NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1471 8.2931 120.3094 55.2597 33.9777 172.5148 2 G 3.6651 7.9447 112.8506 44.9231 0.0000 171.9791 3 F 4.4847 9.4841 125.6029 56.3581 41.1715 174.7945 4 K 4.3876 8.5138 123.9181 55.0908 31.3788 175.5161 5 L 4.8876 7.9801 125.0507 52.9012 44.4154 176.8238 6 R 4.4769 8.1553 116.5441 55.2443 29.9279 175.1261 7 G 3.8532 8.3237 110.4228 45.5408 0.0000 171.5762 8 Q 4.6084 7.7365 117.7683 55.2038 30.3142 176.0598 9 V 4.0249 8.6523 119.6534 64.0424 32.1340 179.3142 10 S 4.5674 7.4564 114.1722 57.3021 64.2877 174.3561 11 E 4.4514 8.1392 119.5448 55.2799 30.6868 175.3085 12 L 4.7235 7.6463 119.3723 53.1218 43.7104 174.8992 13 P 4.1788 0.0000 0.0000 65.4738 31.4291 176.6137 14 F 4.5255 7.1817 115.2307 55.7976 37.4179 174.7580 15 E 4.1271 8.8891 125.5170 59.5002 30.9408 177.0319 16 R 4.8351 8.0588 121.5090 55.0937 31.4029 175.8873 17 V 5.0259 8.4884 116.9228 59.6313 36.0143 173.9796 18 Y 4.9999 8.9587 125.1771 55.8323 41.2924 173.9993 19 I 4.6715 7.6392 126.0679 59.4987 40.4113 174.5254 20 T 4.4228 8.4510 122.1968 60.3745 70.4044 172.0166 21 A 4.8140 8.4607 130.6523 49.4045 20.8154 174.3253 22 P 4.2366 0.0000 0.0000 65.2975 31.5139 177.2627 23 A 4.5539 7.7951 117.8334 50.5052 19.7733 175.5803 24 G 3.8360 7.9202 106.9928 46.8643 0.0000 173.5476 25 L 4.5778 7.3585 122.8343 53.7472 44.1392 177.9815 26 T 3.8267 8.6425 111.5676 65.5460 68.1979 175.9310 27 I 3.7223 8.1340 121.0807 63.7785 37.5264 177.6967 28 G 3.5738 8.2194 106.6941 47.7693 0.0000 176.0092 29 S 4.1637 8.3011 117.7616 61.3118 62.8252 176.3070 30 D 4.3837 8.0614 121.1171 57.2961 40.5665 178.3154 31 L 3.9326 8.1436 120.8844 58.3630 42.1006 178.6644 32 E 3.9634 7.8179 118.2595 59.6867 29.4393 179.8215 33 R 3.9256 7.6798 117.3077 59.2546 30.1798 179.2433 34 V 3.6359 8.1407 118.4207 66.0048 31.4420 178.0679 35 I 3.6991 8.1282 119.8233 64.6446 36.8301 178.4217 36 S 4.3572 7.9853 112.6793 61.3660 62.2097 175.8759 37 T 4.1450 7.7477 111.7650 64.7169 69.1021 176.2167 38 H 4.4854 8.5225 118.9770 56.0999 28.9828 175.1548 39 T 4.5404 7.7286 109.5163 59.3907 71.0878 174.0816 40 R 4.0073 8.2890 119.9539 57.5788 30.3604 176.0139 41 A 4.4707 7.6462 118.9652 52.5719 19.4191 177.1792 42 K 4.4260 9.2837 120.5246 54.7755 35.5245 175.5870 43 V 4.2453 8.5849 128.5315 63.1590 31.9336 175.7268 44 V 4.4144 8.6233 121.7651 60.2319 32.9803 175.9534 45 N 4.7235 8.9238 120.3769 54.5620 39.4092 175.0769 46 K 4.5163 7.6400 115.7379 55.7267 35.7370 176.2698 47 A 4.2259 8.0889 121.9987 51.8285 18.4921 179.2464 48 E 3.8682 7.6042 115.0318 58.7150 30.2669 177.4892 49 K 4.6754 7.3182 116.2047 54.8983 32.1003 175.4737 50 S 4.8299 7.4666 114.5905 56.6746 66.4538 175.1955 51 E 4.3945 9.2837 122.1427 58.4283 30.2834 176.1384 52 A 4.6359 7.7531 118.9954 50.5435 23.4229 174.9260 53 I 5.0042 8.5028 119.2093 59.6891 41.0237 174.8980 54 I 4.4982 8.8715 128.5155 59.8684 38.9310 174.3810 55 Q 5.0314 8.7704 128.7861 54.1089 31.7742 173.7551 56 I 4.5696 7.8925 126.4581 59.6497 39.4828 175.1714 57 V 3.8268 8.8208 130.6401 65.5653 31.7643 175.5905 58 H 4.9910 7.8588 115.3644 54.8761 33.4830 172.7175 59 A 5.3832 8.4764 122.7066 51.3273 20.3898 174.1381 60 I 4.5258 8.2702 120.8576 59.9128 40.4492 174.5018 61 R 5.0374 8.9998 128.3191 55.0125 30.6434 174.4830 62 E 4.9110 8.7799 125.5940 54.2845 33.1771 174.6443 63 K 5.1605 8.3736 117.6311 55.5435 35.6639 175.6260 64 R 4.1575 8.2479 118.5444 54.1206 33.5832 173.8331 65 I 3.4525 7.6038 119.8905 61.3421 38.1524 174.1302 66 L 4.4711 8.7666 130.4112 56.2904 43.2971 176.0146 67 S 4.8609 7.8475 111.7290 56.3995 66.3915 171.7924 68 L 5.3471 8.4542 122.1165 53.0743 45.4417 176.0024 69 S 4.6849 8.8514 116.9810 57.4462 65.6584 174.4822 70 E 3.6341 9.4578 119.7920 