NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2455 8.4444 120.2135 55.5327 30.9479 174.7982 3 L 3.9187 8.1974 122.6174 54.9926 42.8102 174.2934 4 K 4.7347 8.3840 124.4924 54.4394 36.8395 174.4245 5 S 5.2174 8.3660 114.6223 57.4948 65.8674 173.8736 6 T 4.8257 8.5076 113.8433 59.9058 70.8000 172.8057 7 R 3.8495 8.3681 119.2285 60.2731 30.0800 178.5500 8 H 5.1252 7.6292 114.2428 54.9299 30.0725 173.2917 9 T 4.8875 7.6028 106.9351 60.4401 72.7968 172.7467 10 K 5.1740 8.5557 121.4993 54.8824 34.9934 175.1305 11 Y 4.8484 9.0370 121.9614 55.8911 42.0872 174.1312 12 L 4.5735 8.5015 122.1004 54.2322 44.4222 175.1174 13 C 4.6046 8.9362 124.6549 57.8236 30.6654 172.1506 14 N 5.3243 8.1214 120.7551 51.4655 41.1882 173.5134 15 Y 5.3632 9.0061 119.6798 56.7047 42.9829 173.7272 16 H 5.4295 9.3925 120.2764 54.3960 31.1943 173.8801 17 F 5.6853 9.7458 122.0953 55.8181 42.4880 174.5960 18 V 5.4116 9.5826 122.0104 60.2565 35.0049 173.9720 19 W 5.7183 8.0905 123.0508 55.4736 31.6415 173.0037 20 I 5.2186 8.5494 113.2244 58.2261 40.7078 173.2871 21 P 4.9858 0.0000 0.0000 62.5554 32.2050 176.6962 22 K 4.0797 8.9359 121.7495 59.8222 32.3674 177.6567 23 H 4.7409 8.1566 113.0998 56.8125 29.7867 175.5400 24 R 4.7370 7.3048 117.7088 54.3299 32.8082 176.6123 25 R 4.1920 8.6523 119.2391 57.3181 30.3499 176.6462 26 N 5.0645 7.3712 115.6502 52.8104 37.8469 176.6833 27 T 3.9620 8.2157 116.6317 67.7715 69.0039 176.1460 28 L 4.3560 7.6906 125.0474 53.2981 40.4715 176.0847 29 V 4.7856 7.1384 115.0130 59.5275 37.2325 178.0294 30 N 3.9767 8.3593 119.0851 54.0635 38.0484 177.4182 31 E 4.0757 8.8377 124.4355 60.5675 29.1925 178.5583 32 I 2.8935 7.3006 119.1157 63.9826 37.1436 178.1796 33 A 4.0325 7.6924 121.1757 55.0615 18.3163 179.5077 34 E 3.9455 8.2166 117.1760 59.8828 29.5245 179.0655 35 Y 4.3294 8.4230 119.5969 60.9242 38.8797 177.9468 36 T 3.8909 8.1924 116.8329 66.5749 68.6230 176.4438 37 K 3.9663 8.1366 121.4776 59.4121 32.1948 178.7015 38 E 3.9333 7.9896 118.5431 59.6599 29.3730 179.8524 39 V 3.5556 7.7867 112.7030 64.2554 31.5303 178.7171 40 L 4.2035 8.1418 118.8999 57.7681 41.4493 179.7056 41 K 4.1240 8.1459 118.5399 59.4846 31.8696 179.6699 42 S 4.1779 8.1109 115.5920 61.6243 62.7500 176.7794 43 I 3.6524 8.1618 122.5978 64.1127 36.7307 178.2734 44 A 4.1920 8.3110 121.6965 55.2918 18.3890 179.2873 45 E 3.9166 8.2806 117.8053 59.4104 29.4930 178.5045 46 E 3.9634 8.2226 118.6174 59.1449 29.8128 178.0945 47 L 4.3798 7.9000 116.0009 54.4576 41.9608 177.3798 48 G 3.9506 7.7947 106.8340 46.3073 0.0000 173.1707 49 C 4.9456 8.2872 116.5581 58.0300 30.5446 172.9487 50 E 4.6337 9.1771 122.9521 54.3872 31.3938 175.0672 51 I 4.1383 8.4215 128.6500 61.7087 37.2607 176.0133 52 I 4.0689 8.7840 128.6407 63.4895 38.0953 176.4109 53 A 4.6857 7.5797 121.1568 50.7399 22.6502 175.1954 54 L 4.9442 8.4076 122.8395 53.6556 45.2684 174.9341 55 E 4.5398 9.2094 126.5565 54.6031 32.1909 175.2997 56 V 4.3819 8.4610 125.2646 61.5775 32.2440 174.6290 57 M 4.5461 8.3957 127.4709 52.4567 34.4158 175.7269 58 P 4.5847 0.0000 0.0000 64.5247 31.5018 177.7963 59 D 4.8268 7.5534 113.7742 52.4941 39.9530 174.5849 60 H 4.7144 7.3841 114.0698 55.6374 32.4122 172.7195 61 I 4.5842 7.8816 119.9129 59.4857 40.3824 174.1861 62 H 4.8751 8.8391 126.3384 54.3332 32.5316 171.9164 63 L 4.7296 9.0899 129.2811 53.2004 44.5075 174.6993 64 F 5.7376 9.4351 130.2468 56.6249 41.2569 174.4491 65 V 4.8310 9.0000 125.6186 59.9430 35.4678 173.7292 66 N 5.3463 9.2223 121.6506 52.5837 40.4065 173.5604 67 C 5.4644 9.2961 123.2374 57.1683 32.6087 172.4020 68 P 3.9679 0.0000 0.0000 61.7456 31.4483 176.0429 69 P 4.3573 0.0000 0.0000 64.4001 31.2902 177.4211 70 R 3.8669 7.4234 114.8563 57.6222 29.8408 175.7155 71 Y 4.7112 7.1288 116.9283 56.3243 39.8470 175.7735 72 A 4.4046 8.4570 125.8538 50.9150 20.9213 176.6304 73 P 4.0938 0.0000 0.0000 66.0933 31.4817 