NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2321 8.1727 120.1328 56.8117 34.8149 173.9559 2 V 4.5402 8.0685 121.8537 60.8430 32.3470 174.7555 3 F 4.3536 9.3557 128.1195 57.2842 40.1487 174.9127 4 E 4.0658 8.9823 122.7994 56.0378 30.7629 176.8846 5 R 3.3843 9.0032 124.4965 60.3827 29.9924 179.5707 6 C 4.3286 8.3284 115.2966 59.6793 40.6326 175.5153 7 E 3.8856 8.4127 120.6550 59.2712 29.1608 178.5721 8 L 3.5706 8.0366 119.9700 57.8483 42.0992 178.5138 9 A 3.9402 7.7850 120.7306 55.5387 18.3366 179.9207 10 R 3.8997 7.9621 116.3353 59.5511 29.9528 179.4910 11 T 3.8726 7.8739 115.5967 66.6761 68.4556 176.7643 12 L 3.8631 8.1507 121.3058 57.4155 41.6023 179.4230 13 K 3.8996 8.1361 119.6626 59.7033 31.9492 179.1260 14 R 4.0031 7.8693 116.9458 58.7004 29.9669 177.9923 15 L 4.4405 7.2661 116.7761 54.1549 41.7212 177.1053 16 G 3.8794 7.8482 106.7984 46.5403 0.0000 175.1146 17 M 3.9077 7.8740 121.1734 56.7049 32.2030 175.7153 18 D 4.3914 7.9672 117.7563 55.9364 40.7788 175.6550 19 G 3.9655 9.4558 115.7446 45.3002 0.0000 171.2190 20 Y 4.1566 8.2342 121.6455 59.0914 39.2132 176.6533 21 R 3.4222 8.9160 127.0512 57.1921 27.7735 177.0981 22 G 3.8087 8.1391 104.6070 45.2927 0.0000 173.6492 23 I 4.0747 7.6384 122.0976 59.2553 37.7309 175.7442 24 S 4.5809 8.3148 121.1003 57.9886 64.8377 174.6581 25 L 4.2069 8.5698 124.7888 58.6694 41.7277 179.4525 26 A 4.1434 8.1193 120.0819 55.1862 18.3238 179.1670 27 N 4.4067 8.1118 114.9099 56.4077 38.5583 177.6917 28 W 4.2744 7.9975 120.1815 59.8293 29.0323 178.5778 29 M 4.1492 8.5893 119.1018 58.6504 31.5486 177.8070 30 C 3.2784 8.1276 118.7968 59.2457 42.7503 175.3676 31 L 3.9771 8.2145 121.5738 58.3276 41.7469 178.8799 32 A 4.1754 8.3886 120.7778 54.8923 18.2891 179.4498 33 K 2.7493 8.3918 118.5525 59.2283 32.0129 178.9427 34 W 4.2740 7.6919 117.1358 58.9179 29.2574 178.4284 35 E 4.3145 8.5049 118.7603 58.8745 29.1427 178.0501 36 S 4.5280 7.6192 107.9507 56.4375 64.6615 173.9673 37 G 3.4921 8.3696 108.8840 46.9330 0.0000 173.2443 38 Y 3.6707 7.7451 113.3213 58.7878 34.8818 168.6466 39 N 5.3345 8.0271 119.1902 51.9293 40.4901 175.4083 40 T 4.0394 8.9299 117.4439 63.8517 69.2374 176.1090 41 R 4.3817 8.0058 116.5060 55.9008 30.4168 176.3675 42 A 4.2452 7.9489 122.6024 52.7486 19.2328 176.4652 43 T 4.9810 8.5339 112.2814 59.7637 72.0404 173.1178 44 N 4.9237 8.8350 121.8756 52.0809 42.1760 172.4186 45 Y 4.5726 8.7177 127.7842 57.3216 40.8166 173.8804 46 N 4.7701 8.2851 124.6645 51.1132 38.6387 175.2258 47 A 3.7790 8.2822 127.4369 54.8214 18.9999 179.1341 48 G 3.8530 8.1773 104.1817 48.3035 0.0000 173.8340 49 D 4.7191 7.5143 114.9158 52.0095 40.1260 176.1391 50 R 4.1325 8.2556 116.2883 56.9756 28.2410 176.0058 51 S 4.8328 7.8415 114.0606 57.6004 65.8592 172.9239 52 T 5.0940 8.7813 115.4195 61.9851 72.7298 172.9692 53 D 5.5636 9.0342 124.7580 53.1910 43.5125 175.0928 54 Y 4.8162 8.9776 119.8367 57.5288 41.6513 177.0643 55 G 4.5045 9.4569 112.8791 45.6283 0.0000 173.4676 56 I 3.8083 8.1990 116.9344 62.8410 38.0542 177.5906 57 F 4.7299 8.0172 115.8953 56.4880 40.0046 175.1386 58 Q 3.6454 7.8222 119.2314 57.0923 26.5732 173.9405 59 I 4.4412 8.1735 119.0722 61.0842 39.1471 176.7735 60 N 5.6288 9.1693 125.6515 53.0067 40.0629 175.7687 61 S 4.6240 8.9720 119.8347 60.3044 63.3969 175.4609 62 R 3.7627 8.9074 122.3869 58.7103 30.4533 177.7362 63 Y 4.0180 7.7954 115.0113 57.8312 40.3330 176.8831 64 W 4.9548 7.9684 118.5786 57.5429 32.0487 173.9141 65 C 5.5894 8.0554 112.0080 53.7591 45.6907 172.4413 66 N 4.8568 8.9560 119.3698 52.2920 39.7839 174.8947 67 D 4.8246 8.9618 124.2067 52.5599 40.4144 176.7865 68 G 4.1324 8.4719 109.2285 45.4113 0.0000 174.6555 69 K 4.4479 8.0243 115.3985 56.5862 33.1647 175.7072 70 T 4.4824 7.7095 117.8634 61.1894 