56.9180 26.9886 175.2954 71 S 3.9441 8.6459 110.0656 58.7573 60.8670 171.0439 72 G 4.2886 7.5614 107.1962 46.1501 0.0000 174.7408 73 R 3.9694 8.4111 122.2982 55.9263 31.2137 176.1425 74 V 3.5368 8.1709 126.7623 64.4181 31.7848 174.1905 75 R 4.1162 9.2118 129.6524 56.7626 29.9954 176.3202 76 E 5.2473 8.8317 120.3563 55.1516 33.5657 175.3048 77 F 4.8976 9.2111 125.9986 56.3259 41.7697 174.2392 78 E 4.3914 8.9525 128.8683 56.0432 30.3082 175.7739 79 L 4.7153 9.1041 130.0658 53.9301 41.8600 175.3494 80 V 4.4151 8.3533 123.7001 60.5851 33.2493 174.6403 81 Y 4.9832 9.2318 128.4472 55.9690 40.6513 174.5856 82 R 4.5360 8.9297 127.9167 55.0269 31.7566 175.8390 83 V 4.7687 7.8221 123.5169 60.8179 34.2388 174.2393 84 A 5.0514 9.1166 128.7924 50.3864 21.6580 174.7167 85 A 4.9563 8.1523 121.4880 51.0781 23.7275 174.7603 86 R 4.7972 9.3140 116.0544 54.6991 35.2113 175.0101 87 L 4.6436 8.8307 123.8787 53.6237 44.1347 175.3757 88 L 4.8655 8.4627 126.3648 52.4902 45.3215 175.9210 89 D 4.6494 8.8917 120.1301 53.4131 41.7901 176.8134 90 A 3.9918 8.4398 124.7208 54.8885 18.2391 178.0034 91 H 4.8800 8.5258 113.2013 55.8482 29.2524 175.1096 92 N 4.3259 8.3813 113.5702 54.0960 36.5979 174.1109 93 A 4.2106 7.3416 122.8857 51.2255 18.9710 177.9840 94 E 4.3394 8.5705 122.1350 56.0357 28.4644 176.0807 95 L 4.1317 8.1518 125.9834 56.3654 42.7460 176.7206 96 A 4.3827 7.5790 119.8102 49.8078 21.2857 175.4983 97 S 4.4018 8.5936 117.0928 59.0889 62.7134 174.2919 98 L 4.2811 7.7317 124.7807 55.2198 43.2802 177.2555 99 Q 4.5918 8.6887 122.6336 55.7424 31.1952 174.2128 100 E 4.8042 8.7127 116.0741 55.7415 32.5368 175.1493 101 I 4.4028 8.3764 122.0890 59.8844 39.5672 175.1763 102 R 4.5320 8.6937 127.4113 54.8654 30.7460 176.0466 103 L 4.8380 8.3413 124.8956 52.9733 44.7482 176.0975 104 T 5.1207 8.5745 114.4613 60.0304 70.8162 173.6739 105 R 4.5839 8.8849 125.8391 54.7373 32.8436 175.9280 106 I 4.4538 8.2397 122.9132 60.1259 38.2968 175.4893 107 L 4.5298 8.8404 132.0092 52.8146 42.8709 173.9059 108 P 4.7670 0.0000 0.0000 62.4894 31.9617 175.9740 109 F 4.3515 9.0068 128.9535 57.5193 39.5891 174.7556 110 L 4.7123 7.7473 125.6318 53.0867 45.1047 176.4621 111 D 4.2742 8.6726 122.5323 56.6985 41.5218 177.8931 112 A 4.1101 7.8151 120.4963 55.0217 19.2355 178.8021 113 Q 4.3337 7.6558 116.6313 54.7758 25.7099 176.3042 114 E 3.9349 7.9466 122.3319 59.1074 29.7180 179.1868 115 L 3.8813 7.9028 119.1655 57.6846 41.7212 178.9349 116 A 3.9977 8.0017 119.9174 55.4600 18.0558 179.7327 117 K 3.8949 7.9721 115.1979 58.8921 32.1481 178.4664 118 A 4.3605 7.7281 118.3875 52.5273 19.1287 177.5580 119 A 4.4536 7.3916 118.1273 53.6853 20.4760 178.6858 120 E 3.9042 8.4712 116.5284 59.8443 29.6175 179.6582 121 E 4.1926 8.1767 114.9141 57.8894 29.7489 177.5231 122 E 4.4602 7.7885 118.7345 58.3206 30.8707 177.0362 123 M 4.0319 8.3324 118.9081 58.7937 32.0294 179.0396 124 L 4.1068 8.4328 118.9836 57.4562 41.6654 179.1249 125 Y 4.1384 7.8383 119.6398 60.4862 38.9219 177.4515 126 K 4.0088 8.7454 120.2221 59.9964 32.6183 178.5755 127 D 4.3043 8.2434 119.3267 57.2023 41.0615 178.0028 128 M 4.0847 7.9279 118.7716 58.7549 32.3055 178.1986 129 Q 4.0735 8.5627 118.6708 58.8947 28.9256 178.7343 130 K 3.9428 8.3163 120.7785 59.4154 32.2445 178.1586 131 D 4.3095 8.4388 118.2310 57.3711 41.1993 177.7638 132 A 4.0639 8.3959 121.7298 55.5669 18.4258 180.0953 133 V 3.6536 7.9173 117.3286 65.0897 31.4581 178.5932 134 Q 4.0396 8.3291 118.5871 58.3931 28.4132 178.6969 135 Q 3.9652 8.5333 119.7703 59.0201 28.8053 178.3866 136 I 3.9705 7.7664 122.1152 63.6904 37.1927 177.9332 137 L 3.9554 7.9345 120.8669 58.5166 41.9767 179.1808 138 R 4.0259 8.0387 119.6939 58.7775 29.4186 178.5994 139 Q 4.0272 8.4998 118.5415 58.8723 28.4841 178.5634 140 