NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3219 8.3001 120.3280 55.2132 33.0885 173.4969 2 A 4.3574 7.4876 122.4632 50.3375 21.7125 174.6517 3 G 4.1982 8.5017 108.6697 44.6167 0.0000 171.4787 4 R 4.8751 8.4898 115.9331 54.2067 32.5122 175.3811 5 S 5.0193 8.6017 116.2172 58.5436 64.3506 172.9524 6 M 5.0827 9.4002 122.9661 53.8613 37.0773 173.6450 7 Q 5.2701 8.5164 116.5099 54.1498 32.6913 175.4562 8 A 4.9865 8.8770 124.7024 52.0201 19.8984 176.4940 9 A 5.0728 9.2032 123.1591 49.7378 23.2396 175.6443 10 R 4.4814 8.4635 118.0707 55.9418 31.4302 176.1091 11 C 4.3573 8.4204 120.7977 57.9780 32.4031 171.3571 12 P 4.3776 0.0000 0.0000 65.5414 31.0579 176.2055 13 T 4.7521 7.2504 104.3036 59.9120 72.1559 173.4781 14 D 4.5171 8.7116 121.7876 57.5442 41.3971 178.8603 15 E 4.0413 8.3362 118.2979 59.4673 29.8654 179.1593 16 L 4.0774 8.0099 118.7364 57.7559 41.6541 179.6194 17 S 4.2095 8.0497 113.8586 61.2163 62.5330 176.4522 18 L 4.2948 7.8440 122.0447 57.3102 41.3308 179.0107 19 S 4.4505 8.2160 114.1913 59.3137 63.0707 174.6641 20 N 4.3408 7.9555 116.6923 54.1177 36.4007 173.4738 21 C 4.9210 7.8711 115.1092 58.2196 30.6509 173.1877 22 A 4.0578 8.6877 123.1424 51.4346 19.6919 176.6430 23 V 4.6908 8.0552 122.4072 61.5754 33.9749 175.2071 24 V 4.7685 8.4735 119.3244 59.5937 36.8537 174.2261 25 S 4.7346 8.5399 115.7915 57.4971 62.8963 174.5968 26 E 4.3833 8.6732 127.1315 58.3974 29.2605 178.9967 27 K 4.1085 7.9881 119.1012 58.6431 32.1818 178.0047 28 D 4.4296 8.0208 118.3339 55.1557 41.9353 175.5204 29 Y 4.8653 7.4148 114.6316 56.5668 42.4713 173.2759 30 Q 4.7832 8.7706 117.5916 54.0709 31.1579 175.4890 31 S 4.2840 8.4699 115.8394 60.4333 63.4028 174.0330 32 G 4.0466 8.7448 112.0551 45.5458 0.0000 174.2211 33 Q 4.3049 7.6869 118.1056 56.2671 30.1559 175.1686 34 H 5.4849 8.8005 116.9020 54.3462 32.6481 173.3971 35 V 5.1269 9.1278 113.8621 59.6829 36.5323 174.2631 36 I 4.6855 8.9421 123.4997 59.4344 40.2763 174.4404 37 V 4.4743 9.8314 131.2470 61.4842 33.0205 174.8561 38 R 4.7963 9.0564 131.2511 55.9181 30.0548 176.9026 39 T 4.2208 8.5008 117.8919 63.2238 69.7346 174.5332 40 S 4.5949 7.5120 115.2093 56.3624 65.5156 173.2955 41 P 4.2982 0.0000 0.0000 64.9991 30.8815 176.6920 42 N 4.7975 7.7402 114.1975 52.9917 39.5859 173.7799 43 H 4.8145 8.0743 116.3101 53.7688 32.6040 172.6023 44 K 4.8957 8.2759 121.5324 54.8006 34.9733 175.1516 45 Y 4.5145 9.2916 122.4387 56.1325 41.1822 174.6049 46 I 4.8835 8.2179 122.7841 59.7406 39.2669 175.0142 47 F 5.0304 9.4366 125.0129 56.0080 43.4901 173.9185 48 T 5.0090 8.5076 116.7419 62.1164 71.0730 173.9943 49 L 5.4200 8.5751 125.1856 53.4229 44.2968 175.7487 50 R 4.9746 8.0548 120.6165 55.3737 33.4657 174.3587 51 T 5.3010 8.5280 116.7908 61.4309 70.4195 173.5990 52 H 4.6992 8.4395 120.8958 54.5555 32.8548 172.4439 53 P 4.2686 0.0000 0.0000 65.9463 31.3003 177.7375 54 S 4.3164 8.1865 111.6092 59.7926 63.1668 174.3432 55 V 3.7345 7.4035 121.5849 61.9368 31.8297 175.7936 56 V 3.6977 8.3426 127.4524 62.0109 31.9645 173.3789 57 P 4.5322 0.0000 0.0000 64.4820 31.8840 176.7463 58 G 4.0008 10.0785 111.3066 44.9435 0.0000 172.6194 59 S 5.3145 7.7126 112.9557 56.3359 66.6126 173.6724 60 V 4.3884 8.4844 119.3457 61.0004 34.4381 174.0614 61 A 4.8688 8.7175 130.4561 51.2480 20.0809 176.0474 62 F 5.4323 8.7859 120.2709 55.5311 43.1635 175.3343 63 S 4.5450 9.4812 117.2920 57.2969 64.4645 175.2228 64 L 3.9486 8.6143 121.2897 58.0368 41.7537 176.7909 65 P 4.3382 0.0000 0.0000 65.9358 31.2599 178.6144 66 Q 4.3636 8.0002 115.6217 59.1117 28.6152 178.9104 67 R 3.7445 8.2949 119.2279 58.9687 30.0905 179.2328 68 K 3.9173 8.4700 118.6603 59.2975 31.9198 179.0647 69 W 4.3002 8.1171 126.8054 60.1143 30.6977 176.8725 70 A 2.7888 7.5458 117.2309 50.0981 18.5987 176.8194 71 G 3.7437 7.3168 105.2064 46.8881 0.0000 174.1348 72 L 4.7886 7.6926 118.4257 52.5808 43.9141 176.5489 73 S 4.7914 8.8135 115.6169 55.8744 65.8195 173.7650 74 I 3.9143 8.1476 122.6097 63.1445 37.2069 176.9081 