NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 E 4.2634 8.3027 121.7413 56.1459 31.4201 174.3239 2 Q 4.2915 8.8055 129.2460 54.8672 28.7304 173.5915 3 L 4.6447 8.8107 127.5899 54.5910 43.3509 176.5737 4 T 4.2904 8.8254 112.3760 60.3724 71.1786 175.3627 5 K 3.4325 8.7743 122.4493 60.4421 32.0693 179.4168 6 C 4.4787 7.9975 115.4356 59.1360 38.3750 175.5824 7 E 3.8519 7.6138 121.8610 59.1203 29.2121 178.7422 8 V 3.4543 7.9986 118.6986 65.9302 31.2774 177.5184 9 F 4.0412 7.8634 118.9822 61.5256 39.3572 177.0725 10 R 4.1408 8.3148 117.3647 59.5506 29.7342 179.0685 11 E 4.0589 8.0065 116.7858 58.6804 29.5761 178.2571 12 L 4.3454 7.6649 117.9191 54.3978 41.7123 178.1375 13 K 3.6364 7.6153 123.7745 59.7133 32.1511 178.6333 14 D 4.4096 7.9939 116.8434 57.0818 41.0021 177.3177 15 L 4.0222 7.9599 118.1909 55.4802 41.8672 176.3318 16 K 4.2060 7.7463 120.9292 58.7507 31.8910 176.8438 17 G 3.9854 8.9339 116.1010 45.1701 0.0000 171.6809 18 Y 4.1464 8.2642 122.5469 58.2856 39.1556 175.7632 19 G 3.9137 8.7464 114.3925 45.8883 0.0000 173.2748 20 G 3.8820 7.8717 105.2912 46.0316 0.0000 174.0438 21 V 4.0671 7.4644 119.5776 60.6088 32.5799 175.8608 22 S 4.7557 8.5902 122.8481 57.8215 65.0553 175.4228 23 L 4.0541 8.3302 122.1070 57.6964 41.4424 177.7825 24 P 4.6531 0.0000 0.0000 65.9687 31.1692 178.4693 25 E 3.8654 8.2238 117.2966 59.2280 29.3070 179.4180 26 W 4.2862 8.1827 118.9273 59.4018 29.2768 178.9578 27 V 3.7570 8.7005 118.9917 65.9482 31.0138 177.3249 28 C 2.4500 7.7538 118.1450 59.3529 38.7006 175.7103 29 T 3.7889 8.0175 117.9101 66.8106 67.9854 176.8223 30 T 3.8874 8.2541 111.8977 64.6233 68.5965 175.9230 31 F 3.1415 7.8173 123.0957 61.2833 39.1035 176.5376 32 H 4.2043 7.8701 112.0286 57.2167 28.7020 176.6334 33 T 4.4908 7.4743 117.2234 64.1796 69.5742 175.2183 34 S 4.5257 8.1646 112.3163 56.6694 64.1688 174.5850 35 G 3.4193 8.6580 108.7213 46.8159 0.0000 173.8146 36 Y 3.8115 7.7269 113.7328 58.3365 35.7163 168.1879 37 D 5.3069 7.6920 120.5195 52.7834 42.3511 177.0849 38 T 4.1505 8.4647 117.2409 63.6121 69.9852 175.8342 39 Q 4.5661 8.5436 120.1835 55.5449 29.6882 175.6477 40 A 4.2094 7.8541 123.0080 52.1455 19.5429 177.3351 41 I 4.7808 8.3046 122.4326 59.3950 40.6066 174.9187 42 V 4.4867 8.3872 127.2911 60.9660 33.7292 174.3349 43 Q 5.1269 8.2900 124.5297 53.3965 31.9218 174.6414 44 N 4.4561 8.9630 115.0049 55.3400 40.3716 174.5028 45 N 3.8681 8.3766 114.1905 54.1155 39.1437 175.7889 46 D 4.8421 7.8338 116.0935 52.8217 41.2302 175.7739 47 S 4.9394 9.0747 115.1387 56.8828 66.4651 172.6256 48 T 5.0260 9.5883 110.8449 60.1113 72.3112 172.5096 49 E 5.4405 9.0947 122.9208 54.9381 33.6134 174.5337 50 Y 4.9839 8.7737 119.9188 57.7202 42.0068 176.8152 51 G 4.2991 9.1836 112.9960 45.4633 0.0000 172.7866 52 L 3.8055 8.7208 119.4643 58.1765 41.8030 179.0024 53 F 4.8412 8.1494 112.9600 56.9751 39.9218 175.3459 54 Q 3.5981 7.9894 119.3740 57.0763 26.6309 174.1210 55 I 4.1655 8.1274 119.2940 61.1217 38.7456 177.2488 56 N 5.6939 8.9705 124.3330 51.7148 39.8357 175.0043 57 N 5.2058 8.7426 116.7208 52.6674 37.7021 176.3391 58 K 4.3525 8.7049 120.7174 59.0932 32.5428 177.9741 59 I 4.8680 7.4963 107.4425 58.5460 39.2110 176.7075 60 W 4.5464 7.9781 121.5669 58.4249 29.5299 173.3172 61 C 5.6820 7.8822 110.6298 54.0092 42.1499 172.5522 62 K 4.8583 8.7491 120.9323 55.0489 33.5149 174.7930 63 D 4.9057 8.3164 124.7189 52.1163 42.9499 175.6183 64 D 4.4038 8.9443 117.9589 57.6510 41.0036 178.1454 65 Q 4.1634 8.3709 118.6279 58.7300 29.4127 176.1649 66 N 5.0043 9.0130 117.1333 50.9099 38.8881 172.4492 67 P 4.5015 0.0000 0.0000 64.5169 32.0992 177.8047 68 H 4.6322 8.2089 114.5666 55.3569 28.7349 174.8305 69 S 4.1915 7.6248 114.6004 58.5657 62.6776 174.7502 70 S 3.9842 8.8573 120.8962 59.7703 63.3049 173.5508 71 N 4.1247 7.9846 118.7362 54.7206 37.2602 175.0318 72 I 3.8353 7.9244 119.4634 64.4925 37.8580 177.5340 73 C 4.4533 8.5856 115.9927 57.0884 40.8394 172.5221 74 N 4.0409 8.0300 117.4527 53.4046 37.0889 173.2087 75 I 4.2526 7.8475 117.0105 59.8123 42.1073 173.0829 