V 3.8878 8.3518 119.9778 66.2455 31.1249 178.2701 141 S 3.9657 8.4562 113.4473 60.9933 62.8099 176.1634 142 A 4.0958 7.9181 124.3469 54.8613 16.9857 179.4453 143 F 4.0317 8.7652 116.7918 60.9302 38.7173 177.7138 144 T 4.2411 7.7102 111.6079 64.6483 67.1148 176.0031 145 S 4.4723 7.3068 113.6981 60.5039 63.4397 173.9227 146 A 4.6520 8.5201 122.3101 52.6822 26.3000 176.3856 147 G 3.2453 8.6944 106.6952 45.1636 0.0000 175.5083 148 L 4.1292 7.2984 118.4725 56.6425 40.4857 178.5633 149 E 3.9353 7.6614 119.2285 59.7648 29.4203 177.5537 150 H 4.3768 8.0618 115.9452 56.3129 29.8499 173.1439 151 H 4.0471 7.5301 118.3452 57.5420 30.0512 173.8509 152 H 4.1277 8.1973 119.3836 56.6047 30.7616 174.2619 153 H 4.9700 7.6556 120.4721 53.2470 31.8174 172.4179 154 H 4.4611 8.6657 114.4019 55.5765 28.7440 174.8837 155 H 4.4177 8.5711 119.7542 56.4827 30.0509 172.9767 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 8.29 4.15 0.00 1.74 1.86 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 2 G 7.94 3.67 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 0.00 0.00 0.00 3 F 9.48 4.48 0.00 3.00 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 4 K 8.51 4.39 0.00 1.74 1.80 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.51 7.81 5 L 7.98 4.89 0.00 1.63 1.62 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 6 R 8.16 4.48 0.00 1.71 1.78 0.00 3.22 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 7 G 8.32 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 0.00 0.00 0.00 8 Q 7.74 4.61 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 7.01 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 9 V 8.65 4.02 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 0.83 0.00 0.00 0.91 0.00 0.00 10 S 7.46 4.57 0.00 4.02 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 E 8.14 4.45 0.00 1.92 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 2.21 2.41 0.00 12 L 7.65 4.72 0.00 0.91 1.29 0.39 0.42 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 13 P 0.00 4.18 0.00 2.24 2.21 0.00 3.38 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.97 0.00 14 F 7.18 4.53 0.00 3.13 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.89 4.13 0.00 2.09 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 16 R 8.06 4.84 0.00 1.91 2.11 0.00 3.27 0.00 0.00 3.37 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 17 V 8.49 5.03 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.01 0.00 0.00 18 Y 8.96 5.00 0.00 3.03 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 19 I 7.64 4.67 1.74 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 1.07 0.91 0.72 0.00 0.00 20 T 8.45 4.42 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 1.25 0.00 0.00 21 A 8.46 4.81 1.18 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 22 P 0.00 4.24 0.00 2.17 2.16 0.00 3.68 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.15 0.00 23 A 7.80 4.55 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 7.92 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 0.00 0.00 0.00 25 L 7.36 4.58 0.00 1.79 1.63 0.94 0.69 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 26 T 8.64 3.83 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 1.18 0.00 0.00 27 I 8.13 3.72 1.99 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 1.61 1.67 0.96 0.00 0.00 28 G 8.22 3.57 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 0.00 29 S 8.30 4.16 0.00 3.98 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 30 D 8.06 4.38 0.00 2.93 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 0.00 0.00 0.00 0.00 31 L 8.14 3.93 0.00 1.89 1.81 0.94 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 32 E 7.82 3.96 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.58 0.00 33 R 7.68 