NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1716 8.1627 120.2885 54.5910 32.9937 174.0208 2 K 3.7303 8.5936 128.2642 56.7140 32.5524 175.0027 3 G 3.9697 8.6022 115.7974 44.7532 0.0000 171.7651 4 D 4.5395 8.3988 119.7064 53.7568 41.9234 176.5561 5 K 3.8309 9.1228 127.0217 60.1428 32.1804 178.8346 6 I 3.6649 7.8750 119.1685 63.9228 36.9416 178.5510 7 V 3.7414 8.4229 119.5167 66.1605 31.4004 178.1246 8 I 3.7471 7.9063 119.5795 64.4760 36.9431 178.4310 9 Q 3.9441 8.0657 118.8744 59.2290 28.5362 178.6098 10 H 4.0844 8.1589 117.1077 58.9152 28.7359 177.8300 11 L 4.0442 8.3578 121.1503 58.0047 41.4503 179.4426 12 N 4.3507 8.4313 116.5182 55.8055 38.4745 177.4346 13 K 3.8916 7.8740 121.0850 59.6294 32.2964 178.8351 14 I 3.6924 7.8104 120.0097 64.3586 36.9955 178.0258 15 L 4.0240 8.1970 121.3026 58.2592 41.7426 179.3086 16 G 3.5988 8.1099 105.5064 47.8065 0.0000 175.4537 17 N 4.3415 8.0122 118.5936 56.1516 38.5922 177.3669 18 E 3.9502 8.3969 120.1222 59.4440 29.6903 179.3540 19 L 4.0254 8.0704 119.0325 57.7683 41.5324 179.7462 20 I 3.6051 7.5476 119.2424 64.2459 36.9878 178.2204 21 A 3.2599 7.7405 121.5026 54.9303 18.1195 179.3667 22 I 3.5698 7.9296 118.5617 64.9127 37.2615 178.3848 23 N 4.3325 7.8908 116.3396 56.2238 38.3541 177.3262 24 Q 3.8706 8.1115 121.1212 59.5890 29.2192 178.0838 25 Y 4.4563 8.0001 118.0341 61.0707 37.8549 178.2443 26 F 3.9415 8.4304 121.8488 60.9105 39.4372 177.0591 27 L 3.9728 8.1682 120.0674 58.5756 41.9057 178.6132 28 H 3.9216 8.3579 115.9972 58.6167 28.5676 177.5222 29 A 4.1379 8.4773 122.8620 55.5623 18.1957 180.0438 30 R 3.8427 7.7639 116.2152 59.2427 30.1104 179.2466 31 M 3.5073 7.7861 118.9661 58.0748 31.6774 178.3172 32 Y 4.3915 7.6916 116.9577 61.3171 38.0640 178.4568 33 E 3.9863 8.1759 119.4833 59.5171 29.3234 178.9155 34 D 4.3033 8.1202 117.4431 56.7786 41.2994 177.4605 35 W 4.9465 7.7782 116.6163 56.4376 29.3875 177.0220 36 G 3.9663 8.4161 108.1837 45.9690 0.0000 174.3337 37 L 4.8275 8.1002 122.1708 52.6009 40.1150 176.7013 38 E 3.9557 8.2809 122.6880 59.6233 29.9390 179.1577 39 K 4.0277 8.0125 118.0593 59.4839 32.1104 179.5037 40 L 4.0475 7.7887 118.9232 57.4504 41.4569 179.5206 41 G 3.7026 8.1810 105.7757 47.7410 0.0000 175.5958 42 K 3.8668 8.3239 122.9020 59.3861 32.2464 178.3958 43 H 3.9343 8.1435 118.4348 59.1512 29.8825 176.8553 44 E 3.8567 8.6911 121.6084 59.2215 29.4491 178.1713 45 Y 3.8799 8.3485 120.0271 61.1242 38.8794 177.8765 46 H 4.1211 8.1743 117.0000 58.7076 28.6477 177.7236 47 E 3.8162 7.9608 120.6429 59.1582 29.1896 179.2237 48 S 4.2130 7.8701 112.9893 61.6036 62.5360 176.3587 49 I 3.6406 7.5390 122.4431 64.3384 36.7378 178.2276 50 D 4.2836 8.1180 119.9767 57.3703 40.5412 178.6659 51 E 3.9665 8.4182 119.2116 59.4415 29.4061 179.2707 52 M 4.0255 8.0536 118.9866 58.3375 32.0113 178.9504 53 K 4.0195 8.0357 118.6388 59.5560 32.1702 179.1575 54 H 4.2519 8.2629 116.3554 58.8735 28.5904 177.6128 55 A 3.9823 8.2841 122.7831 55.1924 18.1968 179.0290 56 D 4.2710 8.1992 116.4579 57.6106 41.2943 178.7621 57 K 4.0098 8.1905 118.8294 59.3576 31.9406 179.4212 58 L 4.0092 7.9624 119.2822 57.7821 41.5971 179.4277 59 I 3.7033 8.0323 120.0526 64.5228 37.0829 178.5710 60 K 4.0009 8.1802 119.1320 59.4814 31.8223 179.4397 61 R 4.0120 8.1400 118.9375 59.4560 30.0513 178.5941 62 I 3.7241 8.1571 120.0247 64.4661 37.1433 178.4479 63 L 4.0607 8.0790 119.7852 57.6787 41.2048 179.3452 64 F 4.3736 8.0669 119.7256 61.2640 39.7192 176.6234 65 L 4.2125 7.9856 117.0862 53.9867 41.0604 177.0052 66 E 3.8620 7.9129 117.5624 57.5005 27.2162 174.5156 67 G 3.9485 8.3042 107.7457 43.9929 0.0000 173.6565 68 L 4.5575 7.9900 118.8402 51.9345 42.4656 175.2385 69 P 4.3906 0.0000 0.0000 62.6259 31.7373 176.3183 70 N 4.6551 8.8188 122.1222 