NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4016 8.3344 115.2904 57.8774 62.7901 172.7818 3 V 3.4337 8.6942 128.6336 65.0654 31.2563 174.6186 4 I 4.1188 7.9187 123.7043 59.1430 38.4126 174.9302 5 A 4.3891 8.2403 128.4106 51.6359 19.5682 177.7055 6 K 4.3399 8.7851 118.4517 59.5616 32.4392 177.2737 7 Q 4.8829 7.7950 118.1968 55.6130 30.5220 174.2184 8 M 5.0211 8.6231 123.1121 54.8553 37.5380 173.4555 9 T 5.4121 8.9631 111.4440 60.6869 72.8483 171.7814 10 Y 5.5153 8.6079 117.6423 56.3058 41.8966 173.3322 11 K 4.9287 9.2962 121.6374 54.5215 35.7573 175.1717 12 V 5.1729 8.2074 125.6560 60.1931 34.9405 173.7866 13 Y 5.0339 9.3665 121.3797 56.4947 40.8442 174.4037 14 M 6.0253 9.7618 123.6691 52.8862 35.8287 173.9681 15 S 4.5327 8.2694 119.5444 56.7121 67.1251 173.1400 16 G 4.0664 6.4650 107.9554 46.2248 0.0000 171.7832 17 T 6.0214 8.4685 115.5840 60.9105 72.1110 173.8069 18 V 4.6378 8.8517 126.9933 60.9843 33.5057 175.3005 19 N 3.9795 10.7939 128.4428 54.8054 36.2688 175.1397 20 G 3.9960 8.0257 101.4141 46.3294 0.0000 172.3133 21 H 4.6617 8.1925 120.1370 55.5982 30.7677 173.0157 22 Y 5.5780 8.3603 126.8866 56.2171 41.0997 174.1076 23 F 5.2558 7.5605 119.0745 56.3261 42.4158 172.5776 24 E 4.8014 9.7636 118.1287 54.7270 33.8789 174.9197 25 V 5.4725 9.0855 123.8859 60.2179 34.6399 173.9446 26 E 5.0646 8.9065 125.7762 54.5966 32.8957 174.9875 27 G 4.1057 9.2067 111.9565 44.5526 0.0000 171.9603 28 D 5.0425 8.3062 119.9637 52.2014 44.2866 175.4152 29 G 4.0186 8.4709 110.2604 44.4890 0.0000 170.7392 30 K 5.2711 8.2023 116.6577 56.0281 36.1463 174.9016 31 G 4.1353 8.4898 108.1828 46.4964 0.0000 172.2198 32 K 5.5288 7.9934 119.1618 53.5918 32.6920 176.2961 33 P 4.1880 0.0000 0.0000 64.9311 31.4370 177.4059 34 Y 4.4181 7.8099 113.6909 58.8139 38.3013 175.7589 35 E 4.3188 8.1065 118.5039 55.9642 30.4905 177.0399 36 G 4.3421 8.2485 105.9828 45.9173 0.0000 172.3871 37 E 5.2819 7.4869 118.0155 54.3320 33.2728 174.9457 38 Q 4.7075 7.6114 115.9259 56.0703 32.3303 172.7531 39 T 5.2146 7.9409 111.2828 60.4115 72.9280 172.9004 40 V 4.6509 8.5488 118.7243 60.7920 34.7845 172.5843 41 K 4.8010 8.6975 124.3509 54.8866 33.5854 176.0555 42 L 4.6427 8.2490 125.7571 54.3554 44.1703 176.1295 43 T 4.8420 8.2695 114.8653 62.0405 73.0871 173.6145 44 V 4.7271 8.6089 125.6179 62.8443 32.0851 175.5251 45 T 4.6956 8.9556 116.3975 60.9766 70.6168 173.8506 46 K 4.0156 8.2787 119.9208 57.3097 35.3929 175.2347 47 G 4.2064 9.4603 116.1522 45.5061 0.0000 173.0474 48 G 3.7137 7.8961 108.2618 44.5227 0.0000 172.5187 49 P 4.6631 0.0000 0.0000 61.1424 33.0298 175.2805 50 L 3.8783 8.0093 118.5564 53.8338 42.0426 175.2384 51 P 4.6070 0.0000 0.0000 62.3670 31.7591 175.4309 52 F 4.5989 6.5141 112.4632 56.4825 39.8863 172.4582 53 A 4.4149 8.8825 124.4854 51.3259 19.1413 177.8819 54 W 4.4713 9.1777 133.3250 61.6075 29.6956 177.3977 55 D 4.7949 8.6537 118.0943 57.2065 39.9621 178.6438 56 I 4.4844 7.8491 113.0121 63.4722 37.6767 177.5682 57 L 4.2956 7.9805 120.8473 56.5736 41.6244 178.7103 58 S 4.3882 7.3295 114.3190 60.8688 62.8132 173.9726 59 P 4.7303 0.0000 0.0000 62.5860 31.1045 176.1427 60 Q 4.4914 9.1600 118.3809 56.9799 29.5364 176.5792 61 L 4.5067 7.2304 119.8535 53.2428 40.5108 176.4894 *65 S 4.0967 7.4542 113.8094 57.2588 64.0603 175.5961 66 I 3.3023 8.0700 121.3956 63.5879 36.8702 175.6741 67 P 4.1177 0.0000 0.0000 65.5340 31.7550 176.7909 68 F 4.2379 8.1010 118.8775 57.1538 37.6443 176.6642 69 T 4.7964 7.1139 115.8185 60.9429 71.0584 174.5930 70 K 3.8743 8.6678 128.1570 57.4489 33.0165 174.8803 71 Y 4.7200 8.8352 124.6169 55.7227 40.8553 173.3970 72 P 5.0218 0.0000 0.0000 61.0082 33.8360 176.1785 73 E 4.0174 8.9226 121.4561 59.7969 29.4942 178.8468 74 D 4.3929 8.1564 115.8470 55.1161 39.6968 175.9374 75 I 4.1858 8.2235 122.0156 59.4220 36.8502 173.2426 76 