NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 23 A 4.3568 8.1233 123.5821 52.3774 20.8369 179.1560 24 D 4.1853 8.1499 115.6161 56.9579 40.7988 177.3052 25 S 4.1420 9.0406 116.7224 61.4945 63.3183 176.2363 26 K 3.8443 8.1966 120.4833 59.6735 31.7344 178.8895 27 A 4.0318 8.2282 121.0190 55.2353 18.2627 180.1132 28 V 3.6912 8.1215 117.7985 64.6636 31.5785 178.5039 29 L 4.1943 8.3536 119.9562 57.9596 41.5747 179.1100 30 N 4.2729 8.2892 116.8133 56.3334 38.6927 176.5353 31 Q 4.2155 8.6663 121.4047 59.4508 29.1157 178.4321 32 A 4.2154 8.6435 121.9976 55.1534 18.4633 179.5190 33 V 3.5532 8.0276 116.5765 66.3034 31.5624 178.2296 34 A 4.1172 8.3238 120.1306 55.4642 18.2734 179.4251 35 D 4.4050 8.6368 117.8307 57.5274 40.8593 179.0609 36 L 4.1187 8.8318 119.9570 57.6493 41.5191 179.7711 37 S 3.8907 7.8259 115.3100 61.5191 62.6193 176.8887 38 V 3.6182 7.8166 120.7658 65.8260 31.2468 177.8165 39 A 4.0033 8.6549 121.0593 55.4810 18.2258 179.0665 40 H 4.0381 8.5052 116.8474 59.3619 29.8241 177.5083 41 S 4.1064 7.8973 114.6296 61.4269 62.1781 176.1984 42 I 3.6578 7.9210 122.6046 64.3828 36.7693 178.4570 43 L 3.9299 8.0095 119.8648 57.9356 41.3370 179.0498 44 H 3.6811 8.0190 118.1845 58.9839 29.7132 177.0506 45 Q 4.1634 8.1068 121.5762 59.2747 28.7775 178.4263 46 V 3.6560 8.0516 119.5339 66.2477 31.3241 177.2954 47 H 4.1199 8.2622 117.1427 59.3217 29.7379 176.9680 48 W 4.7085 8.3079 119.5225 59.5139 29.0899 177.4056 49 Y 4.4988 8.4499 114.6986 57.1790 38.0460 175.4380 50 M 4.3775 7.5401 120.2928 56.2027 32.8764 175.6204 51 R 4.6277 8.8220 123.1946 55.4520 34.5607 173.6900 52 G 4.0829 9.0123 106.7349 43.1439 0.0000 173.2811 53 R 4.1881 8.3568 119.2759 57.5260 30.3360 177.4199 54 G 4.2824 9.5975 110.4854 45.4178 0.0000 174.9743 55 F 4.1197 8.8152 122.4082 62.1058 39.0256 176.9642 56 M 4.2250 8.1993 115.3242 58.2718 32.2432 177.9152 57 I 3.6352 7.5324 119.7401 64.0815 37.5285 178.1124 58 W 4.1657 8.1292 119.5126 59.1855 28.6679 178.3399 59 H 3.8903 8.2337 118.4762 58.6902 29.6740 175.3533 60 P 4.2482 0.0000 0.0000 65.4488 31.1510 177.9537 61 K 3.4957 7.5044 119.7085 59.6913 31.8734 178.4709 62 M 4.0405 7.9620 118.7222 58.3765 31.7441 178.3508 63 D 4.1845 7.6812 118.5967 57.4542 40.9963 178.7104 64 E 3.8949 7.9009 118.3371 59.6909 29.4207 178.9735 65 Y 4.4740 7.7619 116.7016 61.3699 37.8780 178.3879 66 M 4.0660 8.4870 120.1040 58.3932 32.0835 178.3924 67 E 3.8910 8.3365 119.5839 59.2383 29.8523 178.5450 68 E 3.7070 8.1917 119.3982 59.1036 29.7182 178.7812 69 I 3.7977 8.1095 120.3115 64.5865 37.2201 178.1255 70 D 4.4642 8.5705 120.2442 57.0748 40.5871 179.0059 71 G 3.5144 7.9387 106.2188 48.2004 0.0000 175.3155 72 Y 4.3232 7.3654 119.7065 60.3636 37.8212 178.5765 73 L 3.9885 8.0103 121.2818 58.2048 42.2070 178.6685 74 D 4.2503 8.1423 117.8631 57.3457 41.2399 177.6372 75 E 3.9170 8.2117 119.8323 59.6888 29.5972 178.7884 76 M 3.9044 8.3568 119.0125 58.1894 31.9940 178.6913 77 S 4.0978 8.0733 113.4023 61.5176 62.5835 176.1356 78 E 4.0049 8.6581 121.6352 58.9687 29.1328 179.2837 79 R 3.8145 8.0962 119.2170 59.1462 30.0490 178.1949 80 L 3.8970 7.9281 120.1018 58.2669 42.0382 178.9633 81 I 3.8319 7.8346 119.6161 64.9127 36.8522 178.5372 82 T 3.8844 7.8274 115.1574 66.3236 68.2976 175.6616 83 L 4.4261 7.5847 118.2705 54.5351 41.7910 177.6096 84 G 3.8366 8.1529 107.5901 45.4088 0.0000 174.2307 85 G 3.8268 7.9017 109.1445 44.1896 0.0000 174.0439 86 A 4.4687 7.9322 121.0438 49.1108 19.5659 173.9184 87 P 4.4435 0.0000 0.0000 62.7120 32.2117 177.0958 88 F 4.7208 8.3260 120.0504 58.9885 39.2605 176.6849 89 S 4.8428 8.7915 119.9334 56.5996 63.4448 174.6159 90 T 