3.93 0.00 2.01 1.99 0.00 3.13 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 34 V 8.14 3.64 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 1.04 0.00 0.00 1.02 0.00 0.00 35 I 8.13 3.70 2.03 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.70 0.95 0.00 0.00 36 S 7.99 4.36 0.00 3.89 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 37 T 7.75 4.14 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 38 H 8.52 4.49 0.00 3.36 3.39 0.00 5.57 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 T 7.73 4.54 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 1.32 0.00 0.00 40 R 8.29 4.01 0.00 1.73 1.93 0.00 3.27 0.00 0.00 3.51 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 41 A 7.65 4.47 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 0.00 0.00 0.00 0.00 0.00 0.00 42 K 9.28 4.43 0.00 1.80 1.65 0.00 1.54 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.44 7.81 43 V 8.58 4.25 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 0.95 0.00 0.00 0.95 0.00 0.00 44 V 8.62 4.41 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.16 0.00 0.00 45 N 8.92 4.72 0.00 2.73 2.88 0.00 0.00 6.82 6.72 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 46 K 7.64 4.52 0.00 1.80 1.83 0.00 1.59 0.00 0.00 1.86 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.52 7.81 47 A 8.09 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 E 7.60 3.87 0.00 2.10 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 2.27 2.23 0.00 49 K 7.32 4.68 0.00 1.73 1.73 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.40 7.81 50 S 7.47 4.83 0.00 4.21 3.96 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 51 E 9.28 4.39 0.00 1.98 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 2.56 2.50 0.00 52 A 7.75 4.64 0.78 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 53 I 8.50 5.00 2.02 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 1.50 0.81 1.08 0.00 0.00 54 I 8.87 4.50 1.84 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 1.11 0.63 0.89 0.00 0.00 55 Q 8.77 5.03 0.00 2.06 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.71 0.00 0.00 0.00 0.00 0.00 2.21 2.39 0.00 56 I 7.89 4.57 1.85 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 1.09 1.14 0.94 0.00 0.00 57 V 8.82 3.83 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 0.65 0.00 0.00 0.89 0.00 0.00 58 H 7.86 4.99 0.00 3.05 3.08 0.00 5.68 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 8.48 5.38 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 60 I 8.27 4.53 1.92 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 1.25 0.68 0.97 0.00 0.00 61 R 9.00 5.04 0.00 1.54 1.71 0.00 3.17 0.00 0.00 2.90 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.76 0.00 62 E 8.78 4.91 0.00 2.10 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 2.21 2.22 0.00 63 K 8.37 5.16 0.00 2.13 1.87 0.00 1.59 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.42 1.76 7.81 64 R 8.25 4.16 0.00 1.62 1.85 0.00 2.67 0.00 0.00 3.01 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.34 0.00 65 I 7.60 3.45 1.71 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 1.38 1.08 0.82 0.00 0.00 66 L 8.77 4.47 0.00 1.66 1.73 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 67 S 7.85 4.86 0.00 3.88 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.45 5.35 0.00 1.50 1.49 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.85 4.68 0.00 3.72 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 9.46 3.63 0.00 2.16 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 2.31 2.23 0.00 71 S 8.65 3.94 0.00 3.99 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 72 G 7.56 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 0.00 0.00 0.00 0.00 73 R 8.41 3.97 0.00 1.93 1.93 0.00 