75 G 3.9835 9.1337 113.6492 45.1680 0.0000 173.6681 76 Q 4.1195 7.7869 121.9348 56.2965 30.1582 175.3272 77 E 4.9030 8.7204 125.6061 56.2947 30.5824 176.0383 78 I 4.7471 8.9795 116.5829 59.2634 41.9327 173.3050 79 E 5.0346 8.8298 124.7745 54.7217 31.5097 174.6001 80 V 5.0072 9.1036 127.0639 61.1248 34.5088 174.0852 81 A 5.1671 8.7266 127.8780 49.7795 22.8330 175.2322 82 L 4.5725 8.8343 120.5498 55.2416 42.4990 175.9455 83 Y 4.7073 9.3382 124.7187 55.7346 41.2373 174.6607 84 S 4.5314 7.5170 120.1111 56.2355 64.4879 172.9888 85 F 4.4535 8.8243 127.0637 56.6745 39.0800 175.5921 86 D 4.8308 9.3046 124.7169 53.1196 40.5627 175.0649 87 K 4.5875 8.2329 118.1108 54.7972 35.9233 176.7850 88 A 4.0518 8.9792 126.2285 55.5439 18.2872 179.8799 89 K 4.0956 8.0554 113.1654 59.2538 32.3948 178.1153 90 Q 4.3437 8.5200 117.8954 57.6826 29.1959 175.8254 91 C 4.5346 8.0399 117.2318 59.2663 28.7716 172.7616 92 I 3.8324 8.5408 126.2766 61.7706 36.8757 175.8637 93 G 3.9872 9.8154 116.2626 48.1243 0.0000 173.4361 94 T 5.2333 7.5454 110.6516 59.6582 72.9852 171.8220 95 M 5.0283 8.5504 121.6181 54.7371 36.4197 173.2710 96 T 4.7157 8.6910 122.9276 61.8880 71.1515 173.5202 97 I 4.6603 8.4051 126.9243 59.2326 40.6948 174.0694 98 E 4.7870 9.0972 128.6020 55.2496 30.9704 174.7148 99 I 5.0786 8.4813 127.4095 59.7398 41.3487 173.4316 100 D 4.7141 8.5323 123.8490 53.0679 45.2298 174.7116 101 F 4.2539 8.6700 121.7352 57.7709 38.9445 175.3776 102 L 4.2359 8.6588 125.5369 57.6802 42.6565 177.3732 103 Q 4.6491 7.8635 115.8088 53.4775 32.9175 175.6264 104 K 3.7740 8.8527 122.7764 59.6240 32.2703 178.8094 105 K 3.9041 8.0614 117.6255 59.1003 31.9553 176.4882 106 N 4.6268 7.5593 113.9697 52.7853 38.6448 175.3207 107 I 2.1060 7.3057 120.5564 61.1905 37.5319 174.8537 108 D 4.4868 7.1358 121.1790 53.5521 41.5189 175.2700 109 S 4.8523 8.4512 112.6738 58.3996 63.4815 174.4779 110 N 4.4463 8.3880 118.4564 52.5645 38.7600 172.6428 111 P 4.8289 0.0000 0.0000 62.2300 33.0020 174.5782 112 Y 4.7851 8.7144 121.6740 55.9669 40.8359 174.3825 113 D 4.9697 8.9789 125.0247 54.0409 41.9213 176.7033 114 T 3.5127 9.4561 119.6552 65.1330 68.7692 176.0691 115 D 4.3961 8.5137 121.7780 56.8216 40.7906 178.7572 116 K 4.0599 8.2516 119.7284 59.7478 32.3468 178.6976 117 M 3.4875 8.0609 119.1758 58.0643 31.6902 178.5432 118 A 4.1868 8.6887 121.0259 55.1948 18.5850 179.5697 119 A 3.9970 7.9933 118.8621 55.4144 18.4197 179.5615 120 E 4.0202 8.4676 117.9460 59.0748 29.7156 178.6593 121 F 3.9066 8.8521 121.3367 61.5075 39.0478 177.1965 122 I 3.8715 8.2170 119.3433 64.4996 36.6149 178.2846 123 Q 4.0377 7.9441 118.3321 59.1890 28.7317 178.7435 124 Q 4.0154 8.1223 117.8150 58.0978 29.1597 177.2212 125 F 5.0094 7.4851 118.2005 55.9918 39.4273 174.7454 126 N 4.4869 7.2517 117.5821 55.3288 39.0509 174.2299 127 N 4.3092 9.2028 121.5613 54.3215 36.8738 173.8264 128 Q 4.7985 7.8133 115.7476 54.0081 32.1922 174.5187 129 A 4.9085 8.4465 124.1694 51.0366 20.2317 176.9105 130 F 4.9864 9.1305 119.6266 55.7949 43.6904 174.2537 131 S 5.2588 8.8479 116.5256 56.2822 67.1696 174.0355 132 V 3.7476 8.3688 123.0672 64.7372 31.5637 176.6358 133 G 4.0553 9.1081 116.4525 45.0199 0.0000 173.4622 134 Q 2.5200 7.7278 121.9415 55.6879 30.0886 174.7146 135 Q 5.0415 7.8821 124.4713 54.2499 30.7955 174.7401 136 L 5.0270 8.9792 123.1322 52.9078 46.3705 175.1706 137 V 4.8710 8.5807 119.9214 61.2965 33.4766 174.5863 138 F 5.4478 9.6274 130.1844 56.6909 42.2529 173.3222 139 S 5.1016 8.9438 121.5595 57.0480 63.3072 173.0972 140 F 4.5547 9.2621 129.3781 57.7835 42.2901 174.0026 141 N 3.8834 8.9189 125.2746 54.5511 35.9278 173.6382 142 D 4.4540 8.1992 110.1378 54.9196 40.3291 172.6195 143 K 4.6058 8.1803 115.5977 53.8930 35.7494 174.9042 144 L 5.1260 8.0162 121.6478 53.3898 43.7165 175.5230 145 F 5.3231 9.6313 122.2744 55.6159 43.3346 174.2046 146 G 4.5054 9.7252 109.9780 44.9421 0.0000 172.6876 147 L 5.4376 9.0391 124.0096 52.6300 45.7792 175.3161 148 L 4.9540 8.6013 123.9157 