NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3592 8.2649 123.5833 51.9252 18.7584 176.3105 3 R 3.9114 8.5322 121.3370 58.8484 30.6340 176.3533 4 R 4.4408 8.7292 115.2491 57.9147 33.0120 176.5799 5 R 4.2651 7.5396 117.7308 55.9414 31.4322 176.5896 6 R 4.2361 8.3248 122.7226 55.7553 31.2362 175.4090 7 A 3.9733 8.6752 128.7972 52.7088 18.7010 176.4341 8 E 4.4849 8.4656 120.9315 54.3828 31.4120 176.3651 9 V 3.6286 8.2097 120.9532 63.0720 32.0266 176.1917 10 R 4.0793 8.4889 126.1855 56.1682 30.6467 175.5190 11 Q 4.5653 8.5075 121.8821 54.2764 30.8348 174.8346 12 L 4.7050 8.2690 124.4181 52.8852 44.3970 175.9433 13 Q 4.3043 8.3883 120.0917 54.0492 28.9050 174.5046 14 P 4.4071 0.0000 0.0000 62.7127 31.8477 175.2435 15 D 4.2585 8.7730 118.2634 54.6626 41.2155 177.5494 16 L 4.3921 8.7020 124.5221 55.4470 41.5325 177.5242 17 V 4.2004 7.8457 117.9267 63.1761 33.6578 175.6128 18 Y 4.4866 7.9928 113.8767 56.8067 39.8388 175.4056 19 G 3.8123 8.5210 107.4692 46.8613 0.0000 173.2162 20 D 4.9195 7.8294 117.0588 52.1713 43.4892 176.3029 21 V 3.8478 8.3411 118.5348 63.0581 32.3955 177.9032 22 L 4.3704 8.1355 121.7285 57.4264 42.6561 178.8651 23 V 3.5103 7.7453 117.2029 66.1843 31.4410 178.2345 24 T 3.7496 7.8057 114.7858 66.3519 68.1156 176.3610 25 A 4.0963 7.4142 122.2661 54.4586 18.7318 178.9618 26 F 4.4526 7.7506 119.0345 61.1510 39.5604 177.6489 27 I 3.3103 7.8384 119.7336 64.2837 36.6322 178.0799 28 N 4.2969 7.7957 115.8771 55.6389 38.3566 176.2690 29 K 4.1761 7.4229 118.3208 57.7561 32.7020 177.9856 30 I 3.8539 7.1028 118.2653 62.9917 37.5835 176.1335 31 M 4.1771 7.5743 120.1983 55.5655 32.5921 175.4478 32 R 4.4135 8.3587 118.2218 56.7057 31.8363 174.2299 33 D 4.4062 9.4700 118.9365 55.3422 38.4730 174.5883 34 G 4.3233 8.6238 115.3983 46.8784 0.0000 175.9769 35 K 4.9348 6.6306 121.0532 56.2517 28.5414 175.9783 36 K 4.1060 8.5619 121.7756 58.8680 32.7319 176.2451 37 N 4.2878 8.3030 117.3171 57.2562 38.6122 176.0267 38 L 4.0561 7.7806 121.2066 57.8577 42.1326 179.1579 39 A 3.9079 7.7036 120.0026 54.6644 18.1239 179.2784 40 A 4.1256 7.8594 119.0406 54.7934 18.8082 179.8107 41 R 4.1650 7.9215 116.4624 59.6035 30.1064 179.0829 42 I 3.8215 7.9762 119.5795 64.6019 37.1976 178.0506 43 F 4.1280 7.6298 121.5525 61.6917 39.0870 176.8524 44 Y 4.0941 7.9694 116.3096 61.1451 37.6576 177.7816 45 D 4.4524 9.0463 120.6306 57.3619 40.8153 178.8779 46 A 4.0729 8.7067 121.8120 55.4647 18.2971 179.4442 47 C 3.8955 8.1388 115.5220 62.7995 27.9898 176.6795 48 K 4.0155 8.5483 120.5418 59.5277 31.6204 179.5317 49 I 3.7273 8.0578 120.3161 64.1618 36.9500 178.3972 50 I 3.8134 8.0249 121.0778 64.7922 36.7929 178.5174 51 Q 4.2810 7.5478 118.4032 58.2092 28.5107 178.5733 52 E 4.1191 8.1697 119.3780 59.8956 29.6816 178.9315 53 K 4.0009 8.8025 118.5262 57.3444 32.2654 176.4277 54 T 4.6090 7.9401 113.2596 60.2147 69.4512 175.4738 55 G 3.7733 8.5258 116.6926 46.1754 0.0000 173.2367 56 Q 4.6712 7.2060 117.7650 53.0245 32.4280 175.7442 57 E 4.1606 8.7405 120.5286 56.5119 29.8236 176.5226 58 P 4.4190 0.0000 0.0000 64.4773 32.4555 178.2753 59 L 3.8328 7.8619 121.1716 58.0246 42.3333 178.2213 60 K 3.9776 7.9568 119.1049 59.5076 32.1403 178.7536 61 V 3.6349 7.5074 117.8325 65.6686 31.3123 177.7258 62 F 4.0070 7.9393 120.1495 61.3928 39.1318 177.3378 63 K 4.0245 8.3288 117.8849 58.9858 31.7977 179.3447 64 Q 3.8668 7.8683 119.5546 59.1207 28.5681 177.9772 65 A 4.3269 8.2220 123.6070 54.6134 18.2600 179.8202 66 V 3.1966 7.3213 116.7773 65.8361 31.3077 177.7993 67 E 3.8265 7.6428 118.0864 59.3641 29.6166 178.0683 68 N 4.5513 7.9170 113.3911 54.3844 38.7968 175.6958 69 V 4.1008 6.8941 118.1549 62.6511 33.7301 175.3871 70 K 4.2524 8.6351 120.0767 55.6553 31.7359 175.6701 71 P 4.6203 0.0000 0.0000 63.2485 32.1970 174.6140 72 R 4.8275 8.2443 109.2887 57.5688 35.8486 174.7461 73 M 5.0402 7.9584 118.1317 53.7000 36.0115 174.0472 