179.4791 74 S 4.3586 8.0769 114.5599 61.0248 62.7450 175.9868 75 Y 4.0187 7.8861 122.0031 60.4830 38.5816 177.7059 76 L 3.5319 7.9828 119.6624 57.5431 41.6991 179.2457 77 A 3.1163 7.5397 120.5419 55.1348 18.1176 179.5755 78 N 3.9753 7.6736 114.5841 55.9603 38.3959 177.2275 79 Y 3.6099 7.4654 121.2656 60.3218 38.7652 177.4465 80 F 3.8238 7.9365 119.0251 60.3719 38.9546 177.9334 81 K 3.3561 7.5120 118.1874 59.0197 31.8651 179.8052 82 G 3.4484 7.8972 106.3871 47.7136 0.0000 175.7656 83 K 3.8271 7.8005 122.9381 58.7818 32.1191 179.1190 84 S 4.1641 7.9056 114.3538 61.2773 62.9366 176.3174 85 A 3.8739 8.3146 124.4930 54.8343 18.2350 179.4755 86 R 3.8153 7.8309 116.7862 59.6895 30.1505 178.7945 87 L 4.1143 7.9590 118.6895 57.8627 41.5831 179.6165 88 I 4.1948 8.5209 120.1514 64.6156 36.8901 178.5779 89 L 4.0283 8.2080 119.0878 57.5066 41.4319 179.2043 90 K 4.0609 7.7638 118.7248 59.1868 32.2385 178.4916 91 K 3.9071 7.8681 118.8578 57.1384 33.1966 176.6094 92 F 4.7327 8.0547 118.4387 53.8557 39.4970 173.3146 93 P 4.2675 0.0000 0.0000 65.2900 31.2546 179.1846 94 Q 4.1445 8.0267 115.4334 58.1917 28.7920 176.6314 95 L 4.3303 8.5090 117.6043 56.0124 43.1731 177.9131 96 N 3.1400 9.4250 110.5550 54.3197 39.7650 176.5097 97 K 4.4143 6.3530 112.2232 57.3947 31.3229 176.3382 98 G 3.9538 7.9627 110.5989 45.0845 0.0000 174.5531 99 K 4.0953 8.3947 122.2492 56.3959 33.0063 176.8733 100 L 3.8340 8.3946 124.1454 56.9145 42.2937 176.8094 101 W 5.4497 7.4527 115.9349 54.8460 31.5853 175.2476 102 T 4.3916 8.1028 111.1129 61.0850 69.3127 174.7405 103 R 4.2243 8.4136 119.9131 57.1971 30.3707 176.0452 104 S 4.6574 7.3802 112.6022 58.6177 64.4419 172.3501 105 Y 5.1149 7.3861 117.0374 56.7061 40.7670 172.4343 106 F 5.1433 9.5692 123.7761 56.5872 42.1242 174.7250 107 V 5.4836 7.8188 123.5693 59.5497 34.3809 174.1475 108 A 4.6872 8.1850 125.0503 50.3329 22.5679 175.5032 109 T 4.6729 8.6336 111.7292 61.7287 70.1016 173.7503 110 A 4.7637 9.2992 123.7536 49.8164 22.3447 175.3567 111 G 4.3218 7.9038 109.9825 44.7155 0.0000 172.9301 112 N 5.0303 7.8185 117.5761 51.1469 39.4046 175.0976 113 V 3.7259 7.5689 118.5419 61.6719 32.7109 177.5894 114 S 4.6323 8.3396 117.6261 57.5194 65.8952 175.5732 115 S 4.1683 8.4938 118.0182 61.5984 62.7067 176.4727 116 E 4.0578 8.1473 121.9956 59.2073 29.2129 179.2443 117 V 3.6106 7.6040 118.3829 66.0161 31.6388 178.2381 118 I 3.7896 7.5815 119.7431 64.2096 36.9808 178.2901 119 K 3.9877 8.6367 120.8822 59.3953 31.9498 178.6838 120 K 3.9529 8.3607 120.0781 59.6039 32.1145 177.9693 121 Y 4.0394 8.2277 119.7776 60.8427 38.7593 178.1793 122 I 3.6359 7.9815 120.5108 64.6157 37.2227 178.3590 123 E 4.1363 8.3275 119.2790 59.4328 29.2387 179.2957 124 E 3.9396 8.4702 119.0527 59.4782 29.4111 179.4410 125 Q 3.7520 7.8582 118.1308 58.6134 28.5803 178.7984 126 W 4.0420 8.0349 119.9476 59.4409 28.8442 178.6712 127 R 3.9556 8.1147 118.3997 59.1807 29.5589 178.4044 128 K 4.1314 7.8089 117.6900 59.1798 32.2517 178.6819 129 E 4.0141 8.2438 119.2224 56.7325 29.7834 178.0182 130 G 4.1821 9.0840 102.8882 45.5062 0.0000 173.0193 131 E 4.4090 8.2913 115.3434 56.5741 29.6074 175.1525 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 2 E 8.44 4.25 0.00 1.92 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 2.18 2.22 0.00 3 L 8.20 3.92 0.00 1.64 1.49 0.87 0.21 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 4 K 8.38 4.73 0.00 0.79 1.40 0.00 1.51 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.18 1.25 7.81 5 S 8.37 5.22 0.00 3.92 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 6 T 8.51 4.83 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 1.28 0.00 0.00 7 R 8.37 3.85 0.00 1.66 1.78 0.00 2.97 0.00 0.00 2.90 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.51 0.00 8 H 7.63 5.13 0.00 3.08 3.25 0.00 5.94 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 9 T 7.60 