NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 L 4.1305 8.1849 122.4797 54.0080 43.1241 176.6086 9 P 4.2129 0.0000 0.0000 61.0018 32.0427 175.6866 10 I 3.6280 7.9283 119.7968 63.9416 38.8804 175.7274 11 H 3.2999 7.3546 113.3392 54.4091 28.4227 174.7246 12 A 4.1494 7.1233 123.5315 52.0108 18.9754 177.8348 13 C 3.9878 9.0830 122.6640 60.1652 31.8160 174.9832 14 S 4.3533 8.4092 123.0330 60.5073 62.6924 174.7440 15 Y 4.9147 8.0090 117.7355 59.7116 38.7127 176.1901 16 C 4.6554 8.4851 112.6381 57.5270 31.7228 175.2946 17 G 4.1210 8.1830 107.2309 44.7948 0.0000 173.5645 18 I 3.7474 7.7595 121.4597 61.8585 37.4949 175.8887 19 H 4.8624 8.1979 118.4889 54.8532 29.4061 172.6411 20 D 4.3185 8.0002 120.4794 54.2318 41.1037 175.0387 21 P 3.9100 0.0000 0.0000 65.4236 31.6833 177.5401 22 A 4.1585 8.3054 120.2348 54.0623 18.6491 178.0680 23 C 4.9903 8.3238 112.7790 59.1957 30.0588 174.2520 24 V 4.9202 7.7479 111.2522 59.8504 33.7851 175.4958 25 V 4.5294 9.1346 122.1980 61.4401 34.9727 173.4653 26 Y 3.7951 8.3519 129.0076 56.2644 40.3851 173.6049 27 C 4.2746 7.9942 127.9276 57.9959 32.0885 173.3785 28 N 4.1824 8.4002 125.3106 57.2164 38.2483 177.3540 29 T 3.9364 7.9794 113.9580 66.5205 68.6752 175.6751 30 S 4.3741 7.8026 111.8075 57.3707 63.8146 173.6317 31 K 3.5432 7.5573 118.9500 56.8329 29.9153 175.0843 32 K 4.5725 6.9474 114.9907 54.4421 37.0343 175.9512 33 W 5.1976 8.2760 121.1293 55.6477 31.8083 175.3760 34 F 5.1264 9.1293 120.8410 56.1635 43.5114 174.2323 35 C 4.8958 8.9746 117.7180 57.4169 32.0112 172.5104 36 N 5.1412 8.9090 116.1398 53.7807 39.0119 174.6833 37 G 4.3252 8.1548 103.8343 44.2898 0.0000 175.1845 38 R 4.7593 8.1681 115.3505 54.2666 31.8048 178.1842 39 G 4.0916 7.5594 107.2090 47.3469 0.0000 173.7456 40 N 4.7103 9.0193 121.5718 53.0120 38.4488 174.0971 41 T 4.6596 7.9448 109.3028 59.7372 71.2570 174.3891 42 S 4.3940 8.5762 115.4144 58.9798 63.8365 173.9406 43 G 4.2233 7.6978 109.6145 43.0315 0.0000 172.4402 44 S 4.5599 8.4193 114.2079 57.9656 64.0948 175.5331 45 H 4.6223 8.9863 118.6359 59.3467 28.3624 178.1748 46 I 3.5642 7.8000 121.1273 64.5188 36.9842 178.6456 47 V 3.6044 7.6136 117.5300 65.9622 31.2729 177.6216 48 N 4.3697 8.6580 116.6462 56.7153 38.4418 176.5421 49 H 4.0744 8.5293 119.5718 59.5509 29.7764 177.0394 50 L 4.0085 8.7340 121.7025 57.8124 40.9953 180.0019 51 V 3.5266 8.0428 117.9805 65.9315 31.3855 178.3771 52 R 3.8475 8.0730 116.3224 59.3862 29.9298 178.1870 53 A 4.0673 8.1288 118.1805 52.4864 18.9314 176.8839 54 K 3.7613 7.3734 113.4195 57.9825 29.4486 174.8396 55 C 5.0073 8.2895 115.0513 58.1571 31.5248 174.7549 56 K 4.7313 8.3776 116.5802 56.1108 35.2639 176.0251 57 E 5.1460 8.0718 117.8136 54.6634 31.8591 175.6768 58 V 5.0173 8.1645 115.1439 60.1383 37.0434 174.1501 59 T 4.8890 8.6827 117.2965 62.0489 72.7149 173.8931 60 L 4.8377 8.9015 125.4064 53.5919 44.2316 175.9899 61 H 4.7454 8.8261 120.3980 55.7144 30.8174 175.9817 62 K 3.8575 8.5098 126.1544 59.6797 31.9002 177.7646 63 D 4.6775 8.2094 114.8554 54.4247 41.0869 176.5645 64 G 3.9268 7.7173 109.5314 44.1541 0.0000 172.5793 65 P 4.2462 0.0000 0.0000 65.5186 31.1182 177.7443 66 L 4.4317 7.9638 113.7464 53.6531 41.9173 178.0039 67 G 4.0616 7.5316 109.3820 43.9713 0.0000 174.1387 68 E 5.0321 8.4215 118.7322 55.7155 28.4136 175.4149 69 T 4.6587 8.1108 121.2389 61.0924 71.9873 172.9821 70 V 4.3390 8.3548 126.4254 62.0137 32.4232 175.3470 71 L 4.3930 8.1134 128.2880 54.8562 41.7164 176.3356 72 E 4.9171 8.5038 120.7679 54.9621 32.9168 174.4182 73 C 4.5005 9.1323 122.3325 59.2142 32.0941 173.8487 74 Y 3.9402 8.8480 129.2831 60.8582 38.6154 177.2234 75 N 4.4807 8.3596 117.2938 56.1879 39.2951 175.1080 76 C 4.5923 7.9263 109.8327 57.0774 30.6799 175.1549 77 G 3.8287 8.4837 108.5709 45.7824 0.0000 