P 3.9672 0.0000 0.0000 61.4603 30.2802 177.0447 77 D 3.5354 8.3702 124.7162 52.3574 39.3838 175.0179 78 Y 3.7915 7.9327 124.9582 60.2989 38.9312 177.4056 79 F 3.9822 7.7476 117.7214 60.4664 39.1348 177.9790 80 K 4.2323 8.0525 116.2442 59.3186 31.8689 179.2310 81 Q 4.1499 8.1206 119.1838 58.7722 28.7194 178.5494 82 S 3.8682 7.6903 115.2107 60.2279 62.7039 174.7920 83 F 4.4458 7.0498 120.2108 56.4416 39.1783 173.6512 84 P 4.7444 0.0000 0.0000 64.7421 31.6118 177.7283 85 E 3.9141 8.0810 118.9830 59.7716 30.0400 177.5912 86 G 3.0807 8.7568 105.9509 43.7499 0.0000 170.9601 87 Y 5.5259 7.4281 116.6909 56.0146 42.2832 174.0366 88 T 5.2485 9.8287 110.1070 59.7419 72.3725 172.9765 89 W 5.8085 8.5897 119.1132 55.1382 32.4071 173.3374 90 E 5.1782 9.2881 121.0652 54.7566 31.6653 175.0863 91 R 5.2409 9.4733 124.3796 54.4644 34.0605 174.1032 92 S 5.0086 9.1310 118.8410 56.8284 66.3519 172.9133 93 M 5.0735 8.8167 122.1256 53.6420 32.2024 173.5059 94 N 4.8598 8.7691 117.7758 52.3660 38.6866 174.9436 95 F 4.8958 8.5917 123.3406 56.9464 39.9113 175.7482 96 E 4.2865 8.6982 118.1849 59.1044 30.0012 178.9956 97 D 4.7004 8.4840 120.8918 53.2287 39.5336 177.9103 98 G 4.0061 8.5125 105.0747 47.4724 0.0000 173.9610 99 A 4.2007 8.0343 121.7344 51.8827 19.6465 176.7864 100 V 4.5704 8.3821 120.7924 61.2172 35.3894 174.0145 101 C 5.6339 8.8491 123.3706 57.2754 31.2503 173.1619 102 T 4.9018 8.4431 114.4313 60.6024 70.9717 173.9369 103 V 5.0783 8.9813 123.1815 61.4029 35.7107 174.1120 104 S 4.8083 8.7785 119.7732 56.7220 66.7659 172.2807 105 N 5.2533 8.1161 119.3751 51.9037 42.7738 172.2112 106 D 5.2579 8.9533 123.9636 52.5054 44.2176 174.6035 107 S 5.3246 9.3420 122.7887 57.2123 65.9372 173.7039 108 S 4.8465 8.5104 116.9494 58.4298 66.0479 172.9152 109 I 4.8637 8.2531 118.0017 60.6840 40.8986 175.8207 110 Q 4.3922 8.9112 124.4788 55.9077 31.0082 175.6255 111 G 3.9961 7.9694 118.1561 46.7024 0.0000 171.9138 112 N 4.9084 8.6300 119.2903 52.7919 39.5146 172.4252 113 C 5.2642 7.8217 118.3814 57.9978 35.4402 173.0082 114 F 5.0570 9.4813 124.2518 56.2520 41.7826 174.6709 115 I 4.9580 8.4839 120.9666 59.9459 40.4146 174.1979 116 Y 5.2909 8.8905 125.0283 56.2764 40.6414 174.3182 117 N 5.4209 9.3376 123.2979 51.9201 41.4459 173.4153 118 V 4.7974 9.5364 127.2764 59.7785 34.5408 174.5874 119 K 5.0686 8.6966 124.5209 54.3902 35.0239 174.9389 120 I 4.8101 8.7755 124.8396 59.1108 41.6006 173.7910 121 S 5.1023 9.0700 123.6215 56.4945 64.9830 172.7478 122 G 4.4832 9.4566 114.6757 44.3585 0.0000 171.0515 123 E 4.8999 8.3273 121.0146 55.0947 33.5553 174.8956 124 N 4.2608 9.7677 115.8932 54.2882 36.2681 174.4486 125 F 4.5942 7.9553 117.2055 56.8380 39.3444 173.6779 126 P 4.2271 0.0000 0.0000 62.7742 31.4468 175.6665 127 P 4.4580 0.0000 0.0000 64.5584 31.6409 177.0205 128 N 4.5298 8.1634 114.7001 54.7306 39.4131 175.9797 129 G 3.9317 7.5170 104.7100 43.1887 0.0000 172.6649 130 P 4.1025 0.0000 0.0000 65.1963 31.4951 178.9671 131 V 3.2509 7.1649 117.6590 66.2373 31.1803 177.8584 132 M 4.1844 7.6567 115.7753 57.4940 31.9189 177.5137 133 Q 4.2405 7.3497 116.3379 54.2639 30.0952 175.4852 134 K 3.7137 7.4527 118.2828 57.5936 30.1443 175.3069 135 K 4.4144 8.1250 119.0417 57.9662 34.4949 179.2068 136 T 4.3266 7.7785 108.6034 61.6466 69.7602 173.8314 137 Q 4.5413 9.4505 119.7972 56.2638 30.6265 175.2078 138 G 3.9712 8.8082 105.1000 44.6456 0.0000 173.4251 139 W 5.1209 8.3823 118.2806 54.7242 30.9747 176.4654 140 E 4.3060 8.8933 121.9505 55.5888 29.6412 174.7906 141 P 4.5025 0.0000 0.0000 61.7879 32.6469 175.0655 142 S 4.6096 8.9017 116.5904 58.2200 67.2202 173.1920 143 T 4.9121 7.9304 113.3733 62.5729 72.0176 173.2845 144 E 4.5931 8.9289 128.4858 54.5528 31.7655 174.8169 145 R 4.8124 9.1321 126.6392 55.0088 31.5694 175.3904 146 L 5.2684 8.7555 124.9971 53.3623 45.0178 175.6200 