3.16 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 74 V 8.17 3.54 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 0.00 0.00 0.67 0.00 0.00 0.65 0.00 0.00 75 R 9.21 4.12 0.00 2.00 1.76 0.00 3.16 0.00 0.00 3.25 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 76 E 8.83 5.25 0.00 1.99 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 2.35 2.40 0.00 77 F 9.21 4.90 0.00 3.18 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 78 E 8.95 4.39 0.00 1.97 1.70 0.00 0.00 0.00 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 2.26 0.00 79 L 9.10 4.72 0.00 1.60 1.53 0.91 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 80 V 8.35 4.42 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.94 0.00 0.00 81 Y 9.23 4.98 0.00 2.90 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 R 8.93 4.54 0.00 1.75 1.80 0.00 3.26 0.00 0.00 3.05 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 83 V 7.82 4.77 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 0.82 0.00 0.00 0.09 0.00 0.00 84 A 9.12 5.05 1.13 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 85 A 8.15 4.96 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 86 R 9.31 4.80 0.00 1.78 1.69 0.00 3.03 0.00 0.00 3.06 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 87 L 8.83 4.64 0.00 1.30 1.13 0.61 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.46 4.87 0.00 1.62 1.59 0.86 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.89 4.65 0.00 2.65 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.44 3.99 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 91 H 8.53 4.88 0.00 3.28 3.23 0.00 5.77 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 92 N 8.38 4.33 0.00 2.84 2.92 0.00 0.00 6.85 8.29 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 93 A 7.34 4.21 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.57 4.34 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.30 0.00 95 L 8.15 4.13 0.00 1.57 1.71 0.90 0.74 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 96 A 7.58 4.38 0.78 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 97 S 8.59 4.40 0.00 3.71 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 98 L 7.73 4.28 0.00 1.54 1.71 1.26 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.69 4.59 0.00 2.44 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.45 0.00 100 E 8.71 4.80 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 101 I 8.38 4.40 1.78 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 1.25 0.93 0.92 0.00 0.00 102 R 8.69 4.53 0.00 1.70 1.91 0.00 3.14 0.00 0.00 3.23 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 103 L 8.34 4.84 0.00 1.83 1.69 1.17 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 104 T 8.57 5.12 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 0.00 105 R 8.88 4.58 0.00 1.75 1.88 0.00 3.30 0.00 0.00 3.21 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.95 0.00 106 I 8.24 4.45 1.90 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 1.25 0.81 0.95 0.00 0.00 107 L 8.84 4.53 0.00 1.85 1.88 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 108 P 0.00 4.77 0.00 2.14 2.11 0.00 3.85 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.98 0.00 109 F 9.01 4.35 0.00 3.09 3.30 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 0.00 110 L 7.75 4.71 0.00 1.48 1.41 0.89 1.12 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 0.00 111 D 8.67 4.27 0.00 2.60 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 0.00 112 A 7.82 4.11 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 Q 7.66 4.33 0.00 2.01 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.83 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 114 E 7.95 3.93 0.00 2.15 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 