52.3986 37.9144 174.2388 71 L 4.5167 8.0817 123.1712 54.3988 42.7459 177.8673 72 Q 4.0570 8.1113 120.5208 58.6802 29.3311 176.0314 73 E 4.2454 8.3493 117.0820 55.4272 30.2187 175.7336 74 L 4.5574 8.2647 124.5752 52.8174 44.3342 176.4928 75 G 3.7858 8.4610 115.4601 44.6756 0.0000 171.7807 76 K 4.1208 8.3120 120.7526 55.5502 32.2545 176.6850 77 L 4.1551 8.3931 126.8564 54.8092 42.1937 177.5235 78 L 4.4834 8.9480 124.0316 53.2756 40.6746 174.4750 79 I 4.1697 7.9342 122.4976 60.0297 37.8604 176.6134 80 G 3.9959 8.7807 114.6680 45.1066 0.0000 172.6743 81 E 4.7166 8.9742 117.9553 56.5571 31.1654 176.4500 82 H 4.9892 7.6300 113.6316 52.9975 32.9299 173.8088 83 T 4.2597 8.7216 117.7784 67.2836 68.3192 176.2150 84 K 3.8480 8.2963 120.4223 59.7659 32.0970 178.2044 85 E 4.0845 8.1227 118.8597 59.5808 29.6313 178.5344 86 M 4.0298 8.4519 119.1255 58.2554 31.9727 178.7544 87 L 4.1451 8.3429 119.4124 57.9345 41.7401 179.4566 88 E 4.0218 8.3555 118.5162 59.5530 29.3915 179.1876 89 C 4.2161 8.5050 117.1514 63.0507 28.2425 175.9743 90 D 4.6771 8.4193 120.5098 57.1831 40.3038 178.6362 91 L 3.9788 8.1097 121.0313 58.0416 42.1427 178.9000 92 K 3.9350 8.4655 120.0361 59.2825 31.8587 178.5122 93 L 3.9676 7.9289 119.7407 58.3639 42.2874 178.5278 94 E 4.2064 8.3755 118.4920 59.6324 28.7351 179.4409 95 Q 4.0491 8.5371 117.9161 58.4990 28.5390 178.1623 96 A 4.3074 8.0281 120.9604 54.0910 18.8437 179.1482 97 G 3.7752 7.7870 104.3979 46.7894 0.0000 175.9358 98 L 3.9856 7.3697 121.8637 57.7514 41.7482 177.5876 99 P 4.2471 0.0000 0.0000 65.9690 31.1539 178.4393 100 D 4.3403 7.9175 116.9520 57.3308 40.8271 178.5782 101 L 3.9928 7.9368 119.4408 57.8726 41.6073 179.8195 102 K 3.9943 8.3195 118.2725 59.3627 31.9618 179.3543 103 A 4.0093 8.1171 120.9691 54.8845 18.1625 179.6245 104 A 3.7103 7.9344 119.5356 55.2024 18.5014 179.9305 105 I 3.6419 8.1526 118.5294 64.4067 37.1823 178.4864 106 A 4.0007 8.2071 121.7335 55.3798 18.3293 179.1021 107 Y 3.8325 8.1086 117.9824 60.9752 38.8868 177.8601 108 C 4.0402 8.4329 118.0384 62.6759 28.2754 175.7854 109 E 3.9258 8.1969 121.1325 59.3049 29.0794 179.0307 110 S 4.1060 7.7521 112.9597 60.6172 62.9177 175.8530 111 V 4.0965 6.9226 112.5424 60.1874 31.7726 176.3999 112 G 2.9811 7.1623 106.0527 46.2519 0.0000 175.4695 113 D 4.4397 7.3140 121.3127 52.8319 38.1498 176.2275 114 Y 4.2871 7.2067 121.1752 60.6244 38.5270 177.7168 115 A 4.0974 8.0713 121.4437 55.3004 18.6002 179.7282 116 S 4.1500 8.4488 113.8059 61.5598 62.7790 176.8267 117 R 3.9303 7.9730 121.2334 59.5109 29.9650 178.4291 118 E 3.9870 8.3639 118.3908 59.1745 29.4943 179.0937 119 L 3.9512 7.8846 120.1063 58.2858 42.1927 179.0361 120 L 4.0229 8.0304 118.8537 57.9407 41.5313 179.4462 121 E 4.0626 8.6238 118.8669 59.4347 29.1488 179.1618 122 D 4.5725 8.0510 118.7075 57.3562 40.7721 178.8939 123 I 3.5919 7.5409 119.9650 64.0445 37.0666 178.0924 124 L 3.9468 8.2995 121.6633 58.2195 41.3645 178.8162 125 E 3.9722 8.1968 118.4226 59.6498 29.4458 179.3892 126 S 4.1914 7.8564 112.9636 61.4401 62.4326 176.0453 127 E 4.2153 8.4790 121.5746 59.4949 29.1163 179.0413 128 E 4.1878 8.5328 118.1124 58.6676 29.3750 179.0701 129 D 4.4327 7.7435 118.7940 57.4723 41.0036 178.0212 130 H 4.3445 8.3116 118.7601 59.4973 29.8388 177.3512 131 I 3.7682 7.9541 121.6779 64.1784 36.8892 177.9116 132 D 4.3064 7.9137 119.0711 57.0943 41.1660 178.0081 133 W 4.1167 8.5862 129.0898 60.4972 30.7708 177.8103 134 L 3.8210 8.5697 119.1470 57.9979 41.1571 179.4135 135 E 3.9338 8.5924 118.7801 59.6704 29.2377 179.6754 136 T 3.7784 7.8435 115.7875 66.5486 68.3805 176.7973 137 Q 3.5763 7.4930 119.8691 58.8122 28.5104 178.8314 138 L 3.7272 7.4753 119.7915 57.8320 41.6333 179.3959 139 D 4.3036 7.9413 118.8475 57.0788 40.6397 