69.3653 172.2051 71 P 4.2357 0.0000 0.0000 63.7670 31.9055 176.8729 72 G 3.7741 8.8604 108.7697 45.6024 0.0000 173.3247 73 A 4.2430 7.3829 121.0942 51.8503 19.3565 177.2513 74 V 4.3675 8.0687 112.5266 59.2821 35.5905 176.0228 75 N 5.0089 8.0262 116.1936 52.5565 37.7238 174.8644 76 A 4.0656 8.7473 124.4681 54.9276 19.1596 178.4713 77 C 4.3803 8.6550 111.6752 57.4964 41.0242 173.2551 78 H 4.0829 7.9924 114.9209 56.2608 27.4231 174.0497 79 L 4.8166 8.3614 119.3920 53.2285 46.4532 176.7429 80 S 4.5330 8.4451 115.8288 58.3358 63.1758 176.0085 81 C 3.9341 8.7170 124.7902 59.8174 38.8613 176.2929 82 S 3.9566 7.9014 114.7765 61.4901 61.6084 176.0860 83 A 4.1259 7.9628 122.4582 54.4306 18.4158 177.9269 84 L 4.5090 7.7810 116.4068 54.9372 41.7485 177.5213 85 L 5.3710 7.7416 116.4133 53.6581 42.4294 176.7921 86 Q 4.3297 7.9148 117.6121 55.5086 29.4591 176.0760 87 D 4.4181 8.5927 120.5233 57.1685 41.1420 176.7707 88 N 4.5866 8.0757 118.1647 53.2598 39.3298 174.5845 89 I 4.3231 8.3925 118.7570 60.9694 38.0415 177.1194 90 A 3.9353 8.5088 125.2749 56.0494 18.2211 180.3132 91 D 4.2741 8.0889 116.5754 57.3019 40.9092 178.7017 92 A 4.1021 7.9695 120.9813 55.1176 18.4084 179.6952 93 V 3.3540 8.2239 116.9468 66.0294 31.6086 178.0350 94 A 3.8334 8.0685 120.6435 55.3173 18.0863 178.8487 95 C 4.1883 8.3313 116.7166 59.5780 37.8798 175.4961 96 A 3.9432 8.3054 122.8759 55.1880 17.6079 179.7554 97 K 3.8423 7.8527 116.3546 59.3986 32.3330 179.2106 98 R 4.0552 7.7815 119.0029 59.3050 30.0081 178.4496 99 V 2.3382 7.4398 118.1124 65.8298 31.1328 177.8080 100 V 3.9379 7.3034 107.4720 62.1806 31.7072 177.8695 101 R 4.1879 7.6798 117.6393 57.2195 30.5042 176.4786 102 D 4.7373 7.5101 119.2580 52.7497 41.9033 175.4098 103 P 4.2459 0.0000 0.0000 66.1030 31.6885 178.4016 104 Q 4.0446 8.1856 116.2887 56.6845 30.0630 177.5197 105 G 3.5949 7.7692 107.5846 46.5096 0.0000 176.4045 106 I 3.7686 7.7091 121.8494 62.8528 37.9074 177.5561 107 R 4.2600 7.3347 117.6569 58.1943 30.0350 177.4036 108 A 3.9022 7.7359 121.1700 54.4404 18.7091 177.7733 109 W 4.6707 8.1880 116.8118 55.6166 29.6840 177.4186 110 V 3.7286 8.8078 123.8135 66.1309 30.9154 177.6391 111 A 4.0428 8.2778 120.0113 54.7310 18.1106 179.2845 112 W 3.9543 8.3620 126.6929 60.6563 30.5991 178.3955 113 R 4.0060 8.0932 117.7085 58.8057 29.6413 178.3795 114 N 4.3505 8.0419 115.0228 55.5692 38.6835 176.8047 115 R 4.0354 7.5838 115.7471 55.7699 31.8677 175.9375 116 C 4.5031 7.0997 113.7247 57.8888 39.0871 174.2682 117 Q 3.2042 6.7327 120.9197 57.1682 28.7614 176.1339 118 N 4.2456 8.6682 120.1568 54.0518 36.1073 173.8004 119 R 4.4666 7.2695 116.1319 54.0813 32.7541 175.4933 120 D 4.5685 8.4493 118.9855 54.1444 40.8184 175.9018 121 V 4.6281 8.2205 119.1020 61.2193 32.3406 178.2786 122 R 4.0976 8.3014 122.2939 59.0875 30.2267 179.0160 123 Q 3.9947 8.1197 115.8065 59.1900 28.6316 178.2301 124 Y 4.1499 7.6561 115.2147 60.2205 38.2365 177.3052 125 V 4.3293 7.6861 110.5070 60.5848 32.6379 175.2208 126 Q 4.1160 7.6156 122.4409 57.5731 29.0254 176.8110 127 G 3.9733 8.9368 112.8820 45.9951 0.0000 174.3849 128 C 4.4120 8.0004 115.5948 56.9287 40.6243 174.3885 129 G 3.8876 8.2377 107.2942 46.2063 0.0000 174.0797 130 V 4.0015 7.7926 118.0145 61.1019 31.9925 175.7494 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 K 8.17 4.23 0.00 1.64 2.11 0.00 1.06 0.00 0.00 1.28 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.16 7.81 2 V 8.07 4.54 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.36 4.35 0.00 2.81 2.84 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 4 E 8.98 4.07 0.00 2.03 1.82 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 2.39 2.26 0.00 5 R 9.00 3.38 0.00 1.97 1.91 0.00 3.46 0.00 0.00 3.45 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.81 