NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3440 8.3044 120.3458 55.6078 33.2666 174.1037 2 H 4.6636 8.7624 126.1323 53.9525 31.2754 172.2597 3 L 4.8309 7.7675 126.2564 52.3344 45.7889 176.6021 4 T 4.0158 8.7098 113.1972 60.9449 70.7087 173.6885 5 P 4.2085 0.0000 0.0000 66.1033 31.3639 178.7997 6 E 3.9619 8.0568 116.5613 59.4371 29.5828 179.1219 7 E 3.9081 8.3277 118.7825 59.2305 29.5331 179.3657 8 K 3.8690 8.4041 120.1795 59.4320 32.2564 178.8333 9 S 4.0805 8.1570 113.3168 61.2571 62.1428 176.0061 10 A 4.0196 7.9471 123.4696 54.9823 18.1062 179.8617 11 V 3.3499 7.5997 116.5062 66.3484 31.5548 178.4394 12 T 3.9765 7.9693 109.3801 64.8204 68.3498 176.2907 13 A 4.0353 7.9193 122.8058 54.7683 18.7130 179.0858 14 L 3.9369 7.9414 118.8809 57.9709 42.1505 178.9993 15 W 4.4609 8.7555 128.4676 60.1332 30.4209 178.0719 16 G 3.7228 8.0120 104.7459 46.8601 0.0000 174.6974 17 K 4.4302 7.6877 118.3640 55.4202 32.9090 176.5685 18 V 3.7005 7.0216 120.6471 61.9446 32.1438 175.7734 19 N 4.4509 8.3460 125.4907 52.5784 38.8222 175.1781 20 V 3.4777 8.1805 128.5137 66.1227 31.5543 177.3356 21 D 4.3030 7.9180 117.8622 57.3683 40.8081 178.2663 22 E 3.8409 7.9303 119.2163 59.2707 29.7541 178.8166 23 V 3.5726 7.8576 118.5274 65.6860 31.5678 178.1685 24 G 3.7186 8.4845 106.1211 47.8804 0.0000 175.8824 25 G 3.6218 8.0585 108.5697 47.3434 0.0000 175.4350 26 E 3.8990 8.2407 121.4417 58.9316 29.6541 178.8187 27 A 3.9341 8.3684 121.3632 54.9987 18.5708 179.4237 28 L 3.9795 8.1059 119.0978 58.0834 42.1741 179.3967 29 G 3.5623 7.9378 105.4370 47.9699 0.0000 175.9524 30 R 3.8885 8.1203 120.7579 58.5510 30.0057 178.7488 31 L 3.9906 7.8778 120.3335 58.4165 42.2143 179.1996 32 L 4.0959 7.7562 119.5018 56.5902 41.2541 179.6662 33 V 3.5352 7.2730 117.8477 65.7628 31.6759 177.8356 34 V 3.5904 7.8609 116.7217 63.9354 32.8596 175.5730 35 Y 3.8163 7.2247 116.1130 54.5544 37.7766 174.2056 36 P 4.8757 0.0000 0.0000 63.7213 32.0499 178.2674 37 W 4.3850 7.8030 117.0293 59.3897 28.1053 177.7835 38 T 4.2267 7.8104 110.8449 64.1382 68.1134 175.9087 39 Q 4.5002 8.1262 121.2603 57.7601 28.4666 178.0604 40 R 3.7689 7.6395 116.9224 58.5197 29.3275 177.7694 41 F 4.3786 7.1107 115.9798 57.2899 39.4260 175.6256 42 F 4.5257 7.8723 118.4598 56.7243 39.9544 177.0762 43 E 3.9735 8.5370 122.8661 59.4623 29.3591 178.2921 44 S 4.6644 8.0591 110.4791 58.5795 63.3368 174.6555 45 F 4.5591 8.4136 120.1463 58.4110 39.9634 176.1815 46 G 3.9947 8.1847 105.2003 44.0930 0.0000 174.3822 47 D 4.5351 8.6271 125.8946 54.1489 41.0900 175.6954 48 L 4.8851 8.3556 125.9611 54.4354 43.0581 178.0058 49 S 4.2994 8.0931 115.7133 60.4626 63.4113 174.7982 50 T 4.7226 7.4397 109.7280 58.3371 72.8092 172.8242 51 P 4.2065 0.0000 0.0000 66.0901 31.2511 178.7736 52 D 4.3056 8.0839 116.8253 57.1367 40.5050 178.5980 53 A 3.9756 7.9355 120.8693 54.9794 18.8230 179.5054 54 V 3.6827 8.1443 117.1801 66.6421 31.4385 178.3074 55 M 4.2264 8.2434 117.2870 57.5412 31.8721 177.9892 56 G 4.0246 7.4891 103.3058 43.3956 0.0000 173.1472 57 N 4.4741 7.5698 121.4913 52.4174 39.4081 173.9106 58 P 4.2552 0.0000 0.0000 65.9965 31.3452 178.6685 59 K 3.6945 8.2756 118.2403 58.7919 31.7269 179.5416 60 V 3.6936 7.8304 118.2717 65.9754 31.5685 178.0797 61 K 3.9481 7.9920 117.9980 59.3958 31.9282 179.2675 62 A 3.9793 8.1559 121.2107 55.3989 18.2690 179.2335 63 H 4.3845 8.4878 117.0049 59.1938 29.9816 177.5033 64 G 3.7181 8.5501 108.1585 47.9304 0.0000 175.5202 65 K 4.0378 8.0070 121.7863 59.0096 32.3201 178.9526 66 K 4.0163 7.8864 119.7102 59.2997 32.1293 179.1260 67 V 3.6370 7.9578 118.6927 66.0307 31.5181 177.8119 68 L 4.3767 8.2088 119.8616 57.5461 41.9257 179.0201 69 G 3.7446 8.3156 106.0882 47.8367 0.0000 175.6143 70 A 4.2042 7.9715 121.9112 54.5555 18.7285 179.1730 71 F 4.3829 8.6247 119.5141 61.5839 39.5622 177.1413 72 S 4.1486 8.9296 113.1951 61.8103 62.1220 175.9894 73 D 4.5456 8.4365 121.4055 57.1546 40.4762 178.8993 74 G 3.5181 8.0139 106.1272 47.0764 0.0000 175.6130 75 L 3.8703 7.2859 119.6025 56.5620 41.6252 178.1480 76 A 4.3169 7.2890 119.0059 52.4728 19.7341 176.5472 77 H 4.8816 7.9402 115.1151 54.8995 29.7387 175.4881 78 L 3.9825 7.9285 