NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 H 4.7437 8.4444 120.3944 56.0374 31.8944 174.2505 2 K 4.0357 8.2889 119.9379 58.2680 32.2245 176.4260 3 C 4.9715 7.9794 115.3916 56.2654 43.2532 173.1308 4 D 4.5778 7.9458 118.2459 53.9116 41.6967 176.5954 5 I 3.7631 8.3090 123.2492 63.9558 37.8691 178.0529 6 T 3.8954 8.7438 116.9468 66.7246 68.1610 176.0796 7 L 3.9844 8.0539 121.1980 57.8994 41.5851 179.3099 8 Q 4.0511 8.3235 119.2820 59.0670 28.9338 177.9973 9 A 4.0554 7.8951 121.4368 55.1131 18.4356 179.6045 10 I 3.6631 7.8520 118.3648 64.5423 37.1380 178.7030 11 I 3.6503 7.7888 120.6807 64.0994 37.0339 178.3013 12 K 3.8142 8.3779 120.8751 60.0056 31.9631 179.0118 13 T 3.7320 7.6828 115.5578 66.4896 68.3312 176.8313 14 L 3.9413 8.0242 121.0296 57.6734 41.3530 179.2580 15 N 4.2694 8.0412 116.0408 56.2936 38.5972 177.3831 16 S 4.1963 7.6428 116.1134 61.4447 62.5949 176.6272 17 L 3.8490 7.8022 122.3131 57.6878 41.1663 179.0391 18 T 4.5199 8.0288 108.5945 61.8738 69.2858 175.5039 19 E 4.4741 7.5500 119.6340 55.2291 30.3877 175.0111 20 Q 4.5695 7.2146 120.1562 54.1909 31.1297 174.3249 21 K 4.6491 8.5598 125.5908 54.8970 34.4722 174.5111 22 T 4.8250 7.8563 118.3661 61.5159 72.1699 174.8268 23 L 4.0741 8.4975 120.8130 56.8208 41.9104 178.6364 24 C 5.0829 7.8733 114.8758 56.4893 42.4063 175.5847 25 T 3.8261 7.9936 110.8945 63.5895 68.4389 175.4039 26 E 4.3361 8.0133 120.5261 57.4508 30.3535 176.4571 27 L 4.4421 8.1434 120.1027 55.0862 42.9269 176.4620 28 T 5.1789 8.4436 110.9430 60.8140 71.3144 173.9232 29 V 4.6499 8.5245 114.2975 59.5772 36.5246 175.1889 30 T 4.2832 8.3056 119.5052 63.8564 69.1649 175.0592 31 D 4.7285 9.1991 127.4066 53.2079 39.5347 176.5036 32 I 3.9365 7.8988 117.3061 62.3175 37.9321 177.3337 33 F 4.8175 7.5726 119.3007 57.5874 38.6606 176.0480 34 A 4.4737 7.8545 122.4900 51.9688 19.5330 178.2002 35 A 4.2311 7.6585 120.4347 52.0230 19.0977 177.9754 36 S 4.4287 8.5547 115.9133 57.5261 63.1217 174.4166 37 K 4.2437 7.2897 115.2173 57.1216 34.0237 173.5925 38 N 4.7222 8.7674 123.1097 52.0452 39.8807 176.7279 39 T 4.2761 8.3858 112.3001 61.4226 68.0048 174.0117 40 T 4.0123 8.3101 114.0098 61.8551 69.5993 175.1056 41 E 3.5962 8.5624 124.9349 59.3982 29.6249 179.2943 42 K 4.1107 7.9020 117.8879 59.4313 32.1517 178.8163 43 E 4.0019 8.0386 119.2132 59.4267 29.5326 178.8495 44 T 3.8375 7.7816 115.9804 66.5553 68.4385 176.7458 45 F 4.5211 7.7408 119.5878 60.7332 38.9240 176.9023 46 C 4.1204 8.4088 118.1779 59.6599 44.5189 175.9647 47 R 3.8153 8.1831 119.4869 59.0496 29.6870 178.8198 48 A 4.1392 8.3055 120.6777 55.2846 18.5502 179.5940 49 A 4.0794 7.9814 120.8868 54.6560 18.1295 180.1732 50 T 3.9811 7.4026 114.3952 67.0642 68.7539 177.5156 51 V 3.5608 7.7428 114.2869 64.2983 31.4590 178.7352 52 L 3.9762 7.8765 118.8898 57.5844 41.4500 179.4707 53 R 2.9787 7.9257 118.8607 59.1048 30.1353 178.6291 54 Q 4.0175 7.8451 118.6300 58.2394 28.5676 178.3573 55 F 3.8439 7.8677 122.7122 61.3824 39.6756 176.8324 56 Y 4.4842 8.2524 117.5047 59.8568 37.7940 177.9210 57 S 4.3028 7.7571 116.3744 61.1952 62.9737 175.6304 58 H 4.5539 7.8084 118.0660 56.8985 28.9819 176.0454 59 H 4.8503 7.8357 115.9524 55.2334 29.2896 175.4351 60 E 4.1230 8.2097 122.3289 58.5458 29.6188 177.6186 61 K 4.6047 7.8711 115.7113 55.8975 32.9150 175.0400 62 D 4.5473 7.8172 120.6018 53.7645 41.4575 177.4608 63 T 3.8747 8.5212 117.0097 64.4326 68.9285 175.6518 64 R 4.1049 8.3960 120.7332 58.1815 30.2342 176.4958 65 C 4.8945 8.0087 113.6127 57.0861 36.5642 175.0938 66 L 3.7593 7.8455 119.8376 55.8057 41.4277 178.2608 67 G 4.2199 8.2664 102.1585 46.0816 0.0000 172.7838 68 A 4.2745 9.0239 124.7938 54.2960 19.8175 179.1334 69 T 4.3604 7.8083 105.5601 60.8020 71.3978 175.4283 70 A 4.1181 8.4642 123.2287 55.4320 18.3823 