178.8137 140 L 3.9451 7.9770 120.0677 57.7154 41.6227 179.3971 141 I 3.5529 7.5710 120.0058 64.5524 36.7546 178.2203 142 D 4.3320 7.5407 118.5362 57.1373 40.6724 178.5452 143 K 4.1838 7.7779 118.2351 58.1501 32.4267 178.3729 144 I 4.2673 8.2334 110.9305 59.5356 39.1046 176.5421 145 G 4.0005 7.8543 108.4380 45.9618 0.0000 174.1993 146 L 3.9799 8.6031 123.2951 58.1455 42.1005 179.2942 147 E 3.9661 8.1808 117.8273 59.7086 29.4384 179.0774 148 N 4.3729 8.1097 115.8906 56.2323 38.4437 176.7115 149 Y 3.9516 7.9557 120.1071 60.7767 39.2451 177.8922 150 L 4.0155 8.3548 120.2761 57.6783 41.7294 179.1710 151 Q 3.9341 8.1196 119.5284 59.4010 28.8078 178.5152 152 S 4.2546 7.9698 113.9980 60.2746 63.0928 175.3758 153 Q 4.3424 7.5766 120.1317 55.7092 28.5968 177.2862 154 M 4.2772 7.6421 120.1776 57.2985 32.3173 175.9625 155 D 4.9628 7.8115 120.2226 53.4255 41.5288 175.3898 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 8.16 4.17 0.00 1.36 1.87 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.38 0.00 2 K 8.59 3.73 0.00 1.82 1.67 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.46 7.81 3 G 8.60 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 4 D 8.40 4.54 0.00 2.75 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 9.12 3.83 0.00 1.85 1.81 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.53 7.81 6 I 7.88 3.66 1.87 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 0.66 0.11 0.00 0.00 7 V 8.42 3.74 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 1.21 0.00 0.00 1.13 0.00 0.00 8 I 7.91 3.75 1.99 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.53 0.90 0.00 0.00 9 Q 8.07 3.94 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 10 H 8.16 4.08 0.00 3.37 3.33 0.00 5.62 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 11 L 8.36 4.04 0.00 1.83 1.74 0.96 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.43 4.35 0.00 2.93 2.84 0.00 0.00 6.64 6.90 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 13 K 7.87 3.89 0.00 1.82 2.02 0.00 1.60 0.00 0.00 1.65 0.00 0.00 3.30 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 I 7.81 3.69 2.01 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 1.71 0.75 0.92 0.00 0.00 15 L 8.20 4.02 0.00 1.84 1.87 0.95 0.93 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 16 G 8.11 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.01 4.34 0.00 3.04 2.88 0.00 0.00 7.01 7.51 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 18 E 8.40 3.95 0.00 2.11 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 2.57 2.52 0.00 19 L 8.07 4.03 0.00 1.79 1.68 0.90 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.55 3.61 1.98 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 1.45 0.89 0.85 0.00 0.00 21 A 7.74 3.26 1.09 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 0.00 0.00 22 I 7.93 3.57 1.98 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 1.47 0.75 0.86 0.00 0.00 23 N 7.89 4.33 0.00 2.78 2.83 0.00 0.00 6.76 7.00 0.00 0.00 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 Q 8.11 3.87 0.00 2.07 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.30 0.00 25 Y 8.00 4.46 0.00 3.07 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 26 F 8.43 3.94 0.00 3.37 3.09 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 27 L 8.17 3.97 0.00 1.85 1.78 0.89 0.90 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 28 H 8.36 3.92 0.00 3.40 3.14 0.00 5.70 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 29 A 8.48 4.14 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 30 R 7.76 3.84 0.00 1.75 1.90 0.00 3.24 0.00 0.00 2.85 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.83 0.00 31 M 7.79 3.51 0.00 0.85 1.59 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.20 