NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 K 4.1824 8.3101 121.7892 56.6161 33.4352 176.2025 6 A 4.3842 8.1255 125.1573 49.9991 17.4112 174.5976 7 Q 4.6576 7.8741 118.6974 53.7757 34.3351 172.6771 8 E 4.7501 8.4161 119.5558 54.8797 33.3514 174.2328 9 I 4.3599 8.1019 126.0288 59.7341 39.5576 174.5284 10 I 4.2351 8.2378 128.3583 59.4486 38.7171 175.2277 11 L 4.8244 8.2596 127.0510 52.8950 45.3611 176.3507 12 S 4.8181 8.3764 115.1049 57.8358 65.2673 173.3893 13 C 5.1973 9.0048 124.4887 55.1696 42.1287 172.5465 14 E 5.7517 8.1204 115.6250 54.2896 33.6447 175.3578 15 I 4.1023 8.3350 123.7039 61.3770 38.3878 175.7721 16 N 4.7375 9.7692 126.2802 54.5856 38.4081 175.1623 17 S 4.5723 7.6179 111.1629 57.4888 66.6895 173.1103 18 I 4.6708 8.4714 124.3209 60.2285 36.9784 174.1845 19 E 4.7897 8.7281 126.2529 54.1147 32.7866 176.2600 20 R 4.4441 8.7520 122.6642 55.8617 30.8997 177.5974 21 G 4.1023 8.4808 115.5391 46.0923 0.0000 175.3482 22 S 4.4448 8.6699 114.8662 60.1353 64.1893 175.5116 23 L 4.1699 7.5718 119.4075 53.8630 41.2933 177.0402 24 K 4.1487 8.3725 120.6668 57.3955 32.8006 176.9549 25 N 4.8709 8.8189 115.0253 53.5410 36.2072 173.2091 26 L 5.0880 7.4763 117.2298 53.5234 45.1897 175.2842 27 S 5.1233 8.9160 122.2751 56.7498 66.7221 173.1725 28 I 5.2380 8.5007 125.2362 59.7080 38.8741 174.9882 29 I 4.0952 8.2927 128.2171 60.2801 38.2621 174.1953 30 H 4.8533 8.5551 125.8519 55.0405 30.2076 174.6178 31 M 5.2055 9.0120 123.4807 52.2675 35.2202 175.1145 32 S 5.3357 8.2344 120.6539 57.6299 64.5105 173.2246 33 C 4.8425 8.7848 124.7874 54.2061 44.4981 172.7077 34 N 4.5231 8.5079 117.7992 53.5141 36.8094 175.3547 35 D 4.4931 8.8952 120.7579 54.8605 39.0684 175.1209 36 F 4.9191 7.5681 116.8560 55.7576 39.5344 172.9039 37 N 4.7026 8.7892 118.7062 53.3827 39.8785 175.1208 38 I 5.4016 8.7676 124.7349 59.1953 41.1511 174.5770 39 S 5.2380 7.8459 114.4496 58.6198 65.7618 174.1295 40 F 5.6238 8.2360 120.7799 56.2877 42.1531 173.9239 41 D 5.2291 8.0853 120.6294 53.1404 42.2054 176.3596 42 I 4.5759 8.3209 123.1034 59.5409 40.8631 174.9010 43 I 4.9249 8.0905 126.1591 59.7895 38.8764 176.8600 44 D 4.2252 8.7492 125.0740 57.4925 41.0225 179.2414 45 S 4.2148 7.9964 112.1540 61.0997 63.0848 175.2686 46 I 3.8118 7.2038 120.1464 61.6931 37.0330 174.6194 47 N 4.4657 8.0240 121.4525 52.6247 38.8414 174.2169 48 I 4.8752 7.9025 120.4437 60.2703 39.9658 173.5787 49 F 4.9946 8.7953 121.6366 57.6008 40.9300 173.9772 50 S 4.8150 7.9728 116.8306 57.3449 64.4799 175.4463 51 Q 4.1265 8.7435 121.3468 58.2076 28.4800 177.0372 52 K 4.8339 7.6960 117.8645 53.5824 34.9882 174.9630 53 E 4.8121 8.5160 126.7563 54.8606 33.2954 173.9808 54 K 4.8705 8.7791 126.8131 56.4688 32.8767 176.6930 55 V 4.7240 8.8552 123.4536 60.4700 34.8012 173.5359 56 K 5.0015 8.9757 121.3083 54.8557 35.2475 175.5003 57 A 4.7223 8.9897 125.2548 50.3248 21.2071 174.8271 58 F 4.8536 8.9304 120.5378 57.5856 40.7649 175.4011 59 I 5.4977 8.6755 124.3188 58.5714 40.0424 174.2879 60 S 4.8854 8.4684 120.6665 55.9067 66.8654 173.5244 61 K 4.8788 8.2687 120.1356 55.5856 31.9473 177.4012 62 N 4.6630 7.5949 111.3227 53.1939 43.0236 175.4504 63 R 3.0232 6.8479 122.2803 52.4066 28.4895 173.0199 64 L 3.7021 7.2337 126.1457 53.9652 43.2754 174.8015 65 S 4.4474 8.3846 118.8417 58.4492 63.6398 172.6536 66 Y 4.9969 8.2655 119.6770 55.6988 41.3219 173.9922 67 T 4.5165 8.8067 114.9014 61.4201 72.3215 175.1571 68 N 4.2810 8.7263 120.7793 56.4467 38.6389 175.5763 69 D 4.7190 7.9182 116.3131 54.3897 40.7933 174.8680 70 D 4.9911 7.8627 119.4793 52.5991 45.3026 174.5058 71 F 4.9563 8.9829 120.8516 57.3302 41.7138 173.8841 72 C 4.7342 8.0700 122.4749 58.2356 32.1697 173.7160 73 G 4.0319 7.9291 105.7632 46.8601 0.0000 171.6369 74 H 4.7222 8.5371 113.9176 54.3781 30.9759 173.8372 75 G 3.7989 8.3845 108.9835 46.4606 0.0000 169.6788 76 Y 5.3059 8.8466 119.1372 57.1408 42.6416 174.0419 77 I 5.0398 8.4679 118.8560 60.6023 41.4310 175.2126 78 V 4.5820 8.8533 124.8146 61.8918 35.3376 173.9002 79 T 4.9783 8.3258 122.3293 62.2367 71.7255 171.8047 80 E 4.8656 7.7281 119.3017 56.6572 37.4300 175.8704 81 L 4.7082 7.4766 119.8108 52.8918 