179.7560 71 Q 3.9640 8.0944 117.5475 59.5135 29.2277 178.4043 72 Q 4.0620 8.3414 119.1185 58.9493 28.7774 178.5019 73 F 5.0358 8.5219 123.1779 61.0261 39.3459 176.6865 74 H 3.9142 8.6248 118.1895 59.4159 29.7311 177.4868 75 R 3.8520 8.1676 119.8921 59.3063 29.8113 178.5130 76 H 4.1411 8.3816 117.9968 59.3716 29.8988 177.4139 77 K 3.7494 7.8574 120.1482 59.3518 31.7345 179.0641 78 Q 3.5752 8.1307 120.1011 58.9567 28.9245 178.0620 79 L 4.2103 8.2787 121.6709 58.4700 42.1211 179.0661 80 I 3.7238 7.8159 119.6909 64.1809 36.9998 178.4097 81 R 3.6766 7.9826 119.6787 59.4814 29.9043 178.6371 82 F 4.4424 8.1176 117.7181 60.5972 38.8489 177.6605 83 L 4.1356 8.2513 118.7416 57.7978 41.3478 179.7802 84 K 3.8014 7.8477 118.4721 59.2200 32.0343 179.4737 85 R 3.8922 8.0821 119.0513 59.2684 30.0101 178.3241 86 L 3.9627 8.4423 120.6234 58.1726 42.1337 178.3705 87 D 4.2684 8.6279 118.4369 57.3529 41.3410 178.0550 88 R 4.1477 8.4786 119.5535 59.8196 30.0843 178.2866 89 N 4.4115 8.1717 115.8332 56.1558 38.5219 177.4862 90 L 3.7282 8.0479 120.5036 57.6058 41.7310 179.6085 91 W 4.6324 8.4617 119.2773 59.7930 28.7293 178.8273 92 G 3.7455 7.9428 104.6586 47.8048 0.0000 175.4806 93 L 4.1974 7.7656 120.2717 57.3315 41.5891 179.0232 94 A 4.5041 8.8316 121.4680 53.7252 18.1035 178.9156 95 G 4.4525 8.2552 103.0463 45.9466 0.0000 172.9451 96 L 4.7801 7.7140 118.7835 53.4819 45.3849 174.9525 97 N 4.7963 8.9181 121.0406 54.2199 40.6806 174.8943 98 S 4.6293 7.9690 114.7827 57.0673 62.1447 171.8707 99 C 4.9687 8.3232 118.8841 52.8058 44.3029 172.5961 100 P 4.4844 0.0000 0.0000 62.0490 31.6940 176.1487 101 V 4.2202 8.1673 121.0329 61.4322 32.5889 175.1211 102 K 4.4023 8.4303 125.9831 56.0622 33.0650 177.1765 103 E 3.9516 8.1274 118.6423 56.9175 29.9636 176.7773 104 A 4.1936 8.6251 126.1140 54.6997 19.5113 177.6092 105 N 4.3632 8.0864 114.0393 54.6706 39.9873 173.4317 106 Q 5.2166 8.7339 123.9886 54.1308 31.2488 174.9772 107 S 5.0705 8.7441 118.2935 56.1534 66.6747 174.0424 108 T 4.3987 8.4445 110.9446 61.4966 69.4466 174.9171 109 L 3.8175 8.9318 125.4772 58.2979 41.4113 179.0725 110 E 3.9110 8.2434 119.1092 59.6404 29.5993 178.7263 111 N 4.4330 8.3306 116.3406 56.1110 38.5116 177.2892 112 F 4.2166 8.4337 122.2775 61.3409 39.4760 177.2782 113 L 4.0749 8.4460 118.8985 57.7935 41.3855 179.3473 114 E 3.8912 8.1984 118.6991 59.1965 29.3792 179.3847 115 R 3.6101 7.8387 118.8039 59.2233 30.1200 178.3129 116 L 3.5509 7.5881 120.1632 57.7622 42.0296 178.7771 117 K 3.8372 8.0595 119.6687 59.7553 32.1100 178.7864 118 T 3.7572 7.6873 115.8894 66.7548 68.3624 176.6044 119 I 3.6075 7.5221 121.4781 64.6287 37.1084 178.4906 120 M 4.1514 8.4296 119.9197 58.5443 31.8031 179.0930 121 R 3.9606 8.5522 118.5105 59.0164 30.0374 178.8121 122 E 3.9580 8.1387 119.4414 59.1109 29.4245 178.9387 123 K 3.9820 7.8183 117.6260 59.5197 32.4212 178.2767 124 Y 4.1011 8.1463 119.7635 60.7315 38.5982 178.0000 125 S 4.2000 8.3665 113.9467 61.6680 62.3367 176.3982 126 K 4.0857 8.2042 119.0506 58.8639 31.7791 177.9546 127 C 4.4946 7.8964 116.2337 57.0122 40.6868 173.6816 128 S 4.7684 6.8221 114.2961 55.8220 64.9678 174.2885 129 S 4.2714 8.4094 114.3984 58.7272 62.7720 174.0891 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 H 8.44 4.74 0.00 3.14 3.40 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 K 8.29 4.04 0.00 1.87 1.85 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.73 7.81 3 C 7.98 4.97 0.00 2.95 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 4 D 7.95 4.58 0.00 2.84 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 5 I 8.31 3.76 1.87 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 1.65 1.08 0.91 0.00 0.00 6 T 8.74 3.90 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 7 L 8.05 3.98 0.00 1.76 1.82 