4.4835 6.9038 109.7003 59.8704 72.8941 173.4191 91 L 3.9333 8.2397 122.3968 57.8289 41.7135 179.6016 92 K 3.7971 7.8755 118.9878 59.7098 32.0933 178.5031 93 E 3.7019 7.6241 118.5373 59.1589 29.3182 179.3466 94 F 4.4492 7.5728 117.7935 60.7564 38.7900 177.9286 95 S 4.1583 8.1643 113.8253 61.5225 62.8487 176.1771 96 E 4.1778 7.9536 117.2854 57.8917 29.8052 177.4757 97 N 4.5184 7.7450 116.6645 53.8006 39.6126 175.5671 98 S 4.4883 7.5406 114.5663 58.3924 62.9575 173.6873 99 Q 4.3096 8.7522 124.7074 55.8939 28.8746 175.7877 100 L 4.0702 7.5386 119.4776 53.6268 42.5329 176.2866 101 K 4.4905 8.2678 122.4714 54.8335 33.8127 175.6474 102 E 4.6870 8.4546 121.6803 54.6502 31.8224 175.6341 103 V 4.5059 7.7479 113.9072 58.8253 35.2747 175.6407 104 L 4.0054 8.2636 121.1815 54.4885 42.0024 177.8557 105 G 2.4968 8.0366 110.8424 45.6039 0.0000 172.8173 106 D 4.3598 7.3171 121.7299 52.8544 43.5682 175.6027 107 Y 4.8505 8.6327 124.3324 60.1597 38.2094 176.7859 108 N 4.5104 8.5764 117.7013 55.4708 39.2999 175.3926 109 V 3.7347 7.1543 117.9464 62.7904 32.2072 176.3891 110 T 4.2156 8.2932 117.2796 61.2525 70.8449 175.5722 111 I 3.6689 8.2629 122.5620 64.9139 37.1483 178.5399 112 E 3.9453 8.1198 118.6022 59.4003 29.2019 179.2496 113 E 3.9095 8.2705 118.7028 59.3143 29.5100 179.2493 114 Q 3.9339 8.3219 118.5409 59.0516 28.7332 179.0253 115 L 3.7098 8.2022 120.1065 57.4874 41.5314 179.3332 116 A 3.8899 8.0582 120.9812 55.1211 18.2896 179.6798 117 R 3.7430 8.0867 117.3197 59.3583 30.0278 178.9723 118 V 3.1945 7.5546 118.1227 65.7316 31.5014 177.9441 119 V 3.4348 7.7485 118.3869 66.1197 31.3031 177.5751 120 E 3.9367 8.1804 118.8098 59.2989 29.4382 178.9611 121 V 3.6421 7.7796 118.2681 66.0483 31.4901 178.0981 122 F 4.4877 8.4979 117.9343 60.6550 38.7388 177.7606 123 R 3.9306 8.6787 118.1814 59.4488 29.7589 178.5174 124 Y 3.9356 7.9567 119.1013 60.6977 38.8099 177.9964 125 L 3.3829 8.1535 119.7722 57.4334 41.6275 179.3315 126 A 3.8406 8.0431 120.7844 55.0353 18.2393 179.6037 127 A 3.8022 7.6990 119.2763 55.0162 18.3447 179.6479 128 L 3.5991 7.4890 119.0628 58.2655 42.1324 179.3085 129 F 4.5022 8.1237 118.1094 60.2764 38.7436 177.5979 130 Q 3.8830 7.9213 119.5509 59.0052 28.9341 177.8961 131 K 3.8835 8.1027 120.9214 59.5270 32.1443 178.8199 132 G 2.2437 7.8616 106.0870 47.1394 0.0000 175.0515 133 F 3.9645 8.2856 123.7746 61.2110 39.2808 176.8778 134 D 4.4234 8.5958 118.4420 57.5452 40.7760 179.0024 135 V 3.5505 7.7572 118.7501 66.1170 31.4603 178.2322 136 S 4.4610 8.0066 115.2768 60.6881 62.7981 175.9520 137 D 4.1107 7.9946 121.7702 57.1886 40.7126 178.0915 138 E 3.9707 8.1270 118.1871 59.0113 29.5681 178.2773 139 E 4.3793 7.9646 115.6342 55.6217 29.8559 176.9811 140 G 3.8374 7.3777 107.1075 46.8552 0.0000 175.3226 141 D 4.6186 7.8884 121.9050 52.5241 38.6432 176.5807 142 S 4.0222 7.9061 119.1837 60.6105 63.5321 176.7095 143 V 3.4940 7.6340 121.6397 66.3238 31.4516 177.6996 144 T 3.7367 7.8744 114.9696 66.6691 68.2886 175.8513 145 N 4.4790 8.1786 120.2251 56.2494 38.8674 176.4170 146 D 4.3752 8.1781 119.2427 57.2415 41.3814 178.0793 147 I 3.5129 7.5282 120.1331 64.4302 37.0162 178.3839 148 F 3.8757 7.8174 118.4022 60.4085 38.6460 177.2128 149 N 4.3443 8.3952 116.7415 56.7502 38.6571 177.1130 150 V 3.5366 8.0076 119.5083 65.8153 31.6499 177.9009 151 A 3.5529 7.3612 121.3124 54.2092 17.9341 179.3141 152 K 3.9561 8.0862 118.1144 59.7601 32.2232 178.4792 153 A 3.9645 8.1956 121.1316 55.4254 18.2266 179.6656 154 S 4.0149 7.8404 111.4479 61.5392 62.5231 176.2577 155 I 3.4209 7.8226 122.5062 64.4866 36.8074 178.2824 156 E 4.0209 8.4389 119.4773 59.1207 29.2934 179.2324 157 