4.89 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 1.24 0.00 0.00 10 K 8.56 5.17 0.00 1.46 1.71 0.00 1.84 0.00 0.00 1.81 0.00 0.00 2.86 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.55 1.69 7.81 11 Y 9.04 4.85 0.00 2.99 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 12 L 8.50 4.57 0.00 1.53 1.53 0.88 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 13 C 8.94 4.60 0.00 3.28 2.76 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 14 N 8.12 5.32 0.00 2.80 2.58 0.00 0.00 6.77 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 15 Y 9.01 5.36 0.00 2.70 2.27 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 16 H 9.39 5.43 0.00 3.16 3.34 0.00 5.55 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 F 9.75 5.69 0.00 3.13 3.26 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 0.00 18 V 9.58 5.41 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 0.83 0.00 0.00 0.80 0.00 0.00 19 W 8.09 5.72 0.00 3.37 3.30 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 20 I 8.55 5.22 2.12 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 1.56 1.11 1.03 0.00 0.00 21 P 0.00 4.99 0.00 2.28 2.24 0.00 4.09 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.22 0.00 22 K 8.94 4.08 0.00 1.75 1.70 0.00 1.77 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.01 1.33 7.81 23 H 8.16 4.74 0.00 3.19 3.33 0.00 5.69 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 R 7.30 4.74 0.00 1.99 2.00 0.00 3.12 0.00 0.00 3.17 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 25 R 8.65 4.19 0.00 1.82 1.99 0.00 3.16 0.00 0.00 3.29 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 26 N 7.37 5.06 0.00 2.83 2.85 0.00 0.00 6.94 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 27 T 8.22 3.96 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 1.13 0.00 0.00 28 L 7.69 4.36 0.00 1.93 1.64 1.25 0.97 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 29 V 7.14 4.79 2.05 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 0.94 0.00 0.00 0.88 0.00 0.00 30 N 8.36 3.98 0.00 2.88 2.14 0.00 0.00 6.81 7.66 0.00 0.00 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 E 8.84 4.08 0.00 2.10 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 0.00 2.52 2.55 0.00 32 I 7.30 2.89 1.73 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.07 0.06 0.65 0.00 0.00 33 A 7.69 4.03 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 34 E 8.22 3.95 0.00 2.32 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 2.37 2.54 0.00 35 Y 8.42 4.33 0.00 3.39 3.29 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 36 T 8.19 3.89 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 1.46 0.00 0.00 37 K 8.14 3.97 0.00 1.99 1.92 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.48 7.81 38 E 7.99 3.93 0.00 2.20 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 2.64 0.00 39 V 7.79 3.56 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 0.04 0.00 0.00 0.94 0.00 0.00 40 L 8.14 4.20 0.00 1.75 1.81 0.95 1.00 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 41 K 8.15 4.12 0.00 2.01 1.89 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.72 7.81 42 S 8.11 4.18 0.00 4.03 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 43 I 8.16 3.65 1.95 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.90 0.26 0.00 0.00 44 A 8.31 4.19 1.62 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 45 E 8.28 3.92 0.00 2.23 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 2.34 2.49 0.00 46 E 8.22 3.96 0.00 2.10 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 2.33 2.39 0.00 47 L 7.90 4.38 0.00 1.49 1.32 0.22 0.31 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 48 G 7.79 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 49 C 8.29 4.95 0.00 3.12 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 50 E 9.18 4.63 0.00 2.00 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 