0.94 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.32 4.05 0.00 2.33 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 9 A 7.90 4.06 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 10 I 7.85 3.66 1.97 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.75 0.85 0.00 0.00 11 I 7.79 3.65 1.95 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 1.36 0.76 0.79 0.00 0.00 12 K 8.38 3.81 0.00 1.84 1.94 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.46 7.81 13 T 7.68 3.73 4.33 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 1.26 0.00 0.00 14 L 8.02 3.94 0.00 1.77 1.64 0.90 0.53 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 15 N 8.04 4.27 0.00 2.76 2.78 0.00 0.00 7.07 8.13 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 16 S 7.64 4.20 0.00 3.11 2.99 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 17 L 7.80 3.85 0.00 1.73 1.64 0.94 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 18 T 8.03 4.52 4.37 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 1.18 0.00 0.00 19 E 7.55 4.47 0.00 2.06 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 0.00 2.36 2.25 0.00 20 Q 7.21 4.57 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.69 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 21 K 8.56 4.65 0.00 1.74 1.66 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.44 7.81 22 T 7.86 4.82 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 23 L 8.50 4.07 0.00 1.75 1.75 0.99 0.84 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 24 C 7.87 5.08 0.00 2.90 3.10 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 25 T 7.99 3.83 4.38 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 1.31 0.00 0.00 26 E 8.01 4.34 0.00 2.02 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 2.31 2.29 0.00 27 L 8.14 4.44 0.00 1.85 1.59 0.65 0.61 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 28 T 8.44 5.18 4.35 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 1.27 0.00 0.00 29 V 8.52 4.65 1.71 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 0.77 0.00 0.00 0.51 0.00 0.00 30 T 8.31 4.28 4.17 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 1.25 0.00 0.00 31 D 9.20 4.73 0.00 2.83 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 32 I 7.90 3.94 1.64 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.36 0.81 0.00 0.00 33 F 7.57 4.82 0.00 3.17 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 34 A 7.85 4.47 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 35 A 7.66 4.23 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 36 S 8.55 4.43 0.00 4.00 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 K 7.29 4.24 0.00 1.85 1.84 0.00 1.48 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.19 1.28 7.81 38 N 8.77 4.72 0.00 2.75 2.80 0.00 0.00 7.15 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 39 T 8.39 4.28 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 40 T 8.31 4.01 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 41 E 8.56 3.60 0.00 1.95 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.05 0.00 42 K 7.90 4.11 0.00 1.86 2.06 0.00 1.75 0.00 0.00 1.92 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.62 1.53 7.81 43 E 8.04 4.00 0.00 2.07 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 0.00 2.36 2.46 0.00 44 T 7.78 3.84 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 1.26 0.00 0.00 45 F 7.74 4.52 0.00 3.25 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 46 C 8.41 4.12 0.00 3.21 3.31 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 47 R 8.18 3.82 0.00 1.97 1.89 0.00 3.29 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 48 A 8.31 4.14 1.56 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 49 A 7.98 4.08 -0.30 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 