00 106 L 8.08 4.08 0.00 1.78 1.64 0.78 0.44 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 0.00 107 A 7.80 4.02 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.88 3.89 0.00 2.04 1.75 0.91 0.72 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 0.00 109 V 7.69 3.67 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 1.02 0.00 0.00 1.04 0.00 0.00 110 G 7.94 3.63 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 0.00 0.00 0.00 111 K 8.16 3.74 0.00 1.80 1.83 0.00 1.65 0.00 0.00 1.62 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.39 1.62 7.81 112 A 7.99 4.01 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 H 8.55 4.19 0.00 3.66 3.69 0.00 5.82 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 0.00 114 A 7.97 3.55 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.68 4.20 0.00 1.69 1.72 0.91 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 116 K 7.92 4.07 0.00 1.93 1.50 0.00 1.62 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.39 7.81 117 H 8.10 4.65 0.00 2.93 3.15 0.00 5.85 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.97 4.56 0.00 2.10 2.18 0.00 1.89 0.00 0.00 0.97 0.00 0.00 3.00 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.68 1.47 7.81 119 V 7.76 3.49 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 0.59 0.00 0.00 0.16 0.00 0.00 120 E 9.20 4.14 0.00 2.46 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.87 0.00 121 P 0.00 3.92 0.00 1.75 0.93 0.00 3.56 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.15 0.00 122 V 7.68 3.84 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 0.71 0.00 0.00 0.85 0.00 0.00 123 Y 7.90 4.22 0.00 3.22 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 0.00 124 F 8.35 3.92 0.00 3.53 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 8.19 3.39 0.00 0.90 1.81 0.00 1.36 0.00 0.00 1.24 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.27 1.20 7.81 126 I 7.56 3.52 1.96 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.79 -0.14 0.00 0.00 127 L 7.92 3.24 0.00 0.80 1.42 0.05 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 128 S 8.19 4.21 0.00 4.09 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 0.00 129 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 0.00 130 V 7.69 3.65 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 1.11 0.00 0.00 1.28 0.00 0.00 131 I 7.84 3.67 2.09 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 1.45 0.65 1.07 0.00 0.00 132 L 8.08 3.83 0.00 1.89 1.68 1.03 0.97 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 0.00 133 E 8.05 3.85 0.00 2.24 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 0.00 134 V 7.79 3.51 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 0.95 0.00 0.00 0.96 0.00 0.00 135 V 7.96 3.50 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.19 0.00 0.00 0.60 0.00 0.00 136 A 7.62 2.63 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 E 7.65 3.86 0.00 2.00 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 0.00 2.26 2.35 0.00 138 E 8.00 3.83 0.00 1.67 1.25 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 2.32 2.31 0.00 139 F 8.04 4.78 0.00 3.01 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 0.00 140 A 8.02 3.99 1.25 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 0.00 0.00 141 S 7.98 4.72 0.00 3.90 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 0.00 142 D 8.38 4.89 0.00 2.73 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 0.00 143 F 8.20 4.97 0.00 3.17 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 0.00 144 P 0.00 4.54 0.00 2.29 2.18 0.00 3.88 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 2.04 2.06 0.00 145 P 0.00 4.15 0.00 2.15 2.15 0.00 3.60 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 2.12 2.17 0.00 146 E 8.21 3.87 0.00 2.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 147 T 7.68 3.90 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 1.30 0.00 0.00 148 Q 7.67 3.64 0.00 2.16 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.36 1.69 0.00 149 R 8.24 3.90 0.00 2.00 1.95 0.00 3.13 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 1.64 1.79 0.00 150 A 7.94 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 0.00 151 W 8.21 3.88 0.00 3.54 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 0.00 152 A 8.33 4.09 1.44 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 0.00 153 K 8.28 3.95 0.00 1.88 1.83 0.00 1.64 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.62 7.81 154 L 7.82 3.81 0.00 1.57 1.69 0.71 0.25 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 0.00 155 R 8.31 4.04 0.00 2.14 2.17 0.00 3.31 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 156 G 8.30 3.68 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 0.00 0.00 0.00 157 L 8.11 4.00 0.00 1.74 1.93 0.82 0.69 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 0.00 158 I 7.86 3.62 2.08 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.32 0.99 0.00 0.00 159 Y 7.97 4.13 0.00 3.13 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 0.00 160 S 8.13 4.04 0.00 4.11 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 H 8.19 4.11 0.00 3.12 3.29 0.00 5.63 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 V 7.67 3.44 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 0.04 0.00 0.00 0.57 0.00 0.00 163 T 7.80 3.47 4.12 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 1.01 0.00 0.00 164 A 8.42 3.93 1.25 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 0.00 0.00 165 A 7.94 3.89 1.33 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 0.00 0.00 0.00 166 Y 7.98 3.84 0.00 2.98 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 0.00 167 K 8.19 4.09 0.00 2.02 1.88 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.57 7.81 168 E 8.31 3.99 0.00 2.07 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 0.00 2.31 2.31 0.00 169 V 7.39 4.21 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 0.82 0.00 0.00 0.90 0.00 0.00 170 G 7.76 4.07 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 0.00 0.00 0.00 171 W 8.28 4.21 0.00 3.60 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