119.6082 57.4108 41.8448 178.4135 79 D 4.5520 7.8889 116.3727 55.2945 42.0041 176.3177 80 N 4.8982 7.9610 116.6816 51.8364 40.6524 174.9765 81 L 4.0894 7.7231 122.4853 57.6687 41.9149 179.3947 82 K 4.1154 8.1051 118.3179 59.5509 31.8473 179.4516 83 G 3.3833 7.6666 103.6020 47.8468 0.0000 175.7136 84 T 3.8504 7.6714 117.2157 65.5781 68.5619 175.8565 85 F 4.7596 7.9457 117.0811 57.0978 39.3179 177.3460 86 A 4.0775 7.5168 123.2742 55.7634 18.1523 180.5980 87 T 3.8727 7.8442 113.6165 66.8381 68.6008 176.9418 88 L 4.1648 7.9682 120.4063 57.4785 41.6849 179.3687 89 S 4.2873 8.4639 113.8038 61.5422 62.4357 175.9809 90 E 3.8931 8.2434 121.2938 59.2156 29.1826 179.0531 91 L 3.8975 7.9093 120.2927 58.7353 42.1306 178.9515 92 H 4.2370 8.5301 115.9887 58.5727 28.7318 177.3630 93 C 3.5345 7.7068 120.7636 62.3308 31.2169 175.3029 94 D 4.4772 8.3454 119.5127 55.9314 40.5802 177.4146 95 K 4.2937 7.7521 116.8367 57.4040 33.8423 177.1673 96 L 4.1807 7.7626 116.4873 54.7409 42.4606 176.1133 97 H 4.1300 7.1126 113.7653 56.6389 26.5881 175.3791 98 V 3.8587 7.9067 118.2277 60.8466 32.4182 174.7054 99 D 4.3180 8.8420 127.1071 54.1077 41.4372 175.2494 100 P 3.1364 0.0000 0.0000 64.2905 31.7677 177.9592 101 E 3.8994 8.1074 119.0306 59.1831 29.2404 178.4099 102 N 4.3216 8.0978 116.8579 56.1753 38.4921 177.2467 103 F 4.4569 7.3593 119.3162 60.5923 38.9034 177.9418 104 R 4.0148 7.9209 117.4076 59.0802 29.9877 178.7862 105 L 3.8199 7.8760 118.9080 57.6650 41.4946 179.3264 106 L 4.0888 8.2834 120.5560 57.9382 42.1043 179.0410 107 G 3.7562 8.1899 105.7791 47.9413 0.0000 175.7861 108 K 4.0640 8.0579 120.9384 59.1665 32.0176 179.7421 109 V 3.6223 7.8510 118.5801 65.8410 31.4114 177.7089 110 L 3.8671 8.2574 120.5409 58.2233 41.8860 179.1966 111 V 3.5716 7.8031 117.8770 66.1612 31.4214 177.7955 112 C 4.1403 8.1014 116.5830 62.8019 27.8624 176.3154 113 V 3.5326 7.9455 120.1420 65.8261 31.0451 178.1374 114 L 3.8492 7.9153 118.7298 57.5062 41.3206 179.2659 115 A 3.7709 7.3303 120.6783 55.3555 18.0893 179.2235 116 H 4.1207 7.9670 115.7664 59.5393 29.9983 176.7659 117 H 3.9816 8.1154 119.2652 58.7161 29.5947 176.5034 118 F 4.6128 8.3557 117.9794 56.0521 39.9218 177.2144 119 G 3.9718 8.8461 108.1291 46.2168 0.0000 177.7618 120 K 4.0684 8.8928 122.9945 59.2022 32.5339 177.8495 121 E 4.0456 7.8584 119.5836 58.7171 29.8799 177.1195 122 F 4.5428 7.9968 122.8577 57.0073 37.7882 175.2270 123 T 4.2154 7.3999 116.0218 59.9742 71.4050 173.5470 124 P 4.1634 0.0000 0.0000 65.6372 31.2550 177.2859 125 P 4.2613 0.0000 0.0000 65.2280 31.2409 178.9685 126 V 3.5197 7.3415 116.4239 65.8242 31.4548 177.6359 127 Q 3.5594 7.7214 119.4209 59.2225 28.7058 178.4200 128 A 4.0700 8.0093 121.2894 55.1241 18.4804 179.5159 129 A 3.9057 7.8472 118.9908 55.5279 18.4243 179.5390 130 Y 3.8770 8.2211 115.3158 61.2076 37.9541 178.5950 131 Q 4.1991 8.8823 119.4791 58.9442 28.7442 179.1006 132 K 3.9953 7.9424 119.3375 59.3581 32.0093 179.6500 133 V 3.5077 7.6470 118.0907 66.1183 31.4972 178.6255 134 V 3.8228 8.4821 112.3634 64.1379 31.3481 178.4941 135 A 4.1390 8.1653 121.0560 54.9610 18.1455 179.9067 136 G 3.5118 8.2670 104.3953 47.8476 0.0000 176.1398 137 V 3.3285 7.9637 120.7622 65.5273 31.6913 177.8226 138 A 3.8942 7.9307 120.4626 55.4467 17.9932 179.4184 139 N 4.3275 8.0966 113.4786 56.3212 38.4472 177.2379 140 A 4.1505 8.1909 122.4531 55.1169 18.2471 179.6348 141 L 3.9006 7.6842 116.2533 56.9441 41.8287 178.4598 142 A 4.3970 7.8407 118.7849 52.8821 18.7366 178.5202 143 H 4.3238 7.9663 116.8314 58.4810 29.9926 175.8118 144 K 4.4628 8.0052 117.7044 56.2294 32.0919 176.3701 145 Y 4.1575 7.9080 117.4148 58.6274 38.3858 175.8551 146 H 4.4240 8.4318 117.1401 56.3100 28.0927 173.4703 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.34 0.00 2.11 2.02 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 2.43 2.47 0.00 2 H 8.76 4.66 0.00 3.19 3.17 0.00 5.72 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.77 4.83 0.00 1.50 1.40 0.78 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.71 4.02 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 1.22 0.00 0.00 5 P 0.00 4.21 0.00 2.16 2.14 