53.0010 45.3397 175.5348 149 V 3.7845 8.4872 127.4324 63.1318 31.6743 176.4567 150 K 4.1884 9.0061 129.0095 58.8127 32.9631 176.8693 151 D 4.6953 7.5348 116.5597 53.3950 44.9552 174.2932 152 I 5.0303 8.0857 122.7694 59.9147 41.7400 173.8680 153 E 5.2357 9.5230 125.3929 54.6638 33.6397 175.4935 154 A 4.8881 8.9316 125.3087 50.3365 20.5901 176.8327 155 M 4.1557 8.3445 119.0305 54.8206 32.6651 176.2042 156 D 4.4921 8.5885 123.7875 53.1687 41.7346 174.3639 157 P 4.1563 0.0000 0.0000 65.5428 31.8233 176.8022 *170 Q 4.3005 7.6638 116.1852 55.6922 30.4414 175.2447 171 K 4.7175 8.4075 120.9914 56.8059 33.4702 176.9645 172 I 4.6756 8.4435 117.5025 59.2618 40.4560 174.9787 173 E 4.3984 8.9061 124.3877 58.4246 30.8415 176.3911 174 V 5.0489 7.6918 116.6219 60.3569 34.7512 174.6115 175 G 4.3513 9.3678 108.9366 45.5388 0.0000 170.9943 176 L 4.7067 8.4993 122.3901 52.9880 44.0068 175.6766 177 V 4.1607 8.5242 126.8882 63.0658 32.9066 175.2381 178 V 4.8294 8.8227 120.2085 58.9941 35.5920 176.6857 179 G 3.8044 8.9891 110.3903 48.4762 0.0000 174.0843 180 N 4.8534 7.9175 114.0244 52.3425 37.6854 174.7830 181 S 4.5327 8.0250 115.5053 59.2819 63.6788 173.5746 182 Q 4.5822 8.9584 123.3569 54.2494 30.8715 174.6405 183 V 4.5122 8.2661 122.8999 60.7964 33.9132 174.2215 184 A 4.7945 8.3681 129.3808 50.1633 21.7906 175.4068 185 F 5.5160 8.9024 120.6719 55.4064 42.4982 174.5462 186 E 5.0345 8.2233 115.4061 55.3088 32.1707 174.9895 187 K 4.8208 8.7131 121.8829 56.3171 34.1367 176.5007 188 A 4.2773 8.4756 123.4199 51.5583 19.7472 177.1485 189 E 4.0079 8.6813 119.1691 58.1670 29.9269 177.6423 190 N 4.3537 8.9724 118.3882 53.4827 36.4799 174.3755 191 S 4.2933 8.1302 114.5443 58.4244 62.7673 173.8014 192 S 4.6298 8.7963 121.2415 58.1387 63.1851 173.8721 193 L 4.0183 7.6419 123.3842 55.8844 42.1796 176.3999 194 N 4.8167 8.8785 124.9389 52.3107 39.2310 171.9545 195 L 5.1268 8.2635 124.6082 52.9886 43.4830 175.6350 196 I 4.4985 8.8577 116.6563 58.9232 41.5161 174.9558 197 G 4.1268 8.9862 107.7293 45.2948 0.0000 173.4517 198 K 4.2475 10.1120 116.9485 56.7797 33.3079 177.2537 199 A 4.4451 7.7960 122.8071 52.1227 17.1486 176.0979 200 K 4.9124 7.6370 119.7356 54.6416 36.3268 178.1252 201 T 4.1122 8.0654 114.5249 62.5689 66.9002 174.2502 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 1 M 8.30 4.32 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.49 0.00 2 A 7.49 4.36 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 3 G 8.50 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 0.00 0.00 0.00 0.00 4 R 8.49 4.88 0.00 1.87 2.05 0.00 2.76 0.00 0.00 3.28 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.63 0.00 5 S 8.60 5.02 0.00 3.92 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 6 M 9.40 5.08 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.56 0.00 7 Q 8.52 5.27 0.00 2.06 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.01 0.00 0.00 0.00 0.00 0.00 2.27 2.51 0.00 8 A 8.88 4.99 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 9 A 9.20 5.07 1.21 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 10 R 8.46 4.48 0.00 1.72 1.90 0.00 3.22 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 1.66 1.65 0.00 11 C 8.42 4.36 0.00 3.12 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 12 P 0.00 4.38 0.00 1.85 2.00 0.00 3.62 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 1.88 2.03 0.00 13 T 7.25 4.75 4.25 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 1.20 0.00 0.00 14 D 8.71 4.52 0.00 2.75 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 15 E 8.34 4.04 0.00 2.09 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 0.00 2.42 2.42 0.00 16 L 8.01 4.08 0.00 1.92 1.73 0.80 0.64 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 17 S 8.05 4.21 0.00 4.16 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 18 L 7.84 4.29 0.00 1.82 1.92 0.97 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.22 4.45 0.00 4.11 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 