0.00 32 Y 7.69 4.39 0.00 3.23 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 33 E 8.18 3.99 0.00 2.10 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 2.40 0.00 34 D 8.12 4.30 0.00 2.56 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 35 W 7.78 4.95 0.00 3.73 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 36 G 8.42 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 37 L 8.10 4.83 0.00 2.02 1.65 1.27 0.99 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 38 E 8.28 3.96 0.00 2.18 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 2.41 2.58 0.00 39 K 8.01 4.03 0.00 1.96 1.93 0.00 1.85 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.46 7.81 40 L 7.79 4.05 0.00 1.38 0.36 0.66 0.96 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 41 G 8.18 3.70 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 0.00 0.00 0.00 42 K 8.32 3.87 0.00 1.82 1.95 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.46 7.81 43 H 8.14 3.93 0.00 3.23 3.05 0.00 5.64 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 44 E 8.69 3.86 0.00 2.45 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 0.00 2.65 2.63 0.00 45 Y 8.35 3.88 0.00 2.90 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 46 H 8.17 4.12 0.00 3.10 3.21 0.00 5.67 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 47 E 7.96 3.82 0.00 1.97 1.80 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 2.05 1.85 0.00 48 S 7.87 4.21 0.00 4.04 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 49 I 7.54 3.64 1.79 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.48 0.85 0.00 0.00 50 D 8.12 4.28 0.00 2.78 2.56 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 51 E 8.42 3.97 0.00 2.09 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 2.77 2.57 0.00 52 M 8.05 4.03 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.52 0.00 53 K 8.04 4.02 0.00 1.93 1.85 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.72 7.81 54 H 8.26 4.25 0.00 3.45 3.33 0.00 5.64 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 55 A 8.28 3.98 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 56 D 8.20 4.27 0.00 2.90 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 57 K 8.19 4.01 0.00 2.03 1.86 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.65 7.81 58 L 7.96 4.01 0.00 1.88 1.73 0.96 0.83 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 59 I 8.03 3.70 2.03 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.11 0.92 0.00 0.00 60 K 8.18 4.00 0.00 1.97 1.88 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.42 0.00 0.00 0.00 0.00 1.47 1.64 7.81 61 R 8.14 4.01 0.00 2.08 2.12 0.00 3.33 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 62 I 8.16 3.72 2.03 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 1.54 0.50 0.94 0.00 0.00 63 L 8.08 4.06 0.00 1.90 1.76 0.94 0.75 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 64 F 8.07 4.37 0.00 2.96 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 65 L 7.99 4.21 0.00 2.03 1.61 0.86 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.91 3.86 0.00 2.04 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 2.17 2.28 0.00 67 G 8.30 3.95 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 0.00 0.00 0.00 68 L 7.99 4.56 0.00 1.61 1.60 0.91 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.39 0.00 2.03 1.99 0.00 3.65 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 70 N 8.82 4.66 0.00 2.66 2.73 0.00 0.00 7.13 7.22 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 71 L 8.08 4.52 0.00 1.64 1.65 0.90 0.96 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 72 Q 8.11 4.06 0.00 1.98 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.90 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 