115 L 7.90 3.88 0.00 1.65 1.74 0.91 0.87 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 0.00 116 A 8.00 4.00 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 0.00 117 K 7.97 3.89 0.00 1.83 1.80 0.00 1.43 0.00 0.00 1.54 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.56 1.45 7.81 118 A 7.73 4.36 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 0.00 119 A 7.39 4.45 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 0.00 120 E 8.47 3.90 0.00 2.04 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 2.35 2.44 0.00 121 E 8.18 4.19 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 122 E 7.79 4.46 0.00 2.03 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 2.29 2.35 0.00 123 M 8.33 4.03 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.61 0.00 124 L 8.43 4.11 0.00 1.75 1.73 0.98 0.72 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 0.00 125 Y 7.84 4.14 0.00 3.11 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 K 8.75 4.01 0.00 1.96 2.03 0.00 1.48 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.68 1.46 7.81 127 D 8.24 4.30 0.00 2.88 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 0.00 128 M 7.93 4.08 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.72 0.00 129 Q 8.56 4.07 0.00 2.06 2.14 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 2.65 2.37 0.00 130 K 8.32 3.94 0.00 1.89 2.03 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.47 7.81 131 D 8.44 4.31 0.00 3.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 A 8.40 4.06 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 V 7.92 3.65 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 0.91 0.00 0.00 0.94 0.00 0.00 134 Q 8.33 4.04 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.71 0.00 0.00 0.00 0.00 0.00 2.64 2.54 0.00 135 Q 8.53 3.97 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.77 0.00 0.00 0.00 0.00 0.00 2.64 2.58 0.00 136 I 7.77 3.97 2.03 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 1.41 1.49 0.94 0.00 0.00 137 L 7.93 3.96 0.00 1.88 1.89 0.94 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 138 R 8.04 4.03 0.00 2.10 2.08 0.00 3.17 0.00 0.00 3.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 139 Q 8.50 4.03 0.00 2.40 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.66 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 140 V 8.35 3.89 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 1.46 0.00 0.00 1.11 0.00 0.00 141 S 8.46 3.97 0.00 4.09 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 0.00 142 A 7.92 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 0.00 143 F 8.77 4.03 0.00 3.39 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 T 7.71 4.24 4.56 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 1.30 0.00 0.00 145 S 7.31 4.47 0.00 3.99 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 0.00 146 A 8.52 4.65 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 G 8.69 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 L 7.30 4.13 0.00 1.84 1.94 0.94 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 0.00 149 E 7.66 3.94 0.00 1.95 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 2.31 2.17 0.00 150 H 8.06 4.38 0.00 3.03 3.43 0.00 5.87 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 H 7.53 4.05 0.00 3.31 3.23 0.00 6.01 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 H 8.20 4.13 0.00 3.12 3.18 0.00 5.92 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 7.66 4.97 0.00 3.14 3.21 0.00 5.79 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 0.00 154 H 8.67 4.46 0.00 3.27 3.37 0.00 5.27 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 H 8.57 4.42 0.00 3.06 3.16 0.00 5.76 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00