NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3592 8.2649 123.5833 51.9255 18.7575 176.3115 3 R 3.9117 8.5323 121.3466 58.8486 30.6336 176.3531 4 R 4.4404 8.7289 115.2517 57.9150 33.0095 176.5850 5 R 4.2642 7.5388 117.6788 55.9367 31.4437 176.5835 6 R 4.2371 8.3233 122.6788 55.7445 31.2326 175.4090 7 A 3.9735 8.6739 128.7859 52.7066 18.7025 176.4337 8 E 4.4859 8.4649 120.9284 54.3778 31.4140 176.3631 9 V 3.6283 8.2097 120.9599 63.0719 32.0274 176.1901 10 R 4.0792 8.4879 126.1836 56.1674 30.6469 175.5188 11 Q 4.5872 8.5070 121.8817 54.2149 30.8794 174.6425 12 L 4.7088 8.1911 124.7640 52.5747 44.0635 176.2188 13 Q 4.0665 8.5680 121.7813 55.0396 28.7400 174.6481 14 P 4.4076 0.0000 0.0000 62.7115 31.8491 175.2437 15 D 4.2585 8.7725 118.2665 54.6559 41.2115 177.5522 16 L 4.3912 8.7022 124.5164 55.4496 41.5284 177.5272 17 V 4.2004 7.8449 117.9215 63.1800 33.6604 175.6132 18 Y 4.4858 7.9947 113.8821 56.8082 39.8406 175.4055 19 G 3.8110 8.5193 107.4678 46.8610 0.0000 173.2121 20 D 4.9196 7.8308 117.0613 52.1701 43.4995 176.3026 21 V 3.8468 8.3411 118.5316 63.0554 32.3899 177.9024 22 L 4.3706 8.1358 121.7332 57.4283 42.6576 178.8663 23 V 3.5064 7.7470 117.2067 66.1880 31.4397 178.2357 24 T 3.7494 7.8061 114.7845 66.3537 68.1149 176.3621 25 A 4.0960 7.4144 122.2723 54.4614 18.7299 178.9630 26 F 4.4532 7.7505 119.0425 61.1535 39.5623 177.6502 27 I 3.3111 7.8409 119.7353 64.2828 36.6319 178.0801 28 N 4.2983 7.7976 115.8867 55.6506 38.3567 176.8079 29 K 4.1639 7.4237 118.3938 57.9602 32.5209 178.4298 30 I 3.8472 7.1209 118.6208 62.2448 37.7151 176.0184 31 M 4.1780 7.2257 119.6058 55.5643 32.6843 175.4471 32 R 4.4133 8.3593 118.2132 56.7060 31.8339 174.2233 33 D 4.4046 9.4759 118.9274 55.3496 38.4738 174.5950 34 G 4.3245 8.6240 115.4011 46.8726 0.0000 175.9716 35 K 4.9316 6.6290 121.0775 56.2443 28.5466 175.9743 36 K 4.1117 8.5655 121.7974 58.8561 32.7296 176.2435 37 N 4.2867 8.3035 117.3107 57.2641 38.6109 176.0265 38 L 4.0562 7.7805 121.1993 57.8587 42.1336 179.1569 39 A 3.9078 7.7047 119.9816 54.6645 18.1230 179.2790 40 A 4.1255 7.8600 119.0384 54.7934 18.8080 179.8104 41 R 4.1649 7.9220 116.4658 59.6038 30.1068 179.0790 42 I 3.8230 7.9754 119.5805 64.6055 37.1987 178.0491 43 F 4.1267 7.6294 121.5471 61.6933 39.0854 176.8519 44 Y 4.0945 7.9697 116.3127 61.1415 37.6571 177.7816 45 D 4.4513 9.0471 120.6336 57.3600 40.8155 178.8747 46 A 4.0729 8.7059 121.8129 55.4656 18.2971 179.4460 47 C 3.8965 8.1368 115.5226 62.7976 27.9897 176.6785 48 K 4.0155 8.5473 120.5453 59.5285 31.6202 179.5336 49 I 3.7283 8.0595 120.3177 64.1589 36.9497 178.3973 50 I 3.8118 8.0271 121.0866 64.7923 36.7925 178.5169 51 Q 4.2819 7.5492 118.4011 58.2065 28.5104 178.5713 52 E 4.1190 8.1704 119.3833 59.8953 29.6813 178.9323 53 K 4.0017 8.8028 118.5277 57.3438 32.2749 176.4290 54 T 4.6091 7.9398 113.2592 60.2138 69.4517 175.4759 55 G 3.7750 8.5261 116.6962 46.1746 0.0000 173.2363 56 Q 4.6712 7.2061 117.7599 53.0246 32.4239 175.7439 57 E 4.1609 8.7404 120.5251 56.5133 29.8274 176.5256 58 P 4.4161 0.0000 0.0000 64.4851 32.4587 178.2809 59 L 3.8321 7.8629 121.1674 58.0254 42.3314 178.2255 60 K 3.9778 7.9573 119.1057 59.5073 32.1396 178.7533 61 V 3.6357 7.5072 117.8453 65.6668 31.3110 177.7249 62 F 4.0074 7.9401 120.1556 61.3928 39.1320 177.3359 63 K 4.0238 8.3287 117.8817 58.9823 31.7994 179.3438 64 Q 3.8672 7.8687 119.5577 59.1202 28.5633 177.9773 65 A 4.3275 8.2216 123.6077 54.6126 18.2598 179.8207 66 V 3.1968 7.3203 116.7942 65.8358 31.3078 177.7999 67 E 3.8266 7.6432 118.0849 59.3633 29.6166 178.0674 68 N 4.5517 7.9172 113.3920 54.3841 38.7968 175.6959 69 V 4.1011 6.8942 118.1503 62.6488 33.7290 175.3846 70 K 4.2524 8.6330 120.0622 55.6564 31.7351 175.6713 71 P 4.6204 0.0000 0.0000 63.2487 32.1944 174.6093 72 R 4.8279 