20 N 7.96 4.34 0.00 2.84 2.87 0.00 0.00 6.96 7.43 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 21 C 7.87 4.92 0.00 2.90 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 22 A 8.69 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.06 4.69 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 0.99 0.00 0.00 0.94 0.00 0.00 24 V 8.47 4.77 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 0.53 0.00 0.00 1.04 0.00 0.00 25 S 8.54 4.73 0.00 4.05 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 26 E 8.67 4.38 0.00 2.17 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 2.26 0.00 27 K 7.99 4.11 0.00 1.75 1.87 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.46 7.81 28 D 8.02 4.43 0.00 2.62 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 0.00 0.00 0.00 29 Y 7.41 4.87 0.00 3.03 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 30 Q 8.77 4.78 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.96 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 31 S 8.47 4.28 0.00 3.90 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 32 G 8.74 4.05 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 0.00 0.00 0.00 33 Q 7.69 4.30 0.00 2.01 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.66 0.00 0.00 0.00 0.00 0.00 2.44 2.51 0.00 34 H 8.80 5.48 0.00 3.59 3.48 0.00 5.56 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 V 9.13 5.13 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 0.40 0.00 0.00 0.97 0.00 0.00 36 I 8.94 4.69 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.38 1.06 0.00 0.00 37 V 9.83 4.47 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 0.94 0.00 0.00 1.16 0.00 0.00 38 R 9.06 4.80 0.00 1.94 1.98 0.00 3.29 0.00 0.00 3.22 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 39 T 8.50 4.22 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 40 S 7.51 4.59 0.00 4.00 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 41 P 0.00 4.30 0.00 2.17 2.22 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 42 N 7.74 4.80 0.00 2.43 2.64 0.00 0.00 6.75 8.46 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 43 H 8.07 4.81 0.00 3.03 2.94 0.00 5.75 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 44 K 8.28 4.90 0.00 1.41 1.57 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.35 7.81 45 Y 9.29 4.51 0.00 2.95 2.52 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 46 I 8.22 4.88 1.74 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.26 0.87 0.00 0.00 47 F 9.44 5.03 0.00 3.05 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 48 T 8.51 5.01 4.24 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 1.22 0.00 0.00 49 L 8.58 5.42 0.00 1.55 1.51 0.44 0.52 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 50 R 8.05 4.97 0.00 1.86 1.72 0.00 3.20 0.00 0.00 3.42 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 51 T 8.53 5.30 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 1.28 0.00 0.00 52 H 8.44 4.70 0.00 3.19 3.11 0.00 5.69 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.27 0.00 2.03 2.09 0.00 3.20 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.06 0.00 54 S 8.19 4.32 0.00 3.91 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 55 V 7.40 3.73 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 0.74 0.00 0.00 0.96 0.00 0.00 56 V 8.34 3.70 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 0.95 0.00 0.00 0.94 0.00 0.00 57 P 0.00 4.53 0.00 2.07 1.97 0.00 3.73 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 2.03 2.09 0.00 58 G 10.08 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 59 S 7.71 5.31 0.00 3.97 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 60 V 8.48 4.39 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 0.25 0.00 0.00 0.91 0.00 0.00 61 A 8.72 4.87 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 0.00 0.00 0.00 0.00 0.00 0.00 62 F 8.79 5.43 0.00 2.79 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 63 S 9.48 4.55 0.00 4.06 