43.9222 176.2784 82 K 4.5259 7.3263 116.3475 55.7873 35.7897 174.5948 83 D 4.7725 8.6112 121.7076 54.4482 43.3613 175.7050 84 S 4.9750 9.0723 115.9869 58.6854 65.4251 173.7149 85 S 5.3133 8.8757 120.0659 56.6683 66.2524 172.8723 86 S 5.6276 8.8077 115.5121 55.7838 65.2425 172.9727 87 N 5.0255 9.4781 125.1389 52.6715 38.0549 175.3147 88 N 4.2171 8.6467 126.3244 53.5750 35.6875 172.6371 89 G 3.6663 8.0049 113.9744 45.6346 0.0000 173.2723 90 N 4.3702 8.4569 117.2408 52.6245 39.6212 173.9856 91 R 4.6539 8.4206 121.9335 54.9751 32.9477 175.1494 92 Y 5.4977 8.4073 119.7487 55.0912 40.7123 174.2145 93 I 4.3149 8.2538 125.5917 61.3510 39.0740 175.2501 94 T 4.6695 8.6880 123.8925 61.8392 70.2099 172.5913 95 I 4.4457 8.8553 128.2716 60.5195 38.7803 175.1824 96 I 4.3895 7.9821 126.2674 59.3843 39.9488 175.4818 97 S 4.1609 8.8412 122.8774 61.3859 62.9289 174.7635 98 L 3.9920 7.7675 115.9608 55.1594 44.2278 171.3994 99 F 3.5904 8.7345 128.0552 57.9434 36.0555 174.3032 100 G 4.0372 8.3832 112.5295 45.6896 0.0000 170.9000 101 L 4.2865 9.0472 122.4611 55.6919 39.7390 176.6365 102 L 4.5833 7.8133 114.1595 54.9875 41.6683 178.4370 103 V 3.7982 7.6671 119.4697 64.1724 31.5692 176.6304 104 K 4.4601 7.6779 118.7786 54.2265 34.0271 175.4327 105 I 3.7830 8.2220 123.3589 61.8187 36.0689 174.4568 106 I 4.4586 7.8016 123.6008 59.3993 39.8244 174.9674 107 S 4.6536 8.1449 120.1617 58.2486 66.5191 173.4751 108 N 5.0299 8.5949 116.8280 53.6805 38.9115 175.0291 109 K 4.7020 7.7801 118.8297 54.9774 34.9037 175.9382 110 E 3.8583 8.5921 121.6663 56.6111 30.4054 176.6657 111 S 4.8096 8.2814 119.3655 57.0576 67.2663 172.9992 112 F 4.7868 9.2209 122.0033 55.2993 40.4715 175.1957 113 L 4.2147 8.2365 127.9132 54.1644 42.2821 174.7343 114 K 4.4476 8.8420 127.2280 54.0675 32.3262 174.4136 115 I 4.4213 8.2153 123.8170 60.9187 38.6913 174.4375 116 H 5.3535 9.2294 124.2569 53.8889 31.3296 175.0893 117 Q 4.3680 8.7353 122.0137 56.5525 28.9750 175.6127 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 5 K 8.31 4.18 0.00 1.74 1.81 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.45 7.81 6 A 8.13 4.38 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 7.87 4.66 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.66 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 8 E 8.42 4.75 0.00 1.93 1.76 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 2.26 2.40 0.00 9 I 8.10 4.36 2.02 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 1.17 0.47 0.79 0.00 0.00 10 I 8.24 4.24 1.69 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.73 0.48 0.00 0.00 11 L 8.26 4.82 0.00 1.66 1.46 0.75 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.38 4.82 0.00 3.80 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 13 C 9.00 5.20 0.00 2.88 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 14 E 8.12 5.75 0.00 1.94 1.79 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 2.24 2.14 0.00 15 I 8.33 4.10 2.03 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 1.31 1.22 1.00 0.00 0.00 16 N 9.77 4.74 0.00 2.60 2.79 0.00 0.00 6.79 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 17 S 7.62 4.57 0.00 3.86 3.91 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 18 I 8.47 4.67 1.91 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 1.39 0.93 0.95 0.00 0.00 19 E 8.73 4.79 0.00 1.94 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.26 0.00 20 R 8.75 4.44 0.00 1.70 1.95 0.00 3.20 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 21 G 8.48 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.67 4.44 0.00 3.98 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 23 L 7.57 4.17 0.00 1.63 1.64 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.37 4.15 0.00 1.82 1.72 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.46 7.81 25 N 8.82 4.87 0.00 2.92 2.90 0.00 0.00 7.00 6.74 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 26 L 7.48 5.09 0.00 1.78 1.67 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 27 S 8.92 5.12 0.00 3.80 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 8.50 5.24 1.95 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 1.31 1.43 