8.2451 109.2873 57.5706 35.8573 174.7490 73 M 5.0398 7.9585 118.1233 53.6979 36.0112 174.0500 74 E 4.7526 9.0259 122.8414 54.9834 34.3165 173.3826 75 V 4.8747 8.1834 119.3210 61.1072 34.6879 174.7800 76 R 4.3831 8.4464 124.7726 54.2838 34.1817 174.3529 77 S 5.1973 8.4480 118.3703 57.4755 64.3161 173.3642 78 R 4.6482 9.4156 126.3058 54.6017 31.9387 176.3294 79 R 4.9823 8.2621 125.8160 54.1233 28.6960 177.1200 80 V 3.4692 7.7357 120.1672 64.4391 32.3607 174.3881 81 G 3.2106 6.8363 112.6554 43.7765 0.0000 174.5719 82 G 4.9057 7.3526 121.4684 46.5286 0.0000 172.0889 83 A 4.6411 7.0317 119.7857 50.4945 23.4075 175.6248 84 N 5.0885 8.7197 116.8825 52.7887 37.7812 173.8633 85 Y 3.7377 9.6014 121.8664 57.5364 39.2947 175.0645 86 Q 4.4083 8.4711 123.8027 56.0040 29.3052 176.1579 87 V 4.3745 8.7784 126.8932 60.6627 32.5709 172.8951 88 P 5.1285 0.0000 0.0000 62.7042 32.5715 175.2420 89 M 4.9183 8.8208 121.0649 53.1865 34.6841 174.5669 90 E 4.8099 8.5704 123.2638 56.0015 31.7617 177.2592 91 V 4.3556 8.1268 124.4441 61.2345 34.8567 175.2238 92 S 4.2501 8.7247 121.9424 57.4807 63.5356 173.0182 93 P 4.7442 0.0000 0.0000 65.1668 30.9673 178.1127 94 R 3.9720 7.9212 118.7187 59.4960 30.3088 177.8631 95 R 4.0608 7.7965 117.3340 58.2833 30.4431 178.0641 96 Q 4.0801 8.4806 120.1228 59.4938 29.0132 177.4910 97 Q 4.0360 7.9970 120.8558 59.1254 29.2399 178.0777 98 S 4.0978 7.8774 115.3463 61.7614 63.0323 176.7497 99 L 3.6095 7.4207 120.5603 57.3797 41.1761 179.4494 100 A 4.3703 7.7058 119.8714 55.3314 18.4430 179.7282 101 L 3.9917 7.8114 117.0663 58.0132 41.7717 179.7896 102 R 3.9619 8.1886 118.6840 59.0801 30.0521 178.6447 103 W 4.3912 8.7966 119.4244 59.7057 29.0233 178.4868 104 L 4.1122 8.1914 119.1329 57.6283 40.9943 179.7953 105 V 3.6724 7.9672 118.0404 66.3451 31.8014 178.2031 106 Q 4.1971 8.1717 117.3449 58.7927 28.2441 178.8811 107 A 4.1894 7.9128 120.7640 54.7730 18.7506 179.1492 108 A 4.3291 8.3172 121.1467 54.8430 18.2218 179.6967 109 N 4.4199 8.4809 114.6390 56.5600 38.7984 177.4163 110 Q 4.1539 7.5594 116.3541 56.9052 29.1813 177.1775 111 R 4.1237 6.9422 118.4224 55.3272 30.8543 175.0028 112 P 4.3596 0.0000 0.0000 65.7920 31.4396 176.8968 113 E 4.0421 8.1002 117.5037 56.1221 29.5618 177.5689 114 R 4.2167 8.3751 117.3564 57.1301 30.8253 177.3452 115 R 4.7151 7.5421 116.6799 53.3114 35.4936 175.8577 116 A 4.0119 8.5824 123.2837 55.2090 18.5793 180.0659 117 A 3.9889 7.9924 118.9190 55.3857 18.5072 179.9288 118 V 3.5485 7.6969 116.2266 66.1742 31.8366 178.3445 119 R 4.2448 7.9808 117.8282 59.0139 29.6132 178.6993 120 I 4.2300 7.7406 118.2000 63.1215 37.8072 177.8227 121 A 4.1731 7.8785 121.7590 55.5854 18.3136 179.2761 122 H 4.1240 8.8282 114.7549 58.9946 29.0911 177.2093 123 E 4.2217 8.2188 118.4718 57.5410 29.1725 177.5826 124 L 4.3718 7.7979 118.1998 57.4084 42.1090 178.6969 125 M 3.9334 7.8419 118.3874 58.4520 32.1488 178.3575 126 D 4.3224 8.1255 118.7827 57.3332 41.0888 178.5719 127 A 4.1037 7.6691 118.9321 54.0893 18.0897 179.1151 128 A 4.0697 7.2995 118.5443 54.4962 18.8129 179.4054 129 E 4.1393 7.6150 116.6625 59.3121 29.7064 177.6256 130 G 4.0222 6.2050 114.8275 45.2520 0.0000 172.3396 131 K 4.5228 7.6860 118.3966 55.4363 35.8252 174.9664 132 G 4.1754 9.0795 106.3394 43.6807 0.0000 175.3183 133 G 3.8865 8.9551 107.3728 47.0705 0.0000 175.7084 134 A 4.1133 7.7569 122.3808 54.8738 19.2070 179.5640 135 V 3.3880 7.5268 116.2977 65.7020 31.5380 177.7744 136 K 3.9578 8.4229 121.0583 59.0502 32.1720 178.9866 137 K 3.7787 7.4945 117.9409 58.2524 31.7595 179.4890 138 K 2.9967 6.9668 120.6590 59.2479 32.2306 178.6224 139 E 4.4552 7.7052 120.1124 58.9037 29.2552 179.1501 140 D 4.3865 8.1443 119.2191 57.4425 41.0368 179.0681 141 V 3.7301 7.2405 117.8333 65.7590 31.5971 177.9378 142 E 4.0138 8.2102 