147 F 5.1169 8.5704 114.1399 56.2891 41.7913 173.3312 148 A 4.7066 8.6421 122.1605 49.8198 18.6305 175.3280 149 R 4.1714 7.9278 120.2662 56.5902 31.7880 176.5854 150 D 4.2137 9.6592 124.5914 55.7406 37.9986 175.3988 151 G 3.9510 7.8477 104.1646 46.5064 0.0000 171.6470 152 M 4.6117 7.8133 119.8694 54.0937 35.2545 174.7327 153 L 4.5767 8.2894 120.8274 53.7405 45.0003 175.7356 154 I 4.1891 7.6879 128.1853 60.9659 38.3917 175.7064 155 G 4.6025 9.6888 113.3919 44.8340 0.0000 171.2900 156 N 5.6730 8.4131 116.5538 51.6597 43.5614 173.2461 157 D 4.6922 8.2613 121.9166 52.7991 45.2554 173.2844 158 Y 4.8409 8.3335 123.0053 57.0258 39.7672 174.8736 159 M 4.5633 8.7128 125.5696 54.2977 35.6472 174.8267 160 A 4.8935 8.3831 115.9624 51.7614 22.6703 175.3252 161 L 4.7173 8.9418 123.2514 52.4574 44.2531 174.8959 162 K 3.7172 8.3938 123.8622 56.5376 33.0406 175.9249 163 L 4.2546 8.1885 124.9887 54.0997 42.8498 176.5811 164 E 4.4578 7.7097 124.9312 56.5489 29.5144 176.1424 165 G 3.6515 10.2205 114.4554 45.2181 0.0000 174.6042 166 G 3.9145 8.0798 108.9694 45.1009 0.0000 174.3009 167 G 3.9703 7.5160 108.1174 45.4393 0.0000 171.3975 168 H 5.2588 8.3812 115.9130 54.6520 32.7192 172.8580 169 Y 4.8538 8.9185 126.0480 57.1425 39.2330 174.5402 170 L 4.8718 9.6404 127.8054 54.4611 44.1063 175.6477 171 C 4.8033 8.5793 120.6029 58.1125 35.6749 172.2783 172 E 4.6998 9.2361 127.8923 55.5824 31.0836 174.6446 173 F 5.3807 9.1602 126.0319 55.7873 41.7489 174.7575 174 K 4.8694 8.8104 122.7816 54.7829 34.9015 175.2599 175 S 4.9495 8.8232 121.6877 56.7933 66.1666 173.2827 176 T 4.9034 8.6482 121.9314 61.9707 70.7522 172.9164 177 Y 5.2997 8.9092 124.8531 56.1423 40.6391 174.6781 178 K 5.0511 10.1237 126.0973 54.5335 34.8498 175.3230 179 A 4.5566 9.4587 130.1006 51.7702 19.2414 177.0499 180 K 4.5566 8.5937 118.5834 56.0439 32.7471 176.9553 181 K 4.4925 7.8012 118.1320 54.7154 35.2431 173.6363 182 P 3.9804 0.0000 0.0000 62.5030 30.8516 175.7534 183 V 4.4256 7.8121 115.8458 58.6713 35.1060 175.7350 184 R 3.9600 8.9699 121.4277 56.7754 30.1198 177.0078 185 M 4.3451 8.5049 123.4369 54.2729 32.7833 174.6374 186 P 4.5430 0.0000 0.0000 61.9705 32.6547 175.9492 187 G 3.9414 8.4376 108.2344 44.5238 0.0000 173.0009 188 R 4.0029 7.7191 118.8934 54.8424 31.1636 174.5094 189 H 4.6681 8.8267 118.9162 55.5222 32.4546 172.1250 190 E 5.1512 9.0848 117.3546 54.7234 34.4406 175.3325 191 I 4.8481 8.5767 121.6704 59.7984 41.1988 174.3103 192 D 5.1252 8.8410 128.2673 53.5382 42.1411 176.1714 193 R 5.5556 9.0114 122.5541 53.4342 34.0173 174.8414 194 K 4.9441 8.3100 121.1632 54.7856 36.0884 175.0013 195 L 4.9550 8.4317 128.1670 54.3245 44.4422 174.2890 196 D 5.0646 8.5959 125.9234 52.0683 44.8701 175.9502 197 V 3.8439 8.7424 122.7595 62.9460 32.0355 176.4416 198 T 4.6998 8.9524 122.0186 61.0152 68.0971 173.3144 199 S 4.9499 7.8134 112.2876 57.5462 62.9476 170.7640 200 H 4.5120 7.3955 115.5241 55.0422 29.7989 173.7038 201 N 4.6888 8.7126 119.0217 52.1468 38.1965 175.7368 202 R 4.1935 8.5793 118.6992 59.2740 30.2397 177.5852 203 D 4.5349 8.0984 114.1991 53.3456 39.5793 176.4874 204 Y 3.5317 8.5663 117.7100 58.8869 35.9870 170.1011 205 T 4.4617 7.9125 108.0532 61.7692 68.9123 174.2588 206 S 4.6637 7.6676 115.7727 58.2559 67.8504 174.2162 207 V 4.4244 7.8808 123.0358 61.4053 35.5694 173.4366 208 E 5.0584 8.6511 122.4411 55.0342 34.1386 174.5376 209 Q 5.2049 9.0795 121.3627 54.3851 33.5667 173.8534 210 C 5.8092 8.3712 114.3178 55.9383 33.4298 172.0254 211 E 5.0498 8.3640 119.0609 55.2829 33.6192 173.1441 212 I 4.9826 8.6344 121.6304 59.3240 41.9810 173.9898 213 A 4.8148 9.0434 130.4839 51.0022 22.2665 175.0786 214 I 4.8087 8.6111 122.0642 59.7520 41.7919 174.6013 215 A 5.1075 8.1198 126.0765 50.3258 21.8051 175.5599 216 R 4.4842 8.5059 116.7165 55.3853 33.4974 173.8895 217 H 4.7950 