K 4.2282 8.1317 119.7727 60.0807 32.2465 178.5149 158 H 4.4096 8.3501 116.4247 58.9622 28.5746 177.8236 159 I 3.8286 8.0773 121.6790 64.0848 36.9692 177.9599 160 W 4.4581 8.4511 129.1944 61.1453 30.4760 177.9179 161 M 3.3018 7.7106 118.1033 57.9716 31.3370 178.8014 162 L 3.9554 8.3437 119.5263 57.9965 41.8477 179.6765 163 Q 3.9688 8.3049 117.7654 58.7223 28.5681 178.4292 164 A 4.0466 8.4371 122.3156 55.3742 18.1965 179.1944 165 E 3.9695 8.1156 116.3859 59.3529 29.7395 178.1781 166 L 4.3890 7.5292 115.9348 54.4087 41.6699 177.3358 167 G 3.9434 8.1368 106.9354 46.1044 0.0000 173.6121 168 Q 4.6490 8.2298 116.8525 53.0986 32.2965 175.4182 169 A 4.3461 8.3494 122.4453 51.5421 19.1620 176.3417 170 P 4.4034 0.0000 0.0000 64.0394 31.8310 177.3988 171 K 3.8380 8.1371 115.1948 56.8594 29.5670 174.9722 172 L 4.1710 8.0342 121.7767 55.3649 41.4895 177.7637 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 23 A 8.12 4.36 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 24 D 8.15 4.19 0.00 2.96 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 S 9.04 4.14 0.00 3.98 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 26 K 8.20 3.84 0.00 1.95 1.86 0.00 1.66 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.53 7.81 27 A 8.23 4.03 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 28 V 8.12 3.69 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 1.05 0.00 0.00 0.75 0.00 0.00 29 L 8.35 4.19 0.00 1.94 1.79 0.94 0.51 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 30 N 8.29 4.27 0.00 2.79 2.49 0.00 0.00 6.89 6.14 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 31 Q 8.67 4.22 0.00 2.42 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.48 2.79 0.00 32 A 8.64 4.22 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 0.00 0.00 0.00 0.00 0.00 33 V 8.03 3.55 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 1.22 0.00 0.00 1.06 0.00 0.00 34 A 8.32 4.12 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.64 4.41 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 36 L 8.83 4.12 0.00 1.82 1.80 1.19 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.83 3.89 0.00 3.43 3.32 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 38 V 7.82 3.62 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 1.11 0.00 0.00 1.04 0.00 0.00 39 A 8.65 4.00 1.49 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 0.00 0.00 40 H 8.51 4.04 0.00 3.33 3.49 0.00 5.79 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.90 4.11 0.00 3.97 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.92 3.66 1.96 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.72 0.85 0.00 0.00 43 L 8.01 3.93 0.00 1.82 1.67 1.11 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 44 H 8.02 3.68 0.00 3.01 2.68 0.00 5.59 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.11 4.16 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 46 V 8.05 3.66 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 0.96 0.00 0.00 0.96 0.00 0.00 47 H 8.26 4.12 0.00 3.04 3.26 0.00 6.00 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.31 4.71 0.00 3.55 2.92 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 0.00 0.00 0.00 49 Y 8.45 4.50 0.00 3.28 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 50 M 7.54 4.38 0.00 2.24 2.35 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.96 0.00 51 R 8.82 4.63 0.00 1.91 1.80 0.00 3.29 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.74 0.00 52 G 9.01 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 0.00 0.00 0.00 53 R 8.36 4.19 0.00 1.87 1.96 0.00 3.38 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.60 