118.7106 58.9233 29.0583 179.4530 143 R 3.8944 7.9411 118.3077 59.3849 29.8822 178.5305 144 M 3.9541 8.5562 118.4484 57.5382 32.2095 176.8679 145 A 4.2535 7.1412 120.1185 52.9917 19.2635 176.4270 146 E 4.1653 9.0070 121.8036 56.3231 29.6421 175.9175 147 A 4.0671 7.6041 120.6749 54.9797 18.9475 178.2232 148 N 4.7273 7.2217 113.2057 52.6879 38.1546 176.0148 149 R 3.9604 7.8891 121.0859 59.4408 31.2275 178.0827 150 A 3.9288 7.8291 119.8114 55.5196 18.5461 178.3299 151 Y 3.8431 7.6516 112.1457 60.4201 38.4896 178.7397 152 A 3.9652 8.9320 125.2944 55.4033 18.6017 179.2264 153 H 4.3469 8.3732 109.4196 58.1650 28.5521 176.1038 154 Y 4.2506 8.3741 118.2389 59.4007 38.0331 177.0539 155 R 4.3949 8.8507 122.9961 55.9653 29.4640 176.0168 156 W 3.7139 8.1244 129.4742 57.8195 31.6169 173.3967 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 A 8.26 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 R 8.53 3.91 0.00 1.90 2.00 0.00 3.34 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 4 R 8.73 4.44 0.00 1.77 1.95 0.00 3.20 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 5 R 7.54 4.26 0.00 1.80 1.87 0.00 3.20 0.00 0.00 3.15 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 6 R 8.32 4.24 0.00 1.72 1.80 0.00 3.27 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 7 A 8.67 3.97 1.26 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 0.00 0.00 0.00 8 E 8.46 4.49 0.00 2.06 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.34 0.00 9 V 8.21 3.63 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 0.82 0.00 0.00 0.94 0.00 0.00 10 R 8.49 4.08 0.00 1.84 1.84 0.00 3.21 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 11 Q 8.51 4.59 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.73 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 12 L 8.19 4.71 0.00 1.63 1.54 0.92 0.98 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 13 Q 8.57 4.07 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 14 P 0.00 4.41 0.00 2.16 2.10 0.00 3.82 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 15 D 8.77 4.26 0.00 2.85 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 16 L 8.70 4.39 0.00 1.76 1.72 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.84 4.20 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.69 0.00 0.00 18 Y 7.99 4.49 0.00 3.25 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 19 G 8.52 3.81 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 0.00 20 D 7.83 4.92 0.00 2.72 2.48 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 21 V 8.34 3.85 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.96 0.00 0.00 22 L 8.14 4.37 0.00 1.80 2.09 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.75 3.51 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 0.19 0.00 0.00 0.42 0.00 0.00 24 T 7.81 3.75 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 1.18 0.00 0.00 25 A 7.41 4.10 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 7.75 4.45 0.00 3.39 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 27 I 7.84 3.31 1.82 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.15 0.79 0.00 0.00 28 N 7.80 4.30 0.00 2.88 2.84 0.00 0.00 7.05 7.33 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 29 K 7.42 4.16 0.00 1.78 1.80 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.65 7.81 30 I 7.12 3.85 1.74 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 -0.02 0.82 0.00 0.00 31 M 7.23 4.18 0.00 2.03 1.89 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.44 0.00 32 R 8.36 4.41 0.00 1.88 1.80 0.00 3.17 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 33 D 9.48 4.40 0.00 2.86 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 34 G 8.62 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 0.00 0.00 0.00 0.00 35 K 6.63 4.93 0.00 2.06 