8.7498 115.7849 55.9164 29.9097 176.2533 218 S 4.8053 8.2620 116.4211 57.5054 65.0633 174.6665 219 L 4.3147 8.1766 121.6694 56.9271 40.3350 175.9031 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 S 8.33 4.40 0.00 3.85 3.89 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 3 V 8.69 3.43 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 0.85 0.00 0.00 0.96 0.00 0.00 4 I 7.92 4.12 1.96 0.00 0.00 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 1.28 0.78 0.71 0.00 0.00 5 A 8.24 4.39 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 6 K 8.79 4.34 0.00 1.91 1.95 0.00 1.68 0.00 0.00 1.79 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.65 1.47 7.81 7 Q 7.79 4.88 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.72 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 8 M 8.62 5.02 0.00 2.25 2.08 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.52 0.00 9 T 8.96 5.41 4.40 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 1.29 0.00 0.00 10 Y 8.61 5.52 0.00 3.40 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 11 K 9.30 4.93 0.00 1.77 1.62 0.00 1.48 0.00 0.00 1.62 0.00 0.00 2.68 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.92 0.81 7.81 12 V 8.21 5.17 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 0.92 0.00 0.00 1.16 0.00 0.00 13 Y 9.37 5.03 0.00 2.95 2.86 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 14 M 9.76 6.03 0.00 2.12 1.91 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.23 0.00 15 S 8.27 4.53 0.00 3.69 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 16 G 6.46 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 17 T 8.47 6.02 4.36 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 1.35 0.00 0.00 18 V 8.85 4.64 1.81 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 0.53 0.00 0.00 0.74 0.00 0.00 19 N 10.79 3.98 0.00 2.99 2.90 0.00 0.00 7.02 7.53 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 20 G 8.03 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.19 4.66 0.00 3.43 3.53 0.00 5.74 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 8.36 5.58 0.00 3.06 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 23 F 7.56 5.26 0.00 3.28 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 24 E 9.76 4.80 0.00 1.90 1.86 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 2.28 2.09 0.00 25 V 9.09 5.47 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 1.57 0.00 0.00 1.20 0.00 0.00 26 E 8.91 5.06 0.00 1.94 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 0.00 2.13 2.42 0.00 27 G 9.21 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 28 D 8.31 5.04 0.00 2.50 2.44 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 29 G 8.47 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 30 K 8.20 5.27 0.00 1.91 1.93 0.00 1.41 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.32 1.39 7.81 31 G 8.49 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 0.00 0.00 0.00 32 K 7.99 5.53 0.00 1.82 1.89 0.00 2.02 0.00 0.00 1.85 0.00 0.00 3.21 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.70 1.37 7.81 33 P 0.00 4.19 0.00 1.26 1.34 0.00 3.82 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.65 0.00 34 Y 7.81 4.42 0.00 3.05 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 35 E 8.11 4.32 0.00 2.21 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 2.37 2.45 0.00 36 G 8.25 4.34 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 0.00 0.00 0.00 37 E 7.49 5.28 0.00 1.94 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 2.31 2.34 0.00 38 Q 7.61 4.71 0.00 1.83 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.59 0.00 0.00 0.00 0.00 0.00 1.93 1.99 0.00 39 T 7.94 5.21 4.28 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 1.20 0.00 0.00 40 V 8.55 4.65 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 0.75 