76 S 4.5307 8.2111 120.9970 58.0085 63.0579 175.7902 77 C 3.7889 8.9719 125.6650 60.0241 34.2147 176.1200 78 D 4.0603 7.3657 118.6894 56.6863 40.1127 178.3046 79 K 4.1261 7.5121 117.7414 57.8118 32.0295 177.3052 80 F 5.3426 7.6361 117.5903 56.5893 38.9913 176.7813 81 L 5.4883 7.9945 119.2875 53.8141 43.0236 176.2365 82 D 4.8579 7.8227 118.0893 52.4788 41.7506 175.1823 83 D 4.6029 8.5391 116.7050 54.7665 41.7624 175.8426 84 D 4.6275 8.0638 119.6508 53.2065 40.9421 176.2385 85 L 4.6342 8.3456 126.2695 55.3016 41.9121 178.3726 86 T 3.8491 8.1667 117.7891 67.1888 68.4542 175.9078 87 D 4.4231 8.0547 120.0787 56.4696 39.0424 177.8029 88 D 4.3227 8.4113 119.9213 57.5682 40.7683 178.9519 89 I 3.2988 7.9075 120.0705 64.2200 37.1970 178.2654 90 M 3.8529 7.8236 119.5826 58.5836 31.8619 177.9332 91 C 4.1809 8.2043 118.4196 59.6693 41.7350 175.5770 92 V 3.2460 7.2524 119.6517 65.8204 30.8192 178.0930 93 K 3.5845 7.8479 118.2078 59.3008 31.6930 179.2478 94 K 3.9543 7.6967 118.2355 59.6951 32.0263 179.2854 95 I 2.8303 7.7925 120.0469 64.1773 36.4949 178.4938 96 L 4.1985 8.3722 120.1072 58.0414 41.2453 179.3877 97 D 4.4812 8.6187 118.4056 56.5184 40.7577 178.2009 98 K 4.4514 7.6219 117.7553 57.9329 33.1421 177.9328 99 V 4.2915 8.1336 108.2943 60.1928 33.8361 176.4454 100 G 4.0087 8.1478 106.9218 45.1394 0.0000 173.7686 101 I 4.0680 8.2122 117.0368 63.9902 37.9470 176.9902 102 N 4.7196 8.1809 114.9702 54.0362 38.6256 174.8665 103 Y 3.7878 7.8243 120.4237 60.0405 38.8575 176.5321 104 W 4.4232 8.6091 122.7094 55.2241 28.5389 176.9438 105 L 4.0427 8.2476 124.7432 57.2237 41.0606 179.0608 106 A 4.0766 8.1101 120.6876 55.0001 18.3753 178.7071 107 H 3.8846 8.3130 117.1128 59.4565 29.6783 177.3893 108 K 3.8858 7.9390 118.8982 59.5705 32.3035 178.2334 109 A 4.1554 7.4600 118.7076 54.1174 18.4421 177.9843 110 L 4.6842 7.9431 114.0930 54.9401 43.6684 176.3941 111 C 5.0410 8.0644 115.0601 56.9326 41.6205 174.4483 112 S 4.6541 8.2034 112.1864 57.6116 64.0219 173.7389 113 E 4.4872 8.0535 118.5596 55.6998 31.8570 173.5794 114 K 3.6110 8.9780 121.5970 57.7087 32.8873 174.3626 115 L 5.1877 8.2476 119.1673 54.2211 43.8406 177.4349 116 D 4.5421 8.2073 118.3890 54.8814 39.5213 176.8420 117 Q 3.9026 7.6198 116.8768 56.7140 29.1212 176.1298 118 W 4.8545 7.7902 118.5666 56.4633 29.7263 175.1343 119 L 4.5898 7.7734 118.0215 53.8871 42.8406 177.8954 120 C 4.4243 7.6710 122.5189 62.3760 40.4968 175.8274 121 E 3.6267 8.4133 111.5093 57.3904 27.1648 178.7413 122 K 4.2721 8.2528 131.5687 55.9004 32.2799 177.7925 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 E 8.30 4.26 0.00 2.33 1.92 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 0.00 2.29 2.33 0.00 2 Q 8.81 4.29 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.61 0.00 3 L 8.81 4.64 0.00 1.56 1.43 0.86 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.83 4.29 4.20 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 1.21 0.00 0.00 5 K 8.77 3.43 0.00 1.90 1.85 0.00 1.83 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.66 1.91 7.81 6 C 8.00 4.48 0.00 2.95 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 7 E 7.61 3.85 0.00 2.05 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 0.00 2.26 2.29 0.00 8 V 8.00 3.45 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 0.92 0.00 0.00 0.54 0.00 0.00 9 F 7.86 4.04 0.00 3.09 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 10 R 8.31 4.14 0.00 2.21 1.99 0.00 3.23 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.85 0.00 11 E 8.01 4.06 0.00 2.02 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 2.32 2.42 0.00 12 L 7.66 4.35 0.00 1.57 1.45 0.70 0.82 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 13 K 7.62 3.64 0.00 1.77 1.76 0.00 1.63 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.36 7.81 14 D 7.99 4.41 0.00 2.61 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 15 L 7.96 4.02 0.00 1.69 1.51 -0.21 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 16 K 7.75 4.21 0.00 1.65 1.78 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.37 