1.80 0.00 1.66 0.00 0.00 1.88 0.00 0.00 2.89 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.51 1.48 7.81 36 K 8.57 4.11 0.00 1.85 1.79 0.00 1.64 0.00 0.00 1.57 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.41 7.81 37 N 8.30 4.29 0.00 2.89 2.72 0.00 0.00 6.87 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 38 L 7.78 4.06 0.00 1.81 1.65 0.95 0.94 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 39 A 7.70 3.91 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.86 4.13 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 7.92 4.16 0.00 2.13 2.10 0.00 3.20 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.96 0.00 42 I 7.98 3.82 1.89 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.04 0.98 0.00 0.00 43 F 7.63 4.13 0.00 3.22 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 44 Y 7.97 4.09 0.00 3.30 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 45 D 9.05 4.45 0.00 2.88 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 46 A 8.71 4.07 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 47 C 8.14 3.90 0.00 2.96 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 K 8.55 4.02 0.00 1.95 1.86 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.68 7.81 49 I 8.06 3.73 1.90 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 1.54 1.10 0.96 0.00 0.00 50 I 8.03 3.81 2.06 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 1.53 0.90 0.94 0.00 0.00 51 Q 7.55 4.28 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.96 0.00 0.00 0.00 0.00 0.00 2.66 2.43 0.00 52 E 8.17 4.12 0.00 2.01 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 2.45 2.50 0.00 53 K 8.80 4.00 0.00 1.70 1.79 0.00 1.62 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.60 7.81 54 T 7.94 4.61 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 1.29 0.00 0.00 55 G 8.53 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Q 7.21 4.67 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.61 6.71 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 57 E 8.74 4.16 0.00 2.05 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 58 P 0.00 4.42 0.00 2.04 2.24 0.00 3.74 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 59 L 7.86 3.83 0.00 1.59 1.67 0.71 0.52 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 60 K 7.96 3.98 0.00 1.88 1.80 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.51 7.81 61 V 7.51 3.64 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.96 0.00 0.00 62 F 7.94 4.01 0.00 3.32 3.17 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 63 K 8.33 4.02 0.00 1.84 1.85 0.00 1.84 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.86 1.64 7.81 64 Q 7.87 3.87 0.00 2.26 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 65 A 8.22 4.33 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 66 V 7.32 3.20 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 0.88 0.00 0.00 0.41 0.00 0.00 67 E 7.64 3.83 0.00 1.97 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 0.00 2.30 2.37 0.00 68 N 7.92 4.55 0.00 2.83 2.78 0.00 0.00 6.78 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 6.89 4.10 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 0.97 0.00 0.00 0.92 0.00 0.00 70 K 8.63 4.25 0.00 1.80 1.79 0.00 1.77 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.69 1.52 7.81 71 P 0.00 4.62 0.00 2.26 2.20 0.00 4.07 0.00 0.00 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.32 0.00 72 R 8.25 4.83 0.00 1.86 2.14 0.00 2.89 0.00 0.00 3.32 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.64 0.00 73 M 7.96 5.04 0.00 1.85 1.94 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 2.49 2.46 0.00 74 E 9.03 4.75 0.00 2.03 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 75 V 8.18 4.87 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 