0.00 0.00 0.72 0.00 0.00 41 K 8.70 4.80 0.00 1.67 1.72 0.00 1.61 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.31 1.32 7.81 42 L 8.25 4.64 0.00 1.68 1.83 1.04 1.19 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 43 T 8.27 4.84 4.28 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 1.25 0.00 0.00 44 V 8.61 4.73 2.21 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 0.97 0.00 0.00 1.20 0.00 0.00 45 T 8.96 4.70 4.32 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 1.31 0.00 0.00 46 K 8.28 4.02 0.00 1.90 1.78 0.00 1.81 0.00 0.00 2.17 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.53 1.47 7.81 47 G 9.46 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 48 G 7.90 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 0.00 0.00 0.00 49 P 0.00 4.66 0.00 2.13 2.33 0.00 3.51 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 1.95 2.18 0.00 50 L 8.01 3.88 0.00 1.40 0.78 1.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.61 0.00 2.15 1.97 0.00 2.57 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.63 0.00 52 F 6.51 4.60 0.00 2.95 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.88 4.41 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 54 W 9.18 4.47 0.00 4.05 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 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0.89 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.54 -0.79 0.00 0.00 67 P 0.00 4.12 0.00 0.85 1.41 0.00 3.71 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 2.41 0.00 68 F 8.10 4.24 0.00 2.97 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 69 T 7.11 4.80 4.38 0.00 0.00 0.00 0.00 0.00 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 70 K 8.67 3.87 0.00 1.97 1.78 0.00 1.87 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.67 7.81 71 Y 8.84 4.72 0.00 2.98 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 72 P 0.00 5.02 0.00 2.38 2.16 0.00 3.86 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 1.95 2.06 0.00 73 E 8.92 4.02 0.00 2.02 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 2.36 2.39 0.00 74 D 8.16 4.39 0.00 2.84 2.85 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 83 F 7.05 4.45 0.00 3.26 3.09 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 84 P 0.00 4.74 0.00 2.22 2.22 0.00 3.79 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 2.00 2.01 0.00 85 E 8.08 3.91 0.00 2.07 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 0.00 2.27 2.34 0.00 86 G 8.76 3.08 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 0.00 87 Y 7.43 5.53 0.00 3.33 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 88 T 9.83 5.25 4.28 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 1.20 0.00 0.00 89 W 8.59 5.81 0.00 3.48 3.52 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 0.00 90 E 9.29 5.18 0.00 1.87 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 2.24 2.36 0.00 91 R 9.47 5.24 0.00 2.26 1.90 0.00 3.04 0.00 0.00 2.54 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.43 0.00 92 S 9.13 5.01 0.00 3.79 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 93 M 8.82 5.07 0.00 1.60 2.01 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.53 0.00 94 N 8.77 4.86 0.00 2.70 2.81 0.00 0.00 7.02 7.89 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 95 F 8.59 4.90 0.00 3.10 2.91 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 0.00 0.00 0.00 0.00 96 E 8.70 4.29 0.00 2.12 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 0.00 2.69 2.68 0.00 97 D 8.48 4.70 0.00 2.95 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 98 G 8.51 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 A 8.03 4.20 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 0.00 100 V 8.38 4.57 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 0.96 0.00 0.00 1.01 0.00 0.00 101 