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 0.00 0.00 0.00 0.00 55 F 8.82 4.12 0.00 3.35 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 56 M 8.20 4.23 0.00 2.09 2.23 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 2.58 2.73 0.00 57 I 7.53 3.64 1.63 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 1.38 0.21 -0.07 0.00 0.00 58 W 8.13 4.17 0.00 3.47 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 H 8.23 3.89 0.00 1.61 2.51 0.00 5.95 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 60 P 0.00 4.25 0.00 2.16 2.22 0.00 3.58 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 2.03 1.94 0.00 61 K 7.50 3.50 0.00 1.48 1.87 0.00 0.93 0.00 0.00 1.23 0.00 0.00 2.57 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.12 0.60 7.81 62 M 7.96 4.04 0.00 2.04 2.21 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 3.03 0.00 63 D 7.68 4.18 0.00 2.88 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 7.90 3.89 0.00 1.87 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 2.30 2.39 0.00 65 Y 7.76 4.47 0.00 3.24 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 66 M 8.49 4.07 0.00 1.89 2.18 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.25 0.00 67 E 8.34 3.89 0.00 2.15 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 2.26 2.28 0.00 68 E 8.19 3.71 0.00 2.06 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 1.76 1.99 0.00 69 I 8.11 3.80 2.18 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.80 1.03 0.00 0.00 70 D 8.57 4.46 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 71 G 7.94 3.51 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 72 Y 7.37 4.32 0.00 3.21 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 73 L 8.01 3.99 0.00 1.87 1.95 0.88 0.78 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 74 D 8.14 4.25 0.00 2.79 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 75 E 8.21 3.92 0.00 2.06 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 2.20 2.29 0.00 76 M 8.36 3.90 0.00 1.98 2.15 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 1.97 0.00 77 S 8.07 4.10 0.00 3.99 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.66 4.00 0.00 2.09 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 2.32 2.38 0.00 79 R 8.10 3.81 0.00 1.93 2.01 0.00 3.10 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 80 L 7.93 3.90 0.00 1.86 1.84 0.93 0.71 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 81 I 7.83 3.83 2.00 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 1.52 0.59 0.90 0.00 0.00 82 T 7.83 3.88 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 1.19 0.00 0.00 83 L 7.58 4.43 0.00 1.82 1.68 0.98 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.15 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 85 G 7.90 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.93 4.47 1.20 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 87 P 0.00 4.44 0.00 2.26 2.06 0.00 3.79 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 2.02 2.00 0.00 88 F 8.33 4.72 0.00 3.40 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 89 S 8.79 4.84 0.00 4.02 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 90 T 6.90 4.48 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 1.13 0.00 0.00 91 L 8.24 3.93 0.00 1.68 1.80 1.00 1.20 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 92 K 7.88 3.80 0.00 1.75 1.71 0.00 1.68 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.57 1.49 7.81 93 E 7.62 3.70 0.00 1.81 1.49 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 2.21 2.22 0.00 94 F 7.57 4.45 0.00 3.23 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 95 S 