73 E 8.35 4.25 0.00 1.98 1.85 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 2.31 2.40 0.00 74 L 8.26 4.56 0.00 1.50 1.48 0.88 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.46 3.79 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 0.00 0.00 0.00 76 K 8.31 4.12 0.00 1.71 1.74 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.42 1.52 7.81 77 L 8.39 4.16 0.00 1.64 1.56 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.95 4.48 0.00 1.73 1.67 1.01 0.85 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 79 I 7.93 4.17 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.76 0.95 0.00 0.00 80 G 8.78 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.97 4.72 0.00 1.99 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 0.00 2.32 2.26 0.00 82 H 7.63 4.99 0.00 3.24 3.29 0.00 5.68 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.72 4.26 4.42 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 1.50 0.00 0.00 84 K 8.30 3.85 0.00 1.85 1.94 0.00 1.69 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.47 7.81 85 E 8.12 4.08 0.00 1.67 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 0.00 2.35 2.36 0.00 86 M 8.45 4.03 0.00 1.75 2.28 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.23 0.00 87 L 8.34 4.15 0.00 2.06 1.71 1.16 1.03 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 88 E 8.36 4.02 0.00 2.19 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 2.32 2.59 0.00 89 C 8.51 4.22 0.00 3.26 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 90 D 8.42 4.68 0.00 2.95 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 91 L 8.11 3.98 0.00 1.88 1.87 0.94 0.55 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 92 K 8.47 3.93 0.00 1.92 2.05 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.48 7.81 93 L 7.93 3.97 0.00 1.88 2.04 0.92 0.82 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 94 E 8.38 4.21 0.00 2.23 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 2.67 2.49 0.00 95 Q 8.54 4.05 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.40 2.60 0.00 96 A 8.03 4.31 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 97 G 7.79 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 L 7.37 3.99 0.00 1.91 1.77 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 99 P 0.00 4.25 0.00 2.17 2.14 0.00 3.64 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.22 0.00 100 D 7.92 4.34 0.00 2.98 2.73 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 0.00 101 L 7.94 3.99 0.00 1.86 1.73 0.94 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 102 K 8.32 3.99 0.00 1.82 1.88 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.62 7.81 103 A 8.12 4.01 1.44 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 0.00 0.00 0.00 104 A 7.93 3.71 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 0.00 105 I 8.15 3.64 2.02 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 1.48 0.89 0.94 0.00 0.00 106 A 8.21 4.00 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 0.00 107 Y 8.11 3.83 0.00 3.17 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 0.00 108 C 8.43 4.04 0.00 3.14 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 0.00 109 E 8.20 3.93 0.00 2.21 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 0.00 2.35 2.41 0.00 110 S 7.75 4.11 0.00 3.92 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 0.00 111 V 6.92 4.10 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 0.22 0.00 0.00 0.78 0.00 0.00 112 G 7.16 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 0.00 0.00 0.00 113 D 7.31 4.44 0.00 2.63 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 0.00 114 Y 7.21 4.29 0.00 3.09 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 0.00 115 A 8.07 4.10 