0.00 6 C 8.33 4.33 0.00 3.26 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 7 E 8.41 3.89 0.00 2.06 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 0.00 2.75 2.48 0.00 8 L 8.04 3.57 0.00 1.38 1.39 -0.13 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.79 3.94 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 10 R 7.96 3.90 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.87 3.87 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 1.21 0.00 0.00 12 L 8.15 3.86 0.00 1.74 1.59 0.92 0.35 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 K 8.14 3.90 0.00 1.95 1.91 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 7.87 4.00 0.00 1.98 1.97 0.00 3.20 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 15 L 7.27 4.44 0.00 1.59 1.56 0.87 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.85 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 17 M 7.87 3.91 0.00 1.38 2.01 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.24 0.00 18 D 7.97 4.39 0.00 2.68 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 19 G 9.46 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 20 Y 8.23 4.16 0.00 3.37 3.19 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 21 R 8.92 3.42 0.00 1.67 1.74 0.00 3.13 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.60 0.00 22 G 8.14 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 23 I 7.64 4.07 1.79 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 0.89 0.70 -0.21 0.00 0.00 24 S 8.31 4.58 0.00 4.11 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 25 L 8.57 4.21 0.00 2.00 1.82 1.00 1.49 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 26 A 8.12 4.14 1.52 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 27 N 8.11 4.41 0.00 2.74 2.72 0.00 0.00 7.10 9.07 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 28 W 8.00 4.27 0.00 3.51 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 29 M 8.59 4.15 0.00 2.17 2.37 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.92 0.00 30 C 8.13 3.28 0.00 2.49 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 31 L 8.21 3.98 0.00 1.87 1.88 0.54 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.39 4.18 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.39 2.75 0.00 1.67 1.55 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.26 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.57 1.43 7.81 34 W 7.69 4.27 0.00 3.33 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.50 4.31 0.00 2.02 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 0.00 2.59 2.53 0.00 36 S 7.62 4.53 0.00 4.04 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 37 G 8.37 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 0.00 0.00 0.00 38 Y 7.75 3.67 0.00 3.23 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 39 N 8.03 5.33 0.00 2.84 2.81 0.00 0.00 7.03 7.34 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 40 T 8.93 4.04 4.45 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 1.45 0.00 0.00 41 R 8.01 4.38 0.00 2.00 2.10 0.00 3.09 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 1.75 1.59 0.00 42 A 7.95 4.25 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 43 T 8.53 4.98 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 1.21 0.00 0.00 44 N 8.83 4.92 0.00 2.82 2.77 0.00 0.00 6.90 8.02 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 45 Y 8.72 4.57 0.00 3.12 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 46 N 8.29 4.77 0.00 2.64 2.59 0.00 0.00 6.98 7.45 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 47 A 8.28 3.78 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 48 G 8.18 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.51 4.72 0.00 2.71 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 