74 E 4.7518 9.0247 122.8432 54.9880 34.3161 173.3792 75 V 4.8749 8.1831 119.3259 61.1061 34.6866 174.7802 76 R 4.3821 8.4445 124.7819 54.2825 34.1741 174.3569 77 S 5.1959 8.4478 118.3868 57.4803 64.3117 173.3640 78 R 4.6497 9.4160 126.3045 54.6006 31.9395 176.3271 79 R 4.9814 8.2615 125.8060 54.1236 28.6958 177.1217 80 V 3.4703 7.7355 120.1650 64.4376 32.3610 174.3887 81 G 3.2116 6.8337 112.6718 43.7825 0.0000 174.5652 82 G 4.9014 7.3546 121.4546 46.5232 0.0000 172.0937 83 A 4.6412 7.0314 119.7867 50.4922 23.4076 175.6223 84 N 5.0880 8.7201 116.8796 52.7924 37.7844 173.8696 85 Y 3.7390 9.5984 121.8808 57.5358 39.2942 175.0650 86 Q 4.4085 8.4705 123.8012 56.0032 29.3085 176.1620 87 V 4.3748 8.7783 126.8998 60.6603 32.5665 172.8923 88 P 5.1294 0.0000 0.0000 62.7046 32.5714 175.2426 89 M 4.9178 8.8219 121.0470 53.1893 34.6868 174.5644 90 E 4.8095 8.5693 123.2301 56.0004 31.7628 177.2464 91 V 4.3566 8.1267 124.4103 61.2326 34.8587 175.2295 92 S 4.2501 8.7241 121.9349 57.4807 63.5341 173.0219 93 P 4.7427 0.0000 0.0000 65.1726 30.9673 178.1044 94 R 3.9713 7.9231 118.7227 59.4948 30.3085 177.8574 95 R 4.0615 7.7947 117.3357 58.2792 30.4447 178.0675 96 Q 4.0819 8.4789 120.1169 59.4999 29.0162 177.4825 97 Q 4.0363 7.9979 120.8630 59.1205 29.2372 178.0765 98 S 4.0981 7.8771 115.3419 61.7631 63.0328 176.7525 99 L 3.6093 7.4210 120.5521 57.3819 41.1764 179.4531 100 A 4.3703 7.7064 119.8815 55.3300 18.4399 179.7294 101 L 3.9926 7.8140 117.0680 58.0098 41.7734 179.7869 102 R 3.9621 8.1913 118.6886 59.0801 30.0531 178.6455 103 W 4.3916 8.7991 119.4288 59.7044 29.0259 178.4858 104 L 4.1120 8.1906 119.1326 57.6302 40.9941 179.7934 105 V 3.6712 7.9687 118.0469 66.3450 31.8001 178.2006 106 Q 4.1955 8.1712 117.3416 58.7950 28.2447 178.8866 107 A 4.1884 7.9117 120.7582 54.7769 18.7517 179.1499 108 A 4.3287 8.3231 121.1401 54.8403 18.2208 179.6974 109 N 4.4200 8.4807 114.6467 56.5596 38.7989 177.4136 110 Q 4.1543 7.5587 116.3513 56.8991 29.1821 177.1756 111 R 4.1239 6.9433 118.4318 55.3231 30.8546 174.9987 112 P 4.3601 0.0000 0.0000 65.7916 31.4326 176.8973 113 E 4.0426 8.0996 117.4984 56.1234 29.5626 177.5646 114 R 4.2183 8.3753 117.3619 57.1250 30.8227 177.3421 115 R 4.7153 7.5422 116.6809 53.3115 35.4957 175.8573 116 A 4.0114 8.5819 123.2801 55.2077 18.5837 180.0620 117 A 3.9885 7.9940 118.9171 55.3918 18.5059 179.9294 118 V 3.5495 7.6970 116.2209 66.1731 31.8400 178.3438 119 R 4.2448 7.9808 117.8293 59.0145 29.6134 178.6999 120 I 4.2298 7.7407 118.2014 63.1251 37.8063 177.8224 121 A 4.1726 7.8772 121.7508 55.5825 18.3130 179.2721 122 H 4.1231 8.8298 114.7466 58.9973 29.0923 177.2128 123 E 4.2210 8.2191 118.4738 57.5461 29.1668 177.5866 124 L 4.3712 7.7973 118.2025 57.4150 42.0996 178.6973 125 M 3.9323 7.8420 118.3854 58.4523 32.1485 178.3587 126 D 4.3223 8.1254 118.7835 57.3315 41.0892 178.5652 127 A 4.1056 7.6693 118.9013 54.0768 18.0915 179.1105 128 A 4.0699 7.2995 118.5454 54.4885 18.8136 179.4079 129 E 4.1393 7.6118 116.6511 59.3262 29.7068 177.6168 130 G 4.0132 6.2023 114.7616 45.2435 0.0000 172.3456 131 K 4.5228 7.6873 118.3983 55.4357 35.8249 174.9686 132 G 4.1753 9.0794 106.3469 43.6827 0.0000 175.3178 133 G 3.8842 8.9555 107.3712 47.0736 0.0000 175.7118 134 A 4.1121 7.7574 122.3824 54.8799 19.2021 179.5685 135 V 3.3882 7.5268 116.2984 65.6961 31.5387 177.7807 136 K 3.9591 8.4246 121.0649 59.0491 32.1675 178.9878 137 K 3.7809 7.4936 117.9381 58.2474 31.7609 179.4874 138 K 2.9930 6.9660 120.6525 59.2465 32.2255 178.6232 139 E 4.4565 7.7052 120.1116 58.9019 29.2520 179.1493 140 D 4.3862 8.1410 119.2159 57.4432 41.0363 179.0682 141 V 3.7211 7.2400 117.8428 65.7574 31.5968 177.9380 142 E 4.0135 8.2083 118.7127 58.9271 29.0588 179.4523 143 R 3.8939 7.9433 118.3058 59.3858 29.8819 178.5275 144 M 3.9529 8.5601 118.4538 57.5391 32.2101 176.8672 145 A 4.2528 7.1405 120.1121 52.9935 19.2619 