2.18 2.25 0.00 51 I 8.42 4.14 1.88 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 1.35 0.70 0.92 0.00 0.00 52 I 8.78 4.07 1.30 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.29 0.77 0.00 0.00 53 A 7.58 4.69 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 54 L 8.41 4.94 0.00 1.53 1.47 0.83 0.86 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 55 E 9.21 4.54 0.00 1.91 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 2.21 2.24 0.00 56 V 8.46 4.38 2.05 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 0.82 0.00 0.00 0.89 0.00 0.00 57 M 8.40 4.55 0.00 1.99 1.63 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 58 P 0.00 4.58 0.00 2.22 2.12 0.00 3.80 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 2.11 2.04 0.00 59 D 7.55 4.83 0.00 2.79 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 60 H 7.38 4.71 0.00 3.12 3.34 0.00 5.20 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 I 7.88 4.58 0.56 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.40 -0.00 0.00 0.00 62 H 8.84 4.88 0.00 3.09 3.16 0.00 5.55 0.00 0.00 0.00 0.00 6.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 9.09 4.73 0.00 1.45 1.45 0.73 -0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.44 5.74 0.00 2.85 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 65 V 9.00 4.83 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 1.08 0.00 0.00 1.10 0.00 0.00 66 N 9.22 5.35 0.00 2.72 2.80 0.00 0.00 7.07 7.67 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 67 C 9.30 5.46 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 68 P 0.00 3.97 0.00 2.04 1.83 0.00 4.06 0.00 0.00 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.23 0.00 69 P 0.00 4.36 0.00 2.00 1.90 0.00 2.89 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.45 0.00 70 R 7.42 3.87 0.00 1.55 1.77 0.00 2.39 0.00 0.00 2.84 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.50 0.00 71 Y 7.13 4.71 0.00 3.06 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 72 A 8.46 4.40 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 73 P 0.00 4.09 0.00 2.16 1.87 0.00 3.62 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 2.09 1.65 0.00 74 S 8.08 4.36 0.00 3.97 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 75 Y 7.89 4.02 0.00 3.10 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 76 L 7.98 3.53 0.00 1.81 1.50 1.09 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 77 A 7.54 3.12 0.34 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 78 N 7.67 3.98 0.00 2.63 2.74 0.00 0.00 6.74 6.75 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 79 Y 7.47 3.61 0.00 2.11 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 0.00 0.00 0.00 80 F 7.94 3.82 0.00 2.71 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 81 K 7.51 3.36 0.00 1.25 1.27 0.00 0.62 0.00 0.00 0.92 0.00 0.00 2.57 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.30 0.21 7.81 82 G 7.90 3.45 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 83 K 7.80 3.83 0.00 0.98 1.31 0.00 1.36 0.00 0.00 1.39 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.23 1.24 7.81 84 S 7.91 4.16 0.00 4.33 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 0.00 85 A 8.31 3.87 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 86 R 7.83 3.82 0.00 1.90 2.07 0.00 3.08 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 87 L 7.96 4.11 0.00 1.95 1.89 0.89 0.98 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 88 I 8.52 4.19 2.00 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 1.69 0.73 1.05 0.00 0.00 89 L 8.21 4.03 0.00 1.74 1.73 0.82 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 90 K 7.76 4.06 0.00 1.88 2.00 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.40 7.81 91 K 7.87 3.91 0.00 1.26 1.12 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.48 