0.00 0.00 0.00 50 T 7.40 3.98 4.38 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 1.28 0.00 0.00 51 V 7.74 3.56 1.75 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 0.83 0.00 0.00 0.50 0.00 0.00 52 L 7.88 3.98 0.00 1.92 1.82 1.06 0.64 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 53 R 7.93 2.98 0.00 2.42 2.11 0.00 3.62 0.00 0.00 3.41 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.35 0.00 54 Q 7.85 4.02 0.00 2.10 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.59 0.00 0.00 0.00 0.00 0.00 2.46 2.13 0.00 55 F 7.87 3.84 0.00 3.19 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 56 Y 8.25 4.48 0.00 3.33 3.42 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 57 S 7.76 4.30 0.00 4.04 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 0.00 58 H 7.81 4.55 0.00 2.89 3.04 0.00 5.62 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 H 7.84 4.85 0.00 2.96 3.15 0.00 5.62 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.21 4.12 0.00 2.24 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 0.00 2.42 2.39 0.00 61 K 7.87 4.60 0.00 1.78 1.79 0.00 1.86 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.37 7.81 62 D 7.82 4.55 0.00 2.67 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 T 8.52 3.87 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 64 R 8.40 4.10 0.00 1.94 2.03 0.00 3.11 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 65 C 8.01 4.89 0.00 2.93 3.22 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 66 L 7.85 3.76 0.00 1.65 1.66 0.90 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 67 G 8.27 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 9.02 4.27 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 69 T 7.81 4.36 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 1.23 0.00 0.00 70 A 8.46 4.12 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 71 Q 8.09 3.96 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.86 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 72 Q 8.34 4.06 0.00 2.38 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 73 F 8.52 5.04 0.00 3.05 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 74 H 8.62 3.91 0.00 3.23 3.52 0.00 5.84 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 75 R 8.17 3.85 0.00 1.95 2.01 0.00 3.24 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 1.69 1.88 0.00 76 H 8.38 4.14 0.00 3.48 3.60 0.00 5.79 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 77 K 7.86 3.75 0.00 1.64 1.60 0.00 1.44 0.00 0.00 1.06 0.00 0.00 2.13 0.00 0.00 2.45 0.00 0.00 0.00 0.00 1.27 0.95 7.81 78 Q 8.13 3.58 0.00 1.88 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.79 0.00 0.00 0.00 0.00 0.00 2.45 2.01 0.00 79 L 8.28 4.21 0.00 1.91 1.89 1.03 1.18 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 80 I 7.82 3.72 1.89 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.54 0.89 0.00 0.00 81 R 7.98 3.68 0.00 1.76 1.68 0.00 2.91 0.00 0.00 2.98 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.49 0.00 82 F 8.12 4.44 0.00 3.26 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 83 L 8.25 4.14 0.00 1.90 1.95 1.12 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 84 K 7.85 3.80 0.00 1.78 1.68 0.00 1.42 0.00 0.00 1.36 0.00 0.00 2.68 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.35 0.70 7.81 85 R 8.08 3.89 0.00 1.92 2.18 0.00 3.26 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 86 L 8.44 3.96 0.00 1.83 1.96 0.91 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 87 D 8.63 4.27 0.00 3.30 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 88 R 8.48 4.15 0.00 2.09 2.19 0.00 3.18 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 89 N 8.17 4.41 0.00 2.94 2.80 0.00 0.00 7.07 6.19 