173.7161 78 C 4.1906 7.5188 120.6476 59.7341 31.9014 174.0094 79 R 4.5610 8.3500 123.5350 55.6868 31.1412 175.3137 80 N 4.5030 8.0318 117.9190 53.6845 38.4308 175.4892 81 V 3.7221 8.6272 127.0925 65.2153 31.7835 177.5995 82 F 4.2705 8.5023 117.1969 58.9749 39.2782 175.5660 83 L 4.7456 7.9198 121.9607 55.6669 44.4351 176.5013 84 L 4.9364 7.7116 119.6202 54.9799 43.0401 176.4975 85 G 3.7630 9.2937 108.6640 44.9752 0.0000 171.0377 86 F 5.6632 8.6470 114.5149 54.9092 41.3858 174.5621 87 I 4.5701 8.9065 121.4323 58.8157 40.1431 173.3517 88 P 4.9968 0.0000 0.0000 62.5775 32.2792 176.0950 89 A 3.8758 8.3025 123.6043 51.0979 19.7133 177.1671 90 K 3.9054 8.0588 119.2361 56.4430 32.4347 178.1535 91 A 3.6408 8.3386 129.2756 51.8700 16.0064 176.5869 92 D 4.2522 7.1763 115.2634 53.5811 44.8527 176.1930 93 S 4.4589 8.6091 125.2258 58.2495 63.0121 174.5042 94 V 4.4339 7.3711 119.6448 61.9876 34.8019 174.7158 95 V 5.1199 8.6201 127.4981 61.2356 33.8357 174.9253 96 V 4.5570 8.6830 125.3023 59.8642 34.7825 174.0792 97 L 5.3234 8.5056 122.4997 53.4068 43.9236 175.4084 98 L 5.1522 9.2163 122.8196 52.8457 46.8953 175.6334 99 C 4.5102 8.8058 119.1907 60.1257 28.7143 174.6435 100 R 2.6223 8.6112 124.2726 58.6781 29.6905 176.9119 101 Q 4.4225 7.4486 113.8597 53.7258 32.5784 172.8467 102 P 4.5988 0.0000 0.0000 63.0524 32.1802 177.3503 103 C 4.0698 7.9694 116.9118 62.3016 28.2451 173.9727 104 A 4.5797 7.5303 120.8693 51.7413 18.9782 176.5395 105 S 4.3858 7.5047 114.2573 58.8801 63.3978 175.3898 106 Q 4.1492 8.6621 125.1626 58.9146 28.7802 179.1021 107 S 4.1975 8.0031 112.2064 60.8279 62.4234 174.8156 108 S 4.5910 8.2029 114.0888 58.3473 63.1687 173.7012 109 L 4.8377 7.1914 118.6366 52.4453 44.5402 176.2512 110 K 4.3512 8.6686 120.5969 55.7836 31.2224 177.5243 111 D 4.4285 9.0971 124.9658 57.5897 40.9590 179.1388 112 I 3.8493 7.8348 117.2682 63.0086 38.3648 175.6308 113 N 4.4750 7.7365 115.1590 52.6026 40.7651 173.5244 114 W 4.8970 8.2173 117.9684 54.7214 31.2030 174.3447 115 D 4.7692 8.6767 123.8821 52.4584 41.1612 176.7936 116 S 4.2471 8.7614 122.4211 61.3317 62.6987 176.3265 117 S 4.2213 8.0820 115.4824 61.3405 62.5654 174.9658 118 Q 4.1598 8.0176 119.2132 56.5235 29.0595 175.6764 119 W 4.3921 7.5490 127.3456 58.2393 31.5206 175.2233 120 Q 4.2992 6.7777 122.9883 53.5879 32.7438 172.3700 121 P 3.9231 0.0000 0.0000 62.4505 31.7106 176.8083 122 L 3.9531 8.6701 122.4049 56.6857 41.8887 177.1341 123 I 4.4280 7.3230 119.0937 59.3708 38.7387 174.8450 124 Q 4.4910 8.1767 123.9030 55.0642 32.2713 174.7908 125 D 4.5112 9.3202 118.2170 55.4254 39.9068 173.2997 126 R 3.8546 8.0254 111.8889 56.2668 27.7077 175.2987 127 C 4.7335 7.4760 109.8652 57.6433 32.8135 172.8033 128 F 4.6849 8.0882 117.7335 56.3355 39.3984 176.2178 129 L 3.9876 7.8949 124.0158 54.6487 41.9125 178.7992 130 S 4.4702 9.0247 119.8560 60.6527 62.4406 176.5733 131 W 4.4363 7.7652 118.2049 58.2741 28.2105 177.9895 132 L 4.1262 6.9761 120.1207 55.7011 41.5383 177.0135 133 V 4.4134 6.8418 119.0042 60.6693 34.5304 174.5349 134 K 4.4159 8.5828 127.7723 56.1380 33.3658 176.2657 135 I 4.2681 8.1908 124.5910 59.6439 37.8457 174.2494 136 P 4.2866 0.0000 0.0000 62.7857 32.0413 176.9852 137 S 4.3834 8.4829 116.2338 57.8912 64.9259 175.0840 138 E 3.9085 8.7218 122.5657 60.0822 29.1533 179.9377 139 Q 4.0722 8.0176 116.2854 58.6533 28.7694 177.4900 140 E 3.9626 7.9899 121.7784 59.0793 29.4232 178.5575 141 Q 4.1961 8.0263 117.4229 58.4653 28.8286 178.0278 142 L 4.2032 7.3975 119.5277 57.4540 41.8031 179.1178 143 R 4.1133 7.6961 116.8103 57.4185 30.2307 176.7211 144 A 4.3330 6.9170 121.7600 50.7300 19.4291 177.0411 145 R 3.9950 8.4860 119.2967 56.9310 30.0666 178.6590 146 Q 4.3016 8.4489 123.7457 55.0963 27.0691 174.6224 147 I 4.3520 7.6310 120.7637 59.9011 