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 64 L 8.61 3.95 0.00 1.77 1.75 0.95 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 65 P 0.00 4.34 0.00 2.27 2.16 0.00 3.73 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 66 Q 8.00 4.36 0.00 2.55 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.76 2.61 0.00 67 R 8.29 3.74 0.00 1.99 2.10 0.00 3.09 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.94 0.00 68 K 8.47 3.92 0.00 2.01 1.91 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.68 7.81 69 W 8.12 4.30 0.00 3.21 3.47 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 70 A 7.55 2.79 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 7.32 3.74 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 0.00 0.00 0.00 72 L 7.69 4.79 0.00 1.35 1.37 -0.24 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 73 S 8.81 4.79 0.00 3.90 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 74 I 8.15 3.91 1.88 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 1.37 0.54 0.93 0.00 0.00 75 G 9.13 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 0.00 0.00 0.00 76 Q 7.79 4.12 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.96 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 77 E 8.72 4.90 0.00 1.88 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 2.32 2.38 0.00 78 I 8.98 4.75 1.92 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.15 0.89 0.00 0.00 79 E 8.83 5.03 0.00 2.11 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 2.26 2.27 0.00 80 V 9.10 5.01 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 1.01 0.00 0.00 1.02 0.00 0.00 81 A 8.73 5.17 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 82 L 8.83 4.57 0.00 1.63 1.70 1.02 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 9.34 4.71 0.00 2.94 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 84 S 7.52 4.53 0.00 3.72 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 85 F 8.82 4.45 0.00 3.08 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 86 D 9.30 4.83 0.00 2.69 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.23 4.59 0.00 1.92 1.71 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.41 1.39 7.81 88 A 8.98 4.05 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 89 K 8.06 4.10 0.00 1.79 1.93 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.49 7.81 90 Q 8.52 4.34 0.00 2.45 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 7.01 0.00 0.00 0.00 0.00 0.00 2.51 2.42 0.00 91 C 8.04 4.53 0.00 3.03 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 92 I 8.54 3.83 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.63 0.91 0.00 0.00 93 G 9.82 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 0.00 0.00 0.00 94 T 7.55 5.23 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 95 M 8.55 5.03 0.00 1.81 1.72 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.10 0.00 96 T 8.69 4.72 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 1.09 0.00 0.00 97 I 8.41 4.66 0.88 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.13 0.69 0.00 0.00 98 E 9.10 4.79 0.00 1.97 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 2.26 2.24 0.00 99 I 8.48 5.08 2.01 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 1.39 0.93 0.00 0.00 100 D 8.53 4.71 0.00 2.86 2.47 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 0.00 101 F 8.67 4.25 0.00 2.96 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 0.00 102 L 8.66 4.24 0.00 1.67 1.69 0.99 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 103 Q 7.86 4.65 0.00 2.06 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.64 0.00 0.00 0.00 0.00 0.00 2.34 2.31 0.00 104 K 8.85 3.77 0.00 1.79 1.80 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.44 7.81 105 K 8.06 3.90 0.00 1.71 1.80 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.40 7.81 106 N 7.56 4.63 0.00 2.75 2.65 0.00 0.00 7.01 7.49 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 0.00 107 I 7.31 2.11 1.67 