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.45 4.15 0.00 4.13 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 0.00 117 R 7.97 3.93 0.00 1.96 2.21 0.00 3.23 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.72 0.00 118 E 8.36 3.99 0.00 2.24 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 2.64 2.50 0.00 119 L 7.88 3.95 0.00 1.74 1.88 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 120 L 8.03 4.02 0.00 1.91 1.71 0.94 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.62 4.06 0.00 2.15 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 2.35 2.64 0.00 122 D 8.05 4.57 0.00 2.90 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 0.00 123 I 7.54 3.59 1.95 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 1.09 0.70 0.78 0.00 0.00 124 L 8.30 3.95 0.00 1.80 1.85 1.00 0.88 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 0.00 125 E 8.20 3.97 0.00 2.24 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 2.35 2.54 0.00 126 S 7.86 4.19 0.00 3.94 4.12 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 0.00 0.00 0.00 0.00 127 E 8.48 4.22 0.00 2.19 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 2.71 2.54 0.00 128 E 8.53 4.19 0.00 2.05 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 2.37 2.57 0.00 129 D 7.74 4.43 0.00 3.01 2.78 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 0.00 130 H 8.31 4.34 0.00 3.27 3.51 0.00 5.61 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 0.00 131 I 7.95 3.77 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.62 0.94 0.00 0.00 132 D 7.91 4.31 0.00 2.98 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 0.00 133 W 8.59 4.12 0.00 3.49 3.47 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 0.00 0.00 0.00 0.00 134 L 8.57 3.82 0.00 1.90 1.71 0.82 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.59 3.93 0.00 1.93 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 2.61 0.00 136 T 7.84 3.78 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 1.09 0.00 0.00 137 Q 7.49 3.58 0.00 1.54 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 138 L 7.48 3.73 0.00 1.73 1.60 0.87 0.99 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 0.00 139 D 7.94 4.30 0.00 2.78 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.98 3.95 0.00 1.66 1.73 0.92 0.70 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 0.00 141 I 7.57 3.55 1.77 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.17 0.80 0.00 0.00 142 D 7.54 4.33 0.00 2.70 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 0.00 143 K 7.78 4.18 0.00 1.73 1.84 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.59 7.81 144 I 8.23 4.27 1.89 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 1.77 0.68 0.93 0.00 0.00 145 G 7.85 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.60 3.98 0.00 1.75 1.68 0.98 0.92 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 0.00 147 E 8.18 3.97 0.00 2.05 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 2.39 2.40 0.00 148 N 8.11 4.37 0.00 3.05 2.88 0.00 0.00 6.72 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Y 7.96 3.95 0.00 2.94 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 0.00 150 L 8.35 4.02 0.00 1.71 1.70 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.12 3.93 0.00 2.16 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.83 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 152 S 7.97 4.25 0.00 3.79 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 0.00 153 Q 7.58 4.34 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.82 0.00 0.00 0.00 0.00 0.00 1.77 2.02 0.00 154 M 7.64 4.28 0.00 2.01 2.21 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.44 0.00 155 D 7.81 4.96 0.00 2.57 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