8.16 4.16 0.00 3.81 3.92 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 0.00 0.00 0.00 96 E 7.95 4.18 0.00 2.08 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 2.49 2.22 0.00 97 N 7.74 4.52 0.00 2.47 2.78 0.00 0.00 6.91 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 98 S 7.54 4.49 0.00 4.10 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 99 Q 8.75 4.31 0.00 1.92 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.54 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 100 L 7.54 4.07 0.00 1.49 1.44 0.92 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.27 4.49 0.00 1.67 1.67 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.37 7.81 102 E 8.45 4.69 0.00 1.91 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 0.00 2.19 2.27 0.00 103 V 7.75 4.51 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 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.26 4.01 0.00 1.54 1.50 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.04 2.50 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 0.00 106 D 7.32 4.36 0.00 2.56 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 0.00 0.00 0.00 0.00 107 Y 8.63 4.85 0.00 3.12 3.02 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 0.00 108 N 8.58 4.51 0.00 2.75 3.15 0.00 0.00 7.12 7.26 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 0.00 109 V 7.15 3.73 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 0.88 0.00 0.00 0.91 0.00 0.00 110 T 8.29 4.22 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 1.22 0.00 0.00 111 I 8.26 3.67 1.88 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.08 0.84 0.00 0.00 112 E 8.12 3.95 0.00 1.96 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 2.34 2.38 0.00 113 E 8.27 3.91 0.00 2.02 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 2.29 2.47 0.00 114 Q 8.32 3.93 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.63 2.61 0.00 115 L 8.20 3.71 0.00 1.45 1.27 -0.53 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 116 A 8.06 3.89 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 0.00 117 R 8.09 3.74 0.00 1.85 1.99 0.00 3.07 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 118 V 7.55 3.19 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 -0.05 0.00 0.00 0.82 0.00 0.00 119 V 7.75 3.43 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 0.80 0.00 0.00 0.89 0.00 0.00 120 E 8.18 3.94 0.00 2.13 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 0.00 2.28 2.31 0.00 121 V 7.78 3.64 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 1.09 0.00 0.00 0.91 0.00 0.00 122 F 8.50 4.49 0.00 3.19 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 0.00 123 R 8.68 3.93 0.00 1.99 2.01 0.00 3.14 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.91 0.00 124 Y 7.96 3.94 0.00 3.11 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 0.00 125 L 8.15 3.38 0.00 1.62 0.89 1.06 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.04 3.84 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 0.00 127 A 7.70 3.80 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 0.00 128 L 7.49 3.60 0.00 1.14 1.33 1.02 1.21 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 0.00 129 F 8.12 4.50 0.00 3.16 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 0.00 130 Q 7.92 3.88 0.00 2.20 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 131 K 8.10 3.88 0.00 1.81 1.90 0.00 1.52 0.00 0.00 1.59 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.35 7.81 132 G 7.86 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 0.00 0.00 0.00 0.00 0.00 0.00 133 F 8.29 3.96 0.00 3.25 3.26 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 