0.84 0.00 0.00 0.93 0.00 0.00 76 R 8.45 4.38 0.00 0.67 0.66 0.00 2.26 0.00 0.00 2.62 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.11 0.00 77 S 8.45 5.20 0.00 3.83 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 78 R 9.42 4.65 0.00 2.29 2.00 0.00 2.56 0.00 0.00 2.48 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.51 0.00 79 R 8.26 4.98 0.00 1.87 1.86 0.00 3.65 0.00 0.00 3.27 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.54 0.00 80 V 7.74 3.47 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 0.35 0.00 0.00 0.57 0.00 0.00 81 G 6.84 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 7.35 4.91 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 83 A 7.03 4.64 1.26 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 0.00 0.00 0.00 84 N 8.72 5.09 0.00 2.66 2.88 0.00 0.00 6.91 7.46 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 85 Y 9.60 3.74 0.00 2.91 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 8.47 4.41 0.00 2.08 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.94 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 87 V 8.78 4.37 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 1.31 0.00 0.00 1.41 0.00 0.00 88 P 0.00 5.13 0.00 2.14 2.06 0.00 3.85 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.21 0.00 89 M 8.82 4.92 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 90 E 8.57 4.81 0.00 1.90 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 2.33 2.17 0.00 91 V 8.13 4.36 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 0.78 0.00 0.00 0.97 0.00 0.00 92 S 8.72 4.25 0.00 3.94 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.74 0.00 2.27 2.21 0.00 3.44 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.91 0.00 94 R 7.92 3.97 0.00 1.95 1.94 0.00 3.22 0.00 0.00 3.27 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 95 R 7.80 4.06 0.00 1.90 1.89 0.00 3.19 0.00 0.00 3.23 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 96 Q 8.48 4.08 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.61 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 97 Q 8.00 4.04 0.00 2.31 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 98 S 7.88 4.10 0.00 3.84 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 99 L 7.42 3.61 0.00 1.74 0.76 0.67 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.71 4.37 1.57 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 0.00 0.00 101 L 7.81 3.99 0.00 1.93 1.96 0.99 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.19 3.96 0.00 1.93 1.83 0.00 2.84 0.00 0.00 3.04 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 103 W 8.80 4.39 0.00 3.71 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 L 8.19 4.11 0.00 2.04 1.85 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.97 3.67 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 1.08 0.00 0.00 106 Q 8.17 4.20 0.00 2.43 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.60 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 107 A 7.91 4.19 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.32 4.33 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.48 4.42 0.00 2.69 2.91 0.00 0.00 7.09 7.48 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 0.00 110 Q 7.56 4.15 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.86 0.00 0.00 0.00 0.00 0.00 2.67 2.56 0.00 111 R 6.94 4.12 0.00 1.98 2.09 0.00 3.22 0.00 0.00 3.31 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.84 0.00 112 P 0.00 4.36 0.00 2.18 2.19 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.97 0.00 113 E 8.10 4.04 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.18 0.00 114 R 8.38 4.22 0.00 1.82 2.01 0.00 3.15 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 115 R 7.54 4.72 0.00 1.87 1.75 0.00 3.13 0.00 0.00 3.17 