C 8.85 5.63 0.00 3.01 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 0.00 102 T 8.44 4.90 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 1.19 0.00 0.00 103 V 8.98 5.08 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 0.83 0.00 0.00 0.94 0.00 0.00 104 S 8.78 4.81 0.00 3.70 3.84 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 0.00 105 N 8.12 5.25 0.00 2.15 1.42 0.00 0.00 6.60 8.48 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 0.00 106 D 8.95 5.26 0.00 2.65 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 S 9.34 5.32 0.00 2.72 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 0.00 108 S 8.51 4.85 0.00 3.93 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 0.00 109 I 8.25 4.86 1.84 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.10 0.99 0.00 0.00 110 Q 8.91 4.39 0.00 2.11 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.34 0.00 0.00 0.00 0.00 0.00 2.27 2.33 0.00 111 G 7.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.63 4.91 0.00 2.65 2.83 0.00 0.00 6.20 7.66 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 0.00 113 C 7.82 5.26 0.00 2.93 2.86 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 0.00 114 F 9.48 5.06 0.00 2.67 2.66 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 0.00 115 I 8.48 4.96 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.24 1.12 0.00 0.00 116 Y 8.89 5.29 0.00 3.12 3.13 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 0.00 0.00 0.00 117 N 9.34 5.42 0.00 2.79 2.68 0.00 0.00 6.42 8.49 0.00 0.00 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 V 9.54 4.80 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 0.94 0.00 0.00 0.93 0.00 0.00 119 K 8.70 5.07 0.00 1.64 1.68 0.00 1.54 0.00 0.00 1.54 0.00 0.00 2.79 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.31 1.30 7.81 120 I 8.78 4.81 1.92 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 1.20 1.53 1.12 0.00 0.00 121 S 9.07 5.10 0.00 3.93 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 0.00 122 G 9.46 4.48 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 0.00 123 E 8.33 4.90 0.00 1.95 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 2.12 2.19 0.00 124 N 9.77 4.26 0.00 2.86 2.96 0.00 0.00 7.31 8.28 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 0.00 125 F 7.96 4.59 0.00 3.01 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 0.00 126 P 0.00 4.23 0.00 2.17 2.03 0.00 3.83 0.00 0.00 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.19 0.00 127 P 0.00 4.46 0.00 2.05 2.13 0.00 3.67 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 2.04 2.13 0.00 128 N 8.16 4.53 0.00 2.67 2.82 0.00 0.00 6.86 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 0.00 129 G 7.52 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 0.00 130 P 0.00 4.10 0.00 1.97 2.01 0.00 2.98 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.09 0.00 131 V 7.16 3.25 1.04 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 0.08 0.00 0.00 0.30 0.00 0.00 132 M 7.66 4.18 0.00 2.02 2.07 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 2.67 2.60 0.00 133 Q 7.35 4.24 0.00 1.85 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.69 0.00 0.00 0.00 0.00 0.00 2.60 2.41 0.00 134 K 7.45 3.71 0.00 1.77 1.66 0.00 1.53 0.00 0.00 1.44 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.15 1.25 7.81 135 K 8.12 4.41 0.00 1.63 1.73 0.00 1.62 0.00 0.00 1.63 0.00 0.00 3.13 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.40 7.81 136 T 7.78 4.33 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 1.15 0.00 0.00 137 Q 9.45 4.54 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 5.75 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 138 G 8.81 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 0.00 0.00 0.00 139 W 8.38 5.12 0.00 3.32 3.18 