0.00 134 D 8.60 4.42 0.00 2.84 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 V 7.76 3.55 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 1.06 0.00 0.00 0.93 0.00 0.00 136 S 8.01 4.46 0.00 4.27 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 D 7.99 4.11 0.00 2.51 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 0.00 138 E 8.13 3.97 0.00 2.12 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 2.33 2.53 0.00 139 E 7.96 4.38 0.00 1.94 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 2.29 2.51 0.00 140 G 7.38 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 0.00 141 D 7.89 4.62 0.00 2.77 2.54 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 0.00 0.00 0.00 0.00 142 S 7.91 4.02 0.00 4.04 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 0.00 143 V 7.63 3.49 2.04 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.87 3.74 4.44 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 1.36 0.00 0.00 145 N 8.18 4.48 0.00 2.64 2.76 0.00 0.00 6.45 8.76 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 0.00 146 D 8.18 4.38 0.00 2.75 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 I 7.53 3.51 1.62 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.77 0.47 0.00 0.00 148 F 7.82 3.88 0.00 3.35 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 0.00 149 N 8.40 4.34 0.00 3.28 2.92 0.00 0.00 6.89 7.87 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 0.00 150 V 8.01 3.54 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 0.99 0.00 0.00 0.99 0.00 0.00 151 A 7.36 3.55 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 K 8.09 3.96 0.00 2.07 2.08 0.00 1.67 0.00 0.00 1.56 0.00 0.00 3.08 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.49 7.81 153 A 8.20 3.96 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 0.00 154 S 7.84 4.01 0.00 3.95 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 0.00 155 I 7.82 3.42 1.84 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.71 0.71 0.00 0.00 156 E 8.44 4.02 0.00 2.03 2.04 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 2.34 2.47 0.00 157 K 8.13 4.23 0.00 2.06 2.02 0.00 1.74 0.00 0.00 1.87 0.00 0.00 3.05 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.73 1.94 7.81 158 H 8.35 4.41 0.00 3.34 3.45 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 8.08 3.83 2.16 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 1.59 1.01 1.00 0.00 0.00 160 W 8.45 4.46 0.00 3.41 3.49 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 0.00 161 M 7.71 3.30 0.00 1.93 2.01 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 2.21 1.01 0.00 162 L 8.34 3.96 0.00 1.86 1.60 0.84 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.30 3.97 0.00 2.37 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.50 2.73 0.00 164 A 8.44 4.05 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 0.00 165 E 8.12 3.97 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.42 0.00 166 L 7.53 4.39 0.00 1.80 1.76 0.80 0.86 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 0.00 167 G 8.14 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 0.00 168 Q 8.23 4.65 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.88 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 169 A 8.35 4.35 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 0.00 170 P 0.00 4.40 0.00 2.12 2.28 0.00 3.89 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 2.07 2.37 0.00 171 K 8.14 3.84 0.00 1.90 1.87 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.60 7.81 172 L 8.03 4.17 0.00 1.63 1.60 0.92 0.95 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