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 6 E 8.06 3.96 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 7 E 8.33 3.91 0.00 2.14 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 2.28 2.26 0.00 8 K 8.40 3.87 0.00 1.86 1.74 0.00 1.57 0.00 0.00 1.52 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.35 7.81 9 S 8.16 4.08 0.00 4.03 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 10 A 7.95 4.02 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 11 V 7.60 3.35 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 0.62 0.00 0.00 0.47 0.00 0.00 12 T 7.97 3.98 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 1.22 0.00 0.00 13 A 7.92 4.04 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 14 L 7.94 3.94 0.00 1.92 1.98 0.21 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.76 4.46 0.00 3.80 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 16 G 8.01 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 0.00 0.00 0.00 17 K 7.69 4.43 0.00 1.99 2.10 0.00 1.69 0.00 0.00 1.56 0.00 0.00 3.16 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.45 7.81 18 V 7.02 3.70 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.15 0.00 0.00 0.74 0.00 0.00 19 N 8.35 4.45 0.00 2.78 2.59 0.00 0.00 6.83 7.71 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 20 V 8.18 3.48 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 1.21 0.00 0.00 0.99 0.00 0.00 21 D 7.92 4.30 0.00 2.69 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 22 E 7.93 3.84 0.00 1.95 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 2.23 2.27 0.00 23 V 7.86 3.57 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 0.92 0.00 0.00 0.67 0.00 0.00 24 G 8.48 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 0.00 0.00 0.00 25 G 8.06 3.62 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 0.00 0.00 0.00 26 E 8.24 3.90 0.00 2.11 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 0.00 2.24 2.31 0.00 27 A 8.37 3.93 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 28 L 8.11 3.98 0.00 1.76 1.63 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 29 G 7.94 3.56 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 0.00 0.00 0.00 0.00 30 R 8.12 3.89 0.00 1.82 1.91 0.00 3.08 0.00 0.00 3.01 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 31 L 7.88 3.99 0.00 1.87 1.88 1.00 0.77 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 32 L 7.76 4.10 0.00 1.84 1.66 0.72 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.27 3.54 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.96 0.00 0.00 34 V 7.86 3.59 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.06 0.00 0.00 0.73 0.00 0.00 35 Y 7.22 3.82 0.00 2.50 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.88 0.00 2.30 2.27 0.00 3.69 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.86 0.00 37 W 7.80 4.38 0.00 3.56 3.50 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 38 T 7.81 4.23 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 1.19 0.00 0.00 39 Q 8.13 4.50 0.00 2.27 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 40 R 7.64 3.77 0.00 1.68 1.97 0.00 3.02 0.00 0.00 2.72 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.50 0.00 41 F 7.11 4.38 0.00 1.89 2.37 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 42 F 7.87 4.53 0.00 2.80 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 0.00 0.00 0.00 43 E 8.54 3.97 0.00 1.95 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 2.26 2.22 0.00 44 S 8.06 4.66 0.00 4.10 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 45 F 8.41 4.56 0.00 3.21 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 46 G 8.18 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.63 4.54 0.00 2.65 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 48 L 8.36 4.89 0.00 1.66 1.62 1.05 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.09 4.30 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 50 T 7.44 4.72 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 1.21 0.00 0.00 51 P 0.00 4.21 0.00 2.14 2.10 0.00 3.58 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 2.08 2.15 0.00 52 D 8.08 4.31 0.00 2.67 2.70 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 