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 0.00 140 E 8.89 4.31 0.00 2.08 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 2.48 2.53 0.00 141 P 0.00 4.50 0.00 1.95 2.00 0.00 3.75 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.17 0.00 142 S 8.90 4.61 0.00 3.93 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 T 7.93 4.91 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 1.20 0.00 0.00 144 E 8.93 4.59 0.00 2.14 1.69 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 2.19 2.38 0.00 145 R 9.13 4.81 0.00 1.72 1.85 0.00 3.17 0.00 0.00 3.18 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.55 0.00 146 L 8.76 5.27 0.00 1.45 1.65 0.84 0.76 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 0.00 147 F 8.57 5.12 0.00 3.20 3.04 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 0.00 148 A 8.64 4.71 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 0.00 149 R 7.93 4.17 0.00 1.57 1.70 0.00 3.35 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 150 D 9.66 4.21 0.00 2.81 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 G 7.85 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 0.00 152 M 7.81 4.61 0.00 1.94 2.12 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.63 0.00 153 L 8.29 4.58 0.00 1.06 1.43 0.45 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 154 I 7.69 4.19 0.86 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.54 0.87 0.00 0.00 155 G 9.69 4.60 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 0.00 0.00 0.00 156 N 8.41 5.67 0.00 2.71 2.29 0.00 0.00 6.29 7.96 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 0.00 157 D 8.26 4.69 0.00 2.47 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 0.00 0.00 0.00 0.00 158 Y 8.33 4.84 0.00 2.85 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 0.00 159 M 8.71 4.56 0.00 1.79 1.88 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.60 0.00 160 A 8.38 4.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 L 8.94 4.72 0.00 1.41 1.33 0.53 -1.17 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 0.00 162 K 8.39 3.72 0.00 1.64 1.75 0.00 1.89 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.59 1.45 7.81 163 L 8.19 4.25 0.00 1.59 1.53 0.90 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 164 E 7.71 4.46 0.00 1.99 1.83 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 2.29 2.10 0.00 165 G 10.22 3.65 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 0.00 0.00 0.00 166 G 8.08 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 G 7.52 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 0.00 0.00 0.00 168 H 8.38 5.26 0.00 3.00 3.24 0.00 5.89 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 Y 8.92 4.85 0.00 2.96 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 0.00 170 L 9.64 4.87 0.00 1.66 1.61 0.96 0.64 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 0.00 171 C 8.58 4.80 0.00 2.77 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 0.00 172 E 9.24 4.70 0.00 2.24 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 0.00 2.33 2.35 0.00 173 F 9.16 5.38 0.00 2.85 2.75 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 0.00 174 K 8.81 4.87 0.00 1.64 1.66 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.38 7.81 175 S 8.82 4.95 0.00 3.48 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 0.00 176 T 8.65 4.90 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 1.14 0.00 0.00 177 Y 8.91 5.30 0.00 2.71 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 0.00 178 K 10.12 5.05 0.00 1.84 1.87 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.43 7.81 179 A 9.46 4.56 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 0.00 180 K 8.59 4.56 0.00 1.62 1.80 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.40 1.45 7.81 181 K 7.80 4.49 0.00 1.75 1.67 0.00 1.56 0.00 0.00 1.84 