39.7920 175.8332 148 T 4.4308 8.3105 117.3240 60.2360 71.9101 175.7572 149 A 3.9723 8.2469 121.6467 55.1214 18.3785 179.7061 150 Q 3.9256 7.9036 116.4211 59.0168 28.9449 178.4319 151 Q 3.9340 7.6403 117.9964 58.6608 28.6545 178.4924 152 I 3.2193 7.3012 120.4780 64.6230 37.0402 178.0186 153 N 4.3351 7.7166 116.9559 56.2484 38.2879 177.4767 154 K 3.8840 7.8509 120.6269 59.2192 32.3641 178.6954 155 L 3.5616 8.0399 121.1098 57.7929 41.9867 178.5553 156 E 3.9848 8.3167 119.7162 59.2930 28.1690 178.5042 157 E 3.9773 7.8817 119.5399 59.1369 29.5094 178.3889 158 L 4.1483 8.0349 119.8398 57.8150 42.2135 178.7702 159 W 4.7272 7.9056 118.6431 59.5430 28.9713 178.4841 160 K 4.0771 8.0119 116.6593 58.5529 31.5369 177.3596 161 E 4.6301 7.3633 115.1175 55.8257 29.9610 175.7056 162 N 4.5253 8.4577 122.8543 53.3449 37.3475 174.1763 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 8 L 8.18 4.13 0.00 1.57 1.61 0.94 0.66 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 9 P 0.00 4.21 0.00 1.74 1.73 0.00 3.41 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.85 0.00 10 I 7.93 3.63 1.84 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 1.58 0.77 0.88 0.00 0.00 11 H 7.35 3.30 0.00 1.49 2.12 0.00 5.58 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 12 A 7.12 4.15 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 13 C 9.08 3.99 0.00 3.03 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 14 S 8.41 4.35 0.00 2.87 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 8.01 4.91 0.00 2.94 2.84 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 0.00 0.00 0.00 16 C 8.49 4.66 0.00 3.25 3.29 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 17 G 8.18 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 0.00 0.00 0.00 0.00 18 I 7.76 3.75 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.54 0.89 0.00 0.00 19 H 8.20 4.86 0.00 2.99 3.18 0.00 5.53 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 20 D 8.00 4.32 0.00 2.83 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 21 P 0.00 3.91 0.00 1.90 1.56 0.00 3.65 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.82 0.00 22 A 8.31 4.16 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 23 C 8.32 4.99 0.00 2.97 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.75 4.92 2.40 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 0.75 0.00 0.00 0.91 0.00 0.00 25 V 9.13 4.53 2.02 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 0.64 0.00 0.00 0.56 0.00 0.00 26 Y 8.35 3.80 0.00 1.43 2.18 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 27 C 7.99 4.27 0.00 2.88 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 28 N 8.40 4.18 0.00 2.63 2.88 0.00 0.00 7.09 7.51 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 29 T 7.98 3.94 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 30 S 7.80 4.37 0.00 3.90 3.97 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 31 K 7.56 3.54 0.00 1.85 1.97 0.00 1.60 0.00 0.00 1.60 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.28 7.81 32 K 6.95 4.57 0.00 1.38 0.98 0.00 1.02 0.00 0.00 0.69 0.00 0.00 2.29 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.04 1.26 7.81 33 W 8.28 5.20 0.00 3.27 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 34 F 9.13 5.13 0.00 2.94 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 35 C 8.97 4.90 0.00 3.07 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 36 N 8.91 5.14 0.00 2.77 2.86 0.00 0.00 7.05 8.40 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 37 G 8.15 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 0.00 0.00 0.00 38 R 8.17 4.76 0.00 2.26 2.19 0.00 3.29 0.00 0.00 3.32 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 39 G 7.56 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 40 N 9.02 