176.4304 146 E 4.1648 9.0075 121.8118 56.3209 29.6397 175.9163 147 A 4.0674 7.6040 120.6693 54.9800 18.9466 178.2213 148 N 4.7274 7.2222 113.2041 52.6918 38.1590 176.0196 149 R 3.9601 7.8894 121.0813 59.4392 31.2259 178.0791 150 A 3.9294 7.8314 119.8114 55.5209 18.5437 178.3291 151 Y 3.8437 7.6533 112.1400 60.4172 38.4898 178.7345 152 A 3.9651 8.9355 125.2998 55.4042 18.6009 179.2242 153 H 4.3500 8.3708 109.4057 58.1497 28.5556 176.1025 154 Y 4.2504 8.3738 118.2510 59.4041 38.0337 177.0508 155 R 4.3949 8.8506 122.9966 55.9736 29.4599 176.0167 156 W 3.7135 8.1233 129.4697 57.8195 31.6170 173.3975 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 4.27 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 8.68 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 8.47 4.48 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 1.85 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 4.57 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 12 L 8.27 4.71 0.00 1.63 1.54 0.92 0.97 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 13 Q 8.39 4.30 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.93 0.00 0.00 0.00 0.00 0.00 2.34 2.29 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 7.85 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 0.14 0.78 0.00 0.00 28 N 7.80 4.30 0.00 2.88 2.84 0.00 0.00 7.05 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.42 4.18 0.00 1.80 1.80 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.59 7.81 30 I 7.10 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 0.86 -0.02 0.82 0.00 0.00 31 M 7.57 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 9.47 4.41 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 8.56 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 4.17 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 8.02 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 3.77 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 0.00 0.00 0.00 56 Q 7.21 4.67 0.00 2.02 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 0.53 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 3.63 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 1.85 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 8.64 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 8.24 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 9.02 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 8.44 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 6.83 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 4.90 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 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 3.19 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 1.93 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 7.79 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 6.60 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 1.29 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 1.04 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 1.08 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 7.47 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 0.00 110 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 1.49 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 0.00 122 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 4.11 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 6.20 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 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 3.88 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 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 2.99 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 3.72 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 1.98 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 4.16 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 8.94 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