50 R 8.26 4.13 0.00 2.05 2.23 0.00 3.15 0.00 0.00 3.21 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.55 0.00 51 S 7.84 4.83 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 52 T 8.78 5.09 4.30 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 0.71 0.00 0.00 53 D 9.03 5.56 0.00 2.68 2.80 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 54 Y 8.98 4.82 0.00 3.07 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 55 G 9.46 4.50 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 56 I 8.20 3.81 1.68 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.41 0.02 0.00 0.00 57 F 8.02 4.73 0.00 3.22 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 7.82 3.65 0.00 2.57 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 7.25 0.00 0.00 0.00 0.00 0.00 2.54 2.73 0.00 59 I 8.17 4.44 2.15 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.29 1.13 0.00 0.00 60 N 9.17 5.63 0.00 3.09 3.01 0.00 0.00 7.05 7.89 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 61 S 8.97 4.62 0.00 4.06 4.34 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 62 R 8.91 3.76 0.00 1.68 1.73 0.00 2.78 0.00 0.00 2.84 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.01 0.00 63 Y 7.80 4.02 0.00 1.93 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 64 W 7.97 4.95 0.00 3.49 3.24 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 65 C 8.06 5.59 0.00 3.05 3.18 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 66 N 8.96 4.86 0.00 2.85 2.71 0.00 0.00 7.09 8.18 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 67 D 8.96 4.82 0.00 2.85 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 68 G 8.47 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.02 4.45 0.00 1.91 1.90 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.63 1.46 7.81 70 T 7.71 4.48 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 71 P 0.00 4.24 0.00 2.16 2.05 0.00 3.85 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 72 G 8.86 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 73 A 7.38 4.24 1.22 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 0.00 0.00 0.00 74 V 8.07 4.37 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 0.57 0.00 0.00 0.85 0.00 0.00 75 N 8.03 5.01 0.00 2.77 2.62 0.00 0.00 6.96 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 76 A 8.75 4.07 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 C 8.65 4.38 0.00 3.26 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 78 H 7.99 4.08 0.00 3.33 3.38 0.00 5.51 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.36 4.82 0.00 1.69 1.53 0.94 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.45 4.53 0.00 3.83 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 81 C 8.72 3.93 0.00 2.21 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.90 3.96 0.00 3.90 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 83 A 7.96 4.13 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 84 L 7.78 4.51 0.00 1.94 1.82 1.03 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.74 5.37 0.00 1.79 1.71 1.13 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.91 4.33 0.00 2.19 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 7.33 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 87 D 8.59 4.42 0.00 2.63 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 88 N 8.08 4.59 0.00 2.70 2.75 0.00 0.00 6.93 7.96 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 89 I 8.39 4.32 1.78 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.98 0.99 0.00 0.00 90 A 8.51 3.94 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 91 D 8.09 4.27 0.00 2.72 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 A 7.97 4.10 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 93 V 