0.00 0.00 3.27 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.19 1.35 7.81 182 P 0.00 3.98 0.00 2.03 2.02 0.00 3.58 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.14 0.00 183 V 7.81 4.43 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 0.51 0.00 0.00 0.46 0.00 0.00 184 R 8.97 3.96 0.00 1.87 1.88 0.00 3.16 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 185 M 8.50 4.35 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.50 0.00 186 P 0.00 4.54 0.00 2.05 2.25 0.00 3.77 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 1.97 1.93 0.00 187 G 8.44 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 0.00 0.00 0.00 188 R 7.72 4.00 0.00 1.84 1.90 0.00 3.18 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.96 0.00 189 H 8.83 4.67 0.00 3.32 3.32 0.00 5.26 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 E 9.08 5.15 0.00 1.79 1.86 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 2.19 2.39 0.00 191 I 8.58 4.85 1.73 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.85 0.81 0.00 0.00 192 D 8.84 5.13 0.00 2.56 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 0.00 193 R 9.01 5.56 0.00 1.59 1.71 0.00 2.93 0.00 0.00 3.25 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.25 0.00 194 K 8.31 4.94 0.00 1.78 1.59 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.82 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.59 1.43 7.81 195 L 8.43 4.95 0.00 1.62 1.52 1.06 1.07 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 0.00 196 D 8.60 5.06 0.00 2.53 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 0.00 197 V 8.74 3.84 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 1.03 0.00 0.00 198 T 8.95 4.70 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 1.27 0.00 0.00 199 S 7.81 4.95 0.00 3.97 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 0.00 200 H 7.40 4.51 0.00 2.70 2.66 0.00 5.52 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 N 8.71 4.69 0.00 2.81 2.82 0.00 0.00 6.96 7.20 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 0.00 202 R 8.58 4.19 0.00 1.86 2.08 0.00 3.22 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 203 D 8.10 4.53 0.00 2.78 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 0.00 204 Y 8.57 3.53 0.00 3.18 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 0.00 205 T 7.91 4.46 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 1.33 0.00 0.00 206 S 7.67 4.66 0.00 3.73 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 0.00 207 V 7.88 4.42 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 0.00 0.00 -0.17 0.00 0.00 -0.64 0.00 0.00 208 E 8.65 5.06 0.00 1.80 1.68 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 2.12 2.16 0.00 209 Q 9.08 5.20 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.69 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 210 C 8.37 5.81 0.00 3.01 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 0.00 211 E 8.36 5.05 0.00 2.00 1.74 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 2.21 2.26 0.00 212 I 8.63 4.98 1.87 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 1.16 1.58 0.90 0.00 0.00 213 A 9.04 4.81 1.17 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 0.00 214 I 8.61 4.81 1.82 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 1.14 0.86 0.87 0.00 0.00 215 A 8.12 5.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 R 8.51 4.48 0.00 1.85 1.98 0.00 2.75 0.00 0.00 3.13 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.60 0.00 217 H 8.75 4.79 0.00 3.06 3.29 0.00 5.69 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 S 8.26 4.81 0.00 3.87 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 0.00 219 L 8.18 4.31 0.00 1.68 1.55 0.91 0.46 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 * Residues marked with a * may have inaccurate shift predictions.