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 0.70 7.81 92 F 8.05 4.73 0.00 3.24 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 93 P 0.00 4.27 0.00 2.20 2.30 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.93 0.00 94 Q 8.03 4.14 0.00 2.19 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.29 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 95 L 8.51 4.33 0.00 1.82 1.69 0.85 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 96 N 9.43 3.14 0.00 2.97 2.45 0.00 0.00 7.37 6.67 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 97 K 6.35 4.41 0.00 1.80 2.07 0.00 1.62 0.00 0.00 1.50 0.00 0.00 3.02 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.31 1.32 7.81 98 G 7.96 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 99 K 8.39 4.10 0.00 1.77 1.77 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.76 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.39 7.81 100 L 8.39 3.83 0.00 1.34 0.92 0.54 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 101 W 7.45 5.45 0.00 3.25 3.05 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 0.00 102 T 8.10 4.39 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 1.32 0.00 0.00 103 R 8.41 4.22 0.00 1.82 2.02 0.00 3.34 0.00 0.00 3.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 104 S 7.38 4.66 0.00 4.01 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 0.00 105 Y 7.39 5.11 0.00 3.38 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 0.00 106 F 9.57 5.14 0.00 3.13 3.08 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 0.00 0.00 0.00 107 V 7.82 5.48 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 0.67 0.00 0.00 0.61 0.00 0.00 108 A 8.19 4.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 T 8.63 4.67 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 1.35 0.00 0.00 110 A 9.30 4.76 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 111 G 7.90 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 0.00 0.00 0.00 0.00 112 N 7.82 5.03 0.00 2.65 2.72 0.00 0.00 6.97 7.68 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 0.00 113 V 7.57 3.73 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 0.73 0.00 0.00 0.92 0.00 0.00 114 S 8.34 4.63 0.00 4.27 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 0.00 115 S 8.49 4.17 0.00 4.09 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 0.00 116 E 8.15 4.06 0.00 2.09 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 2.41 2.44 0.00 117 V 7.60 3.61 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 1.04 0.00 0.00 0.94 0.00 0.00 118 I 7.58 3.79 2.05 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 1.41 0.74 0.98 0.00 0.00 119 K 8.64 3.99 0.00 1.90 2.00 0.00 1.66 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.49 7.81 120 K 8.36 3.95 0.00 1.98 2.05 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.48 7.81 121 Y 8.23 4.04 0.00 3.15 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 0.00 122 I 7.98 3.64 2.13 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 1.69 1.10 1.15 0.00 0.00 123 E 8.33 4.14 0.00 2.15 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 2.55 2.52 0.00 124 E 8.47 3.94 0.00 1.97 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 2.51 2.49 0.00 125 Q 7.86 3.75 0.00 1.73 1.69 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 1.34 1.80 0.00 126 W 8.03 4.04 0.00 3.43 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 0.00 127 R 8.11 3.96 0.00 1.94 2.13 0.00 3.26 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 128 K 7.81 4.13 0.00 1.83 1.80 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.65 7.81 129 E 8.24 4.01 0.00 1.67 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 1.87 2.32 0.00 130 G 9.08 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 0.00 0.00 0.00 0.00 131 E 8.29 4.41 0.00 2.01 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 2.24 2.29 0.00