4.71 0.00 2.91 2.86 0.00 0.00 6.60 7.54 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 41 T 7.94 4.66 4.27 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 1.22 0.00 0.00 42 S 8.58 4.39 0.00 4.01 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 43 G 7.70 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 0.00 0.00 0.00 0.00 44 S 8.42 4.56 0.00 4.00 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 45 H 8.99 4.62 0.00 3.65 3.76 0.00 5.65 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 46 I 7.80 3.56 2.11 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.22 0.94 0.00 0.00 47 V 7.61 3.60 2.24 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 1.13 0.00 0.00 0.93 0.00 0.00 48 N 8.66 4.37 0.00 3.21 2.99 0.00 0.00 6.66 7.76 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 49 H 8.53 4.07 0.00 2.40 2.76 0.00 5.80 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 50 L 8.73 4.01 0.00 1.86 2.17 0.87 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.04 3.53 2.30 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 0.99 0.00 0.00 0.99 0.00 0.00 52 R 8.07 3.85 0.00 2.02 2.00 0.00 3.38 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.73 0.00 53 A 8.13 4.07 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 54 K 7.37 3.76 0.00 1.93 1.89 0.00 1.63 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.32 1.52 7.81 55 C 8.29 5.01 0.00 2.89 2.81 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 56 K 8.38 4.73 0.00 1.86 1.85 0.00 1.59 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.64 1.81 7.81 57 E 8.07 5.15 0.00 1.88 1.82 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 2.32 2.32 0.00 58 V 8.16 5.02 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 0.93 0.00 0.00 0.86 0.00 0.00 59 T 8.68 4.89 4.20 0.00 0.00 0.00 0.00 0.00 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 60 L 8.90 4.84 0.00 1.72 1.59 0.91 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.83 4.75 0.00 3.31 3.26 0.00 5.89 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 K 8.51 3.86 0.00 1.72 1.61 0.00 1.70 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.45 7.81 63 D 8.21 4.68 0.00 2.71 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 64 G 7.72 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 0.00 0.00 0.00 65 P 0.00 4.25 0.00 2.12 2.22 0.00 3.67 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.16 0.00 66 L 7.96 4.43 0.00 1.66 1.73 1.05 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 67 G 7.53 4.06 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 0.00 0.00 0.00 68 E 8.42 5.03 0.00 1.97 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 2.26 2.31 0.00 69 T 8.11 4.66 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 70 V 8.35 4.34 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 0.83 0.00 0.00 0.93 0.00 0.00 71 L 8.11 4.39 0.00 1.64 1.65 0.95 0.83 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 72 E 8.50 4.92 0.00 2.10 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 2.34 2.33 0.00 73 C 9.13 4.50 0.00 3.02 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 74 Y 8.85 3.94 0.00 3.01 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 75 N 8.36 4.48 0.00 2.75 2.84 0.00 0.00 6.77 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 76 C 7.93 4.59 0.00 3.10 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 77 G 8.48 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 78 C 7.52 4.19 0.00 3.10 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 79 R 8.35 4.56 0.00 1.83 1.93 0.00 3.28 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.74 0.00 80 N 8.03 4.50 0.00 2.79 2.81 0.00 0.00 6.80 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 81 V 8.63 3.72 