8.22 3.35 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 0.74 0.00 0.00 0.87 0.00 0.00 94 A 8.07 3.83 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 95 C 8.33 4.19 0.00 3.13 3.27 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 96 A 8.31 3.94 0.77 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 97 K 7.85 3.84 0.00 1.54 1.27 0.00 1.24 0.00 0.00 0.61 0.00 0.00 2.36 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 1.01 7.81 98 R 7.78 4.06 0.00 1.96 2.11 0.00 3.28 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.97 0.00 99 V 7.44 2.34 1.74 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 -0.33 0.00 0.00 -0.65 0.00 0.00 100 V 7.30 3.94 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 0.98 0.00 0.00 1.45 0.00 0.00 101 R 7.68 4.19 0.00 2.05 2.05 0.00 3.24 0.00 0.00 3.39 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.09 0.00 102 D 7.51 4.74 0.00 3.12 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 0.00 103 P 0.00 4.25 0.00 2.01 2.11 0.00 3.68 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 2.02 2.12 0.00 104 Q 8.19 4.04 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 5.89 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 105 G 7.77 3.59 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 0.00 106 I 7.71 3.77 1.00 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.76 -0.79 0.00 0.00 107 R 7.33 4.26 0.00 2.02 2.06 0.00 3.23 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.52 0.00 108 A 7.74 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.19 4.67 0.00 3.48 3.24 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 0.00 110 V 8.81 3.73 2.17 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 1.04 0.00 0.00 1.00 0.00 0.00 111 A 8.28 4.04 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 0.00 112 W 8.36 3.95 0.00 3.49 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 0.00 113 R 8.09 4.01 0.00 2.01 1.98 0.00 3.39 0.00 0.00 2.25 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.86 0.00 114 N 8.04 4.35 0.00 2.68 2.69 0.00 0.00 6.91 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 0.00 115 R 7.58 4.04 0.00 1.16 0.66 0.00 2.21 0.00 0.00 2.41 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.92 0.00 116 C 7.10 4.50 0.00 1.66 2.59 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 0.00 117 Q 6.73 3.20 0.00 0.93 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.21 6.17 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 118 N 8.67 4.25 0.00 2.80 2.83 0.00 0.00 6.87 7.59 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 0.00 119 R 7.27 4.47 0.00 1.82 1.81 0.00 3.10 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 120 D 8.45 4.57 0.00 2.64 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 0.00 121 V 8.22 4.63 2.38 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 0.95 0.00 0.00 1.05 0.00 0.00 122 R 8.30 4.10 0.00 2.00 2.02 0.00 3.15 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 123 Q 8.12 3.99 0.00 2.06 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.60 0.00 0.00 0.00 0.00 0.00 1.99 1.56 0.00 124 Y 7.66 4.15 0.00 3.15 3.19 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 0.00 125 V 7.69 4.33 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 0.88 0.00 0.00 1.04 0.00 0.00 126 Q 7.62 4.12 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.67 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 127 G 8.94 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 0.00 128 C 8.00 4.41 0.00 3.01 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 0.00 129 G 8.24 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 0.00 0.00 0.00 130 V 7.79 4.00 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 0.71 0.00 0.00 0.96 0.00 0.00