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 1.14 0.41 0.79 0.00 0.00 108 D 7.14 4.49 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 0.00 109 S 8.45 4.85 0.00 3.87 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 0.00 110 N 8.39 4.45 0.00 2.51 2.43 0.00 0.00 6.86 7.30 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 0.00 111 P 0.00 4.83 0.00 2.00 1.99 0.00 3.52 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.91 0.00 112 Y 8.71 4.79 0.00 2.91 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 0.00 113 D 8.98 4.97 0.00 2.81 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 T 9.46 3.51 4.45 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 1.15 0.00 0.00 115 D 8.51 4.40 0.00 2.83 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 0.00 116 K 8.25 4.06 0.00 2.19 2.16 0.00 1.69 0.00 0.00 1.90 0.00 0.00 3.08 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.71 1.81 7.81 117 M 8.06 3.49 0.00 1.26 1.38 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.81 0.00 118 A 8.69 4.19 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 0.00 119 A 7.99 4.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 E 8.47 4.02 0.00 2.45 2.32 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 2.45 2.43 0.00 121 F 8.85 3.91 0.00 3.15 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 0.00 122 I 8.22 3.87 2.10 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.14 0.97 0.00 0.00 123 Q 7.94 4.04 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.02 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 124 Q 8.12 4.02 0.00 1.69 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.04 0.00 0.00 0.00 0.00 0.00 2.39 1.20 0.00 125 F 7.49 5.01 0.00 2.86 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 0.00 126 N 7.25 4.49 0.00 2.91 2.75 0.00 0.00 7.14 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 0.00 127 N 9.20 4.31 0.00 2.91 2.95 0.00 0.00 6.85 7.42 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 0.00 128 Q 7.81 4.80 0.00 2.15 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.88 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 129 A 8.45 4.91 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 0.00 130 F 9.13 4.99 0.00 2.96 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.85 5.26 0.00 4.02 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 0.00 132 V 8.37 3.75 2.12 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 0.74 0.00 0.00 1.01 0.00 0.00 133 G 9.11 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 0.00 134 Q 7.73 2.52 0.00 1.50 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.72 0.00 0.00 0.00 0.00 0.00 1.49 1.16 0.00 135 Q 7.88 5.04 0.00 1.91 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.57 0.00 0.00 0.00 0.00 0.00 2.18 2.35 0.00 136 L 8.98 5.03 0.00 1.59 1.79 0.84 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.58 4.87 2.23 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 0.86 0.00 0.00 1.03 0.00 0.00 138 F 9.63 5.45 0.00 3.22 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 0.00 139 S 8.94 5.10 0.00 3.96 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 0.00 140 F 9.26 4.55 0.00 1.99 2.49 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 0.00 0.00 0.00 0.00 141 N 8.92 3.88 0.00 2.78 2.76 0.00 0.00 7.03 8.06 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 0.00 142 D 8.20 4.45 0.00 2.74 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 0.00 143 K 8.18 4.61 0.00 2.14 1.17 0.00 1.68 0.00 0.00 1.96 0.00 0.00 3.25 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.42 7.81 144 L 8.02 5.13 0.00 1.52 1.58 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 145 F 9.63 5.32 0.00 3.07 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 0.00 146 G 9.73 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 L 9.04 5.44 0.00 1.56 1.48 0.92 0.74 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 0.00 148 L 8.60 4.95 0.00 1.68 1.43 0.94 0.70 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 