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 0.84 0.00 0.00 1.06 0.00 0.00 82 F 8.50 4.27 0.00 3.23 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 83 L 7.92 4.75 0.00 1.90 1.90 0.96 0.54 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 84 L 7.71 4.94 0.00 1.87 1.67 0.98 0.87 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 85 G 9.29 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 86 F 8.65 5.66 0.00 3.31 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 87 I 8.91 4.57 1.94 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.77 1.20 0.00 0.00 88 P 0.00 5.00 0.00 2.13 2.19 0.00 3.72 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 2.03 2.03 0.00 89 A 8.30 3.88 0.81 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 0.00 0.00 90 K 8.06 3.91 0.00 1.47 1.65 0.00 1.90 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.40 1.43 7.81 91 A 8.34 3.64 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 92 D 7.18 4.25 0.00 2.62 2.37 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 93 S 8.61 4.46 0.00 3.97 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 V 7.37 4.43 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.96 0.00 0.00 95 V 8.62 5.12 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 1.13 0.00 0.00 0.88 0.00 0.00 96 V 8.68 4.56 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 0.14 0.00 0.00 0.43 0.00 0.00 97 L 8.51 5.32 0.00 1.73 1.73 1.01 0.75 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 98 L 9.22 5.15 0.00 1.69 1.55 0.69 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 99 C 8.81 4.51 0.00 2.89 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 0.00 100 R 8.61 2.62 0.00 1.33 1.69 0.00 2.94 0.00 0.00 3.02 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.50 0.00 101 Q 7.45 4.42 0.00 1.91 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.71 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 102 P 0.00 4.60 0.00 2.17 2.23 0.00 3.67 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 103 C 7.97 4.07 0.00 3.11 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 0.00 104 A 7.53 4.58 1.14 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 0.00 0.00 105 S 7.50 4.39 0.00 3.74 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Q 8.66 4.15 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.68 0.00 0.00 0.00 0.00 0.00 2.47 2.32 0.00 107 S 8.00 4.20 0.00 3.83 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 0.00 108 S 8.20 4.59 0.00 3.96 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 L 7.19 4.84 0.00 1.73 1.70 0.98 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 0.00 110 K 8.67 4.35 0.00 2.00 1.83 0.00 1.78 0.00 0.00 1.88 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.61 1.61 7.81 111 D 9.10 4.43 0.00 2.73 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 I 7.83 3.85 1.86 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 1.24 0.70 0.91 0.00 0.00 113 N 7.74 4.48 0.00 2.47 2.04 0.00 0.00 6.87 7.83 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 0.00 114 W 8.22 4.90 0.00 3.30 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 0.00 115 D 8.68 4.77 0.00 2.78 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.76 4.25 0.00 3.93 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 0.00 117 S 8.08 4.22 0.00 4.29 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 0.00 118 Q 8.02 4.16 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 119 W 7.55 4.39 0.00 3.30 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 0.00 120 Q 6.78 4.30 0.00 1.25 1.73 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 2.28 2.21 0.00 121 P 0.00 3.92 0.00 2.00 1.99 0.00 3.53 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.27 0.00 122 L 8.67 3.95 0.00 1.57 1.62 0.96 