0.00 0.00 0.00 53 A 7.94 3.98 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 54 V 8.14 3.68 2.19 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 1.01 0.00 0.00 0.97 0.00 0.00 55 M 8.24 4.23 0.00 1.98 2.08 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 2.59 2.86 0.00 56 G 7.49 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 57 N 7.57 4.47 0.00 2.99 2.84 0.00 0.00 6.90 7.02 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 58 P 0.00 4.26 0.00 2.24 2.25 0.00 3.72 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 59 K 8.28 3.69 0.00 1.56 0.74 0.00 1.56 0.00 0.00 1.29 0.00 0.00 2.74 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.15 1.24 7.81 60 V 7.83 3.69 2.25 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 1.10 0.00 0.00 1.02 0.00 0.00 61 K 7.99 3.95 0.00 1.96 1.81 0.00 1.69 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.63 7.81 62 A 8.16 3.98 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 63 H 8.49 4.38 0.00 3.57 3.52 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.55 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 0.00 0.00 0.00 65 K 8.01 4.04 0.00 1.86 2.06 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.46 1.62 7.81 66 K 7.89 4.02 0.00 1.93 1.98 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.51 7.81 67 V 7.96 3.64 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 0.98 0.00 0.00 0.92 0.00 0.00 68 L 8.21 4.38 0.00 2.04 1.80 0.77 1.22 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 69 G 8.32 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.97 4.20 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.62 4.38 0.00 3.28 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 72 S 8.93 4.15 0.00 4.62 4.31 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 0.00 0.00 0.00 0.00 73 D 8.44 4.55 0.00 2.88 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 8.01 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.29 3.87 0.00 1.51 1.45 -0.47 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.29 4.32 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 77 H 7.94 4.88 0.00 3.08 3.15 0.00 5.82 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 78 L 7.93 3.98 0.00 1.54 1.64 0.76 0.95 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 79 D 7.89 4.55 0.00 2.64 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 80 N 7.96 4.90 0.00 2.66 2.61 0.00 0.00 7.12 6.28 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 81 L 7.72 4.09 0.00 1.76 1.86 0.88 0.92 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 82 K 8.11 4.12 0.00 1.76 1.82 0.00 1.50 0.00 0.00 1.31 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.45 7.81 83 G 7.67 3.38 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 0.00 84 T 7.67 3.85 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 85 F 7.95 4.76 0.00 3.13 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 86 A 7.52 4.08 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 87 T 7.84 3.87 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 88 L 7.97 4.16 0.00 2.00 1.86 1.12 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.46 4.29 0.00 4.03 4.14 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 0.00 0.00 0.00 90 E 8.24 3.89 0.00 2.21 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.58 0.00 91 L 7.91 3.90 0.00 1.87 1.90 0.91 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 92 H 8.53 4.24 0.00 3.71 3.73 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.71 3.53 0.00 1.23 2.37 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 94 D 8.35 4.48 0.00 2.69 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.75 4.29 0.00 1.80 1.78 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.34 7.81 96 L 7.76 4.18 0.00 1.72 1.63 0.72 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.11 4.13 0.00 3.46 3.40 0.00 5.64 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.91 3.86 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 0.08 0.00 0.00 0.44 0.00 0.00 99 D 8.84 4.32 0.00 2.87 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 0.00 100 P 0.00 3.14 0.00 1.91 1.75 0.00 