0.00 149 V 8.49 3.78 2.08 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 0.57 0.00 0.00 0.77 0.00 0.00 150 K 9.01 4.19 0.00 1.65 1.77 0.00 1.76 0.00 0.00 1.59 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.53 1.44 7.81 151 D 7.53 4.70 0.00 2.70 2.36 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 0.00 152 I 8.09 5.03 2.06 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 1.27 0.43 0.91 0.00 0.00 153 E 9.52 5.24 0.00 1.78 1.76 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 2.19 2.35 0.00 154 A 8.93 4.89 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 0.00 155 M 8.34 4.16 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.47 0.00 156 D 8.59 4.49 0.00 2.63 2.58 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 0.00 157 P 0.00 4.16 0.00 2.08 2.13 0.00 3.76 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 *170 Q 7.66 4.30 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.11 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 171 K 8.41 4.72 0.00 1.64 1.74 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.37 7.81 172 I 8.44 4.68 1.91 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.68 0.94 0.00 0.00 173 E 8.91 4.40 0.00 2.08 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 2.39 2.31 0.00 174 V 7.69 5.05 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 0.75 0.00 0.00 1.06 0.00 0.00 175 G 9.37 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 0.00 0.00 0.00 0.00 176 L 8.50 4.71 0.00 1.13 1.28 0.75 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 177 V 8.52 4.16 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 1.02 0.00 0.00 1.31 0.00 0.00 178 V 8.82 4.83 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 0.72 0.00 0.00 1.02 0.00 0.00 179 G 8.99 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 0.00 180 N 7.92 4.85 0.00 2.81 2.90 0.00 0.00 6.05 7.64 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 0.00 181 S 8.03 4.53 0.00 3.89 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 0.00 182 Q 8.96 4.58 0.00 1.89 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 183 V 8.27 4.51 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 -0.56 0.00 0.00 0.48 0.00 0.00 184 A 8.37 4.79 1.07 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 0.00 185 F 8.90 5.52 0.00 2.90 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 0.00 186 E 8.22 5.03 0.00 1.98 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 2.35 2.25 0.00 187 K 8.71 4.82 0.00 1.78 1.83 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.76 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.41 1.46 7.81 188 A 8.48 4.28 1.34 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 0.00 189 E 8.68 4.01 0.00 1.98 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 2.33 2.35 0.00 190 N 8.97 4.35 0.00 2.92 3.00 0.00 0.00 6.97 7.57 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 0.00 191 S 8.13 4.29 0.00 3.92 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 0.00 192 S 8.80 4.63 0.00 4.13 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 L 7.64 4.02 0.00 1.43 1.58 0.25 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 194 N 8.88 4.82 0.00 2.93 3.07 0.00 0.00 7.15 6.66 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 0.00 195 L 8.26 5.13 0.00 1.56 1.55 0.90 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 196 I 8.86 4.50 1.87 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 1.23 0.97 0.91 0.00 0.00 197 G 8.99 4.13 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 0.00 0.00 0.00 198 K 10.11 4.25 0.00 1.91 1.86 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.41 1.37 7.81 199 A 7.80 4.45 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 0.00 200 K 7.64 4.91 0.00 1.62 1.74 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.48 7.81 201 T 8.07 4.11 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 1.19 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.