0.74 0.00 0.00 29 I 8.29 4.10 1.91 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 1.36 0.82 0.74 0.00 0.00 30 H 8.56 4.85 0.00 3.17 3.18 0.00 5.55 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 M 9.01 5.21 0.00 1.85 1.78 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.18 0.00 32 S 8.23 5.34 0.00 4.09 4.11 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 C 8.78 4.84 0.00 3.07 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 34 N 8.51 4.52 0.00 2.85 2.84 0.00 0.00 6.86 8.08 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 35 D 8.90 4.49 0.00 2.98 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 36 F 7.57 4.92 0.00 2.87 2.93 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 37 N 8.79 4.70 0.00 2.58 2.75 0.00 0.00 6.87 7.56 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 38 I 8.77 5.40 1.68 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 0.95 1.25 0.74 0.00 0.00 39 S 7.85 5.24 0.00 3.57 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 40 F 8.24 5.62 0.00 3.05 3.12 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 41 D 8.09 5.23 0.00 2.45 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 42 I 8.32 4.58 2.04 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.17 0.90 0.00 0.00 43 I 8.09 4.92 1.89 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 1.38 2.18 0.92 0.00 0.00 44 D 8.75 4.23 0.00 2.71 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.00 4.21 0.00 3.99 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 46 I 7.20 3.81 2.08 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.88 0.92 0.00 0.00 47 N 8.02 4.47 0.00 2.83 2.78 0.00 0.00 6.83 7.90 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 48 I 7.90 4.88 1.96 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.60 1.01 0.00 0.00 49 F 8.80 4.99 0.00 2.92 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 50 S 7.97 4.81 0.00 3.93 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 51 Q 8.74 4.13 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.53 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 52 K 7.70 4.83 0.00 1.73 1.68 0.00 1.65 0.00 0.00 0.61 0.00 0.00 2.87 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.39 7.81 53 E 8.52 4.81 0.00 2.15 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.41 0.00 54 K 8.78 4.87 0.00 1.73 1.79 0.00 1.83 0.00 0.00 1.78 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.47 7.81 55 V 8.86 4.72 2.30 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 0.79 0.00 0.00 1.28 0.00 0.00 56 K 8.98 5.00 0.00 1.97 1.50 0.00 1.68 0.00 0.00 1.32 0.00 0.00 2.75 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.40 7.81 57 A 8.99 4.72 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 8.93 4.85 0.00 3.14 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 59 I 8.68 5.50 1.86 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 1.08 0.94 0.91 0.00 0.00 60 S 8.47 4.89 0.00 3.87 3.65 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 61 K 8.27 4.88 0.00 1.79 1.83 0.00 1.82 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.46 7.81 62 N 7.59 4.66 0.00 2.67 2.67 0.00 0.00 7.02 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 63 R 6.85 3.02 0.00 1.54 1.58 0.00 3.06 0.00 0.00 2.91 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.60 0.00 64 L 7.23 3.70 0.00 1.77 1.47 0.99 0.59 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 65 S 8.38 4.45 0.00 3.98 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 66 Y 8.27 5.00 0.00 2.93 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.81 4.52 4.19 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 1.13 0.00 0.00 68 N 8.73 4.28 0.00 2.66 2.88 0.00 0.00 6.97 8.06 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 69 D 7.92 4.72 0.00 2.64 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 70 D 7.86 4.99 0.00 2.57 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 71 F 8.98 4.96 0.00 3.17 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 72 C 8.07 4.73 0.00 2.53 2.34 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 73 G 7.93 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 