3.38 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.44 0.00 101 E 8.11 3.90 0.00 2.05 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 2.31 2.40 0.00 102 N 8.10 4.32 0.00 2.43 2.73 0.00 0.00 6.88 8.81 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 0.00 103 F 7.36 4.46 0.00 3.09 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.92 4.01 0.00 1.99 1.97 0.00 3.30 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 105 L 7.88 3.82 0.00 1.73 1.40 0.80 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.28 4.09 0.00 1.81 1.88 0.92 0.95 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 0.00 107 G 8.19 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 K 8.06 4.06 0.00 2.05 1.95 0.00 1.68 0.00 0.00 1.53 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.47 7.81 109 V 7.85 3.62 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 1.13 0.00 0.00 1.13 0.00 0.00 110 L 8.26 3.87 0.00 1.75 1.82 0.91 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.80 3.57 2.31 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 1.27 0.00 0.00 1.15 0.00 0.00 112 C 8.10 4.14 0.00 3.19 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 0.00 113 V 7.95 3.53 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 1.00 0.00 0.00 0.94 0.00 0.00 114 L 7.92 3.85 0.00 0.91 1.07 0.60 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.33 3.77 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 0.00 116 H 7.97 4.12 0.00 3.17 3.41 0.00 5.78 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.12 3.98 0.00 2.93 2.70 0.00 5.98 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 0.00 118 F 8.36 4.61 0.00 3.28 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 0.00 119 G 8.85 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 0.00 0.00 0.00 120 K 8.89 4.07 0.00 1.92 2.00 0.00 1.62 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.48 7.81 121 E 7.86 4.05 0.00 2.06 2.29 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 2.32 2.28 0.00 122 F 8.00 4.54 0.00 3.05 3.14 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 0.00 0.00 0.00 123 T 7.40 4.22 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 1.30 0.00 0.00 124 P 0.00 4.16 0.00 2.15 2.14 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 125 P 0.00 4.26 0.00 2.11 2.06 0.00 3.49 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.34 3.52 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.89 0.00 0.00 127 Q 7.72 3.56 0.00 1.71 2.10 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 2.41 2.56 0.00 128 A 8.01 4.07 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 0.00 129 A 7.85 3.91 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 8.22 3.88 0.00 3.44 3.28 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 0.00 131 Q 8.88 4.20 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.73 2.62 0.00 132 K 7.94 4.00 0.00 1.90 1.82 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.62 7.81 133 V 7.65 3.51 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.72 0.00 0.00 134 V 8.48 3.82 2.19 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 1.00 0.00 0.00 1.13 0.00 0.00 135 A 8.17 4.14 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 0.00 136 G 8.27 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 0.00 137 V 7.96 3.33 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.72 0.00 0.00 138 A 7.93 3.89 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 0.00 139 N 8.10 4.33 0.00 2.90 2.89 0.00 0.00 7.05 6.87 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 0.00 140 A 8.19 4.15 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 0.00 141 L 7.68 3.90 0.00 1.00 0.74 -0.04 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.84 4.40 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 143 H 7.97 4.32 0.00 3.37 3.51 0.00 5.76 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.01 4.46 0.00 1.84 1.82 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.51 1.75 7.81 145 Y 7.91 4.16 0.00 3.08 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 0.00 146 H 8.43 4.42 0.00 3.22 3.23 0.00 5.75 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