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 123 I 7.32 4.43 1.61 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.17 -0.34 0.74 0.00 0.00 124 Q 8.18 4.49 0.00 2.04 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.32 0.00 0.00 0.00 0.00 0.00 2.26 2.22 0.00 125 D 9.32 4.51 0.00 2.78 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 0.00 126 R 8.03 3.85 0.00 2.09 2.01 0.00 3.23 0.00 0.00 3.41 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 127 C 7.48 4.73 0.00 3.15 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 0.00 128 F 8.09 4.68 0.00 3.06 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 L 7.89 3.99 0.00 0.90 1.09 1.01 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 130 S 9.02 4.47 0.00 4.08 4.15 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 0.00 131 W 7.77 4.44 0.00 3.53 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 L 6.98 4.13 0.00 1.37 1.44 0.28 0.57 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 0.00 133 V 6.84 4.41 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.59 0.00 0.00 134 K 8.58 4.42 0.00 1.79 1.72 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.28 7.81 135 I 8.19 4.27 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.50 0.93 0.00 0.00 136 P 0.00 4.29 0.00 2.04 2.01 0.00 3.69 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 2.06 2.11 0.00 137 S 8.48 4.38 0.00 4.05 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 0.00 138 E 8.72 3.91 0.00 2.00 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 2.42 2.37 0.00 139 Q 8.02 4.07 0.00 2.28 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.92 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 140 E 7.99 3.96 0.00 2.00 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 0.00 2.27 2.31 0.00 141 Q 8.03 4.20 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.60 0.00 142 L 7.40 4.20 0.00 1.75 1.73 0.93 0.89 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 0.00 143 R 7.70 4.11 0.00 1.73 1.99 0.00 3.15 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 144 A 6.92 4.33 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 0.00 145 R 8.49 3.99 0.00 1.99 1.94 0.00 3.21 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 146 Q 8.45 4.30 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 147 I 7.63 4.35 1.86 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.96 0.84 0.00 0.00 148 T 8.31 4.43 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 149 A 8.25 3.97 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 0.00 150 Q 7.90 3.93 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 151 Q 7.64 3.93 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 152 I 7.30 3.22 1.81 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.42 0.60 0.00 0.00 153 N 7.72 4.34 0.00 2.82 2.83 0.00 0.00 6.78 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 0.00 154 K 7.85 3.88 0.00 1.78 1.68 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.38 7.81 155 L 8.04 3.56 0.00 1.64 1.30 0.71 0.66 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 0.00 156 E 8.32 3.98 0.00 2.25 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 0.00 2.40 2.53 0.00 157 E 7.88 3.98 0.00 2.18 1.98 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 2.31 2.32 0.00 158 L 8.03 4.15 0.00 1.74 1.69 0.87 1.03 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 0.00 159 W 7.91 4.73 0.00 3.75 3.11 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 0.00 160 K 8.01 4.08 0.00 2.00 1.95 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.57 1.83 7.81 161 E 7.36 4.63 0.00 1.97 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 2.29 2.43 0.00 162 N 8.46 4.53 0.00 2.83 2.78 0.00 0.00 6.72 7.28 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