0.00 0.00 0.00 74 H 8.54 4.72 0.00 2.01 1.99 0.00 5.76 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 75 G 8.38 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 8.85 5.31 0.00 2.81 2.85 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 77 I 8.47 5.04 2.07 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.62 1.03 0.00 0.00 78 V 8.85 4.58 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 0.95 0.00 0.00 0.96 0.00 0.00 79 T 8.33 4.98 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 1.26 0.00 0.00 80 E 7.73 4.87 0.00 2.06 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 2.33 2.25 0.00 81 L 7.48 4.71 0.00 1.55 1.64 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 82 K 7.33 4.53 0.00 2.00 1.82 0.00 1.49 0.00 0.00 1.73 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.37 1.41 7.81 83 D 8.61 4.77 0.00 2.89 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 84 S 9.07 4.97 0.00 3.94 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 85 S 8.88 5.31 0.00 4.25 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 86 S 8.81 5.63 0.00 3.88 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 87 N 9.48 5.03 0.00 3.05 2.85 0.00 0.00 7.35 6.92 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 88 N 8.65 4.22 0.00 2.79 3.01 0.00 0.00 7.25 7.65 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 89 G 8.00 3.67 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 0.00 0.00 0.00 90 N 8.46 4.37 0.00 2.74 2.67 0.00 0.00 7.12 8.97 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 91 R 8.42 4.65 0.00 1.61 1.71 0.00 3.16 0.00 0.00 3.28 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 92 Y 8.41 5.50 0.00 3.02 3.01 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 93 I 8.25 4.31 1.87 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 1.33 1.11 0.97 0.00 0.00 94 T 8.69 4.67 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 1.42 0.00 0.00 95 I 8.86 4.45 1.85 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 1.22 1.06 0.88 0.00 0.00 96 I 7.98 4.39 1.68 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 0.31 -0.07 0.74 0.00 0.00 97 S 8.84 4.16 0.00 3.81 3.91 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 98 L 7.77 3.99 0.00 1.49 1.53 0.77 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 99 F 8.73 3.59 0.00 3.21 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 G 8.38 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 L 9.05 4.29 0.00 1.94 1.93 1.07 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 102 L 7.81 4.58 0.00 1.71 1.74 0.96 0.94 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 0.00 103 V 7.67 3.80 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 0.84 0.00 0.00 0.99 0.00 0.00 104 K 7.68 4.46 0.00 1.87 1.82 0.00 1.54 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.33 1.44 7.81 105 I 8.22 3.78 1.88 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 1.31 0.81 0.93 0.00 0.00 106 I 7.80 4.46 2.22 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 1.14 0.97 0.00 0.00 107 S 8.14 4.65 0.00 3.87 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 0.00 108 N 8.59 5.03 0.00 2.72 2.86 0.00 0.00 6.75 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 K 7.78 4.70 0.00 1.67 1.82 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.48 7.81 110 E 8.59 3.86 0.00 1.75 1.70 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 1.78 1.47 0.00 111 S 8.28 4.81 0.00 3.89 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 0.00 112 F 9.22 4.79 0.00 2.88 2.89 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 0.00 113 L 8.24 4.21 0.00 1.49 1.14 0.86 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 114 K 8.84 4.45 0.00 1.53 1.53 0.00 1.72 0.00 0.00 1.22 0.00 0.00 2.25 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.19 1.32 7.81 115 I 8.22 4.42 2.03 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.68 1.32 0.00 0.00 116 H 9.23 5.35 0.00 3.40 3.33 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 8.74 4.37 0.00 2.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.65 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00