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 90 L 8.05 3.73 0.00 1.59 1.47 0.89 0.60 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 91 W 8.46 4.63 0.00 3.53 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 92 G 7.94 3.75 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 0.00 0.00 0.00 93 L 7.77 4.20 0.00 1.54 1.54 0.24 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.83 4.50 1.61 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 0.00 0.00 0.00 0.00 0.00 0.00 95 G 8.26 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 0.00 0.00 0.00 0.00 96 L 7.71 4.78 0.00 1.49 1.64 1.02 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.92 4.80 0.00 2.67 2.69 0.00 0.00 6.95 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 S 7.97 4.63 0.00 3.88 3.87 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 99 C 8.32 4.97 0.00 3.05 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.48 0.00 2.07 2.02 0.00 3.63 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 101 V 8.17 4.22 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 0.80 0.00 0.00 0.91 0.00 0.00 102 K 8.43 4.40 0.00 1.75 1.82 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.49 7.81 103 E 8.13 3.95 0.00 1.91 1.91 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 2.57 2.39 0.00 104 A 8.63 4.19 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 0.00 105 N 8.09 4.36 0.00 2.88 2.75 0.00 0.00 6.98 7.62 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 0.00 106 Q 8.73 5.22 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.56 0.00 0.00 0.00 0.00 0.00 2.44 2.28 0.00 107 S 8.74 5.07 0.00 3.98 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 T 8.44 4.40 4.43 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 1.29 0.00 0.00 109 L 8.93 3.82 0.00 1.24 1.71 0.39 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.24 3.91 0.00 2.27 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 2.41 0.00 111 N 8.33 4.43 0.00 2.86 2.91 0.00 0.00 6.73 7.41 0.00 0.00 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 8.43 4.22 0.00 3.16 3.22 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 0.00 113 L 8.45 4.07 0.00 1.89 1.71 0.89 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.20 3.89 0.00 2.11 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 2.47 2.43 0.00 115 R 7.84 3.61 0.00 1.85 1.78 0.00 2.99 0.00 0.00 2.84 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.70 0.00 116 L 7.59 3.55 0.00 1.61 1.68 1.06 0.54 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 0.00 117 K 8.06 3.84 0.00 1.87 1.88 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.41 7.81 118 T 7.69 3.76 4.25 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 1.11 0.00 0.00 119 I 7.52 3.61 1.82 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.29 0.88 0.00 0.00 120 M 8.43 4.15 0.00 2.00 2.20 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.95 0.00 121 R 8.55 3.96 0.00 1.94 1.92 0.00 3.04 0.00 0.00 3.00 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 122 E 8.14 3.96 0.00 2.15 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 0.00 2.28 2.39 0.00 123 K 7.82 3.98 0.00 2.04 1.95 0.00 2.11 0.00 0.00 1.92 0.00 0.00 3.07 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.54 1.80 7.81 124 Y 8.15 4.10 0.00 3.04 3.10 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 0.00 125 S 8.37 4.20 0.00 4.07 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 0.00 126 K 8.20 4.09 0.00 1.89 1.86 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.63 7.81 127 C 7.90 4.49 0.00 2.97 2.99 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 0.00 128 S 6.82 4.77 0.00 3.87 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 0.00 129 S 8.41 4.27 0.00 4.00 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