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.62 0.00 116 A 8.58 4.01 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 0.00 117 A 7.99 3.99 1.35 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 0.00 118 V 7.70 3.55 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 0.80 0.00 0.00 0.95 0.00 0.00 119 R 7.98 4.24 0.00 2.03 2.21 0.00 3.48 0.00 0.00 3.29 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 120 I 7.74 4.23 2.01 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.62 1.32 0.00 0.00 121 A 7.88 4.17 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.83 4.12 0.00 3.27 3.38 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.22 4.22 0.00 2.27 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 2.43 2.48 0.00 124 L 7.80 4.37 0.00 2.09 1.71 1.13 0.82 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 0.00 125 M 7.84 3.93 0.00 2.01 2.08 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 2.65 2.79 0.00 126 D 8.13 4.32 0.00 2.70 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 0.00 127 A 7.67 4.10 1.38 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 0.00 0.00 0.00 128 A 7.30 4.07 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 0.00 129 E 7.61 4.14 0.00 2.13 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 2.32 2.45 0.00 130 G 6.21 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 0.00 131 K 7.69 4.52 0.00 1.78 1.70 0.00 1.54 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.27 1.40 7.81 132 G 9.08 4.18 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 0.00 0.00 0.00 133 G 8.96 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 0.00 0.00 0.00 134 A 7.76 4.11 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 0.00 135 V 7.53 3.39 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 1.02 0.00 0.00 0.86 0.00 0.00 136 K 8.42 3.96 0.00 1.78 1.74 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.44 7.81 137 K 7.49 3.78 0.00 1.44 1.33 0.00 1.96 0.00 0.00 1.81 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.41 7.81 138 K 6.97 3.00 0.00 1.22 1.63 0.00 1.60 0.00 0.00 1.52 0.00 0.00 3.12 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.32 7.81 139 E 7.71 4.46 0.00 2.11 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.17 0.00 140 D 8.14 4.39 0.00 2.63 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 0.00 141 V 7.24 3.73 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 1.20 0.00 0.00 1.09 0.00 0.00 142 E 8.21 4.01 0.00 2.14 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 2.27 2.46 0.00 143 R 7.94 3.89 0.00 2.01 1.93 0.00 3.10 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.79 0.00 144 M 8.56 3.95 0.00 1.97 2.17 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.78 0.00 145 A 7.14 4.25 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 0.00 146 E 9.01 4.17 0.00 2.08 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 0.00 2.13 2.20 0.00 147 A 7.60 4.07 1.37 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 0.00 0.00 148 N 7.22 4.73 0.00 2.63 2.94 0.00 0.00 7.04 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 0.00 149 R 7.89 3.96 0.00 2.03 1.86 0.00 3.19 0.00 0.00 3.33 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 150 A 7.83 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 7.65 3.84 0.00 3.03 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 0.00 0.00 0.00 152 A 8.93 3.97 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 8.37 4.35 0.00 3.40 3.53 0.00 5.54 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.37 4.25 0.00 3.00 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 0.00 155 R 8.85 4.39 0.00 2.07 2.22 0.00 3.52 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 156 W 8.12 3.71 0.00 3.66 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