7.81 17 G 8.93 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 0.00 0.00 0.00 18 Y 8.26 4.15 0.00 3.11 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 19 G 8.75 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 0.00 0.00 0.00 20 G 7.87 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 21 V 7.46 4.07 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 0.08 0.00 0.00 0.69 0.00 0.00 22 S 8.59 4.76 0.00 4.17 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 23 L 8.33 4.05 0.00 1.65 1.58 0.85 0.32 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 24 P 0.00 4.65 0.00 2.29 2.34 0.00 3.72 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.49 0.00 25 E 8.22 3.87 0.00 2.12 1.73 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 2.42 2.32 0.00 26 W 8.18 4.29 0.00 3.38 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 27 V 8.70 3.76 2.41 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 1.38 0.00 0.00 1.25 0.00 0.00 28 C 7.75 2.45 0.00 1.63 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 29 T 8.02 3.79 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 1.11 0.00 0.00 30 T 8.25 3.89 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 0.96 0.00 0.00 31 F 7.82 3.14 0.00 2.59 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 32 H 7.87 4.20 0.00 3.31 3.24 0.00 5.70 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.47 4.49 4.41 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 1.50 0.00 0.00 34 S 8.16 4.53 0.00 4.06 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 0.00 35 G 8.66 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 0.00 0.00 0.00 36 Y 7.73 3.81 0.00 3.44 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 37 D 7.69 5.31 0.00 2.78 2.66 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 0.00 0.00 0.00 0.00 38 T 8.46 4.15 4.46 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 1.27 0.00 0.00 39 Q 8.54 4.57 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.85 0.00 0.00 0.00 0.00 0.00 2.45 2.40 0.00 40 A 7.85 4.21 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 41 I 8.30 4.78 1.82 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.93 0.72 0.00 0.00 42 V 8.39 4.49 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 1.03 0.00 0.00 0.93 0.00 0.00 43 Q 8.29 5.13 0.00 2.01 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.19 0.00 0.00 0.00 0.00 0.00 2.16 2.13 0.00 44 N 8.96 4.46 0.00 2.68 2.68 0.00 0.00 6.95 6.71 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 45 N 8.38 3.87 0.00 2.92 3.04 0.00 0.00 6.22 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 46 D 7.83 4.84 0.00 2.77 2.81 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 47 S 9.07 4.94 0.00 4.00 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 48 T 9.59 5.03 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 1.23 0.00 0.00 49 E 9.09 5.44 0.00 1.92 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 2.47 2.32 0.00 50 Y 8.77 4.98 0.00 3.23 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 51 G 9.18 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 0.00 0.00 0.00 52 L 8.72 3.81 0.00 1.45 1.34 0.88 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 53 F 8.15 4.84 0.00 3.11 3.38 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 54 Q 7.99 3.60 0.00 2.35 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.63 0.00 55 I 8.13 4.17 1.64 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 0.83 0.59 0.88 0.00 0.00 56 N 8.97 5.69 0.00 3.05 3.20 0.00 0.00 6.31 6.84 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 57 N 8.74 5.21 0.00 2.93 3.32 0.00 0.00 6.97 7.30 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 58 K 8.70 4.35 0.00 1.99 1.88 0.00 1.69 0.00 0.00 1.84 0.00 0.00 3.09 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.49 1.42 7.81 59 I 7.50 4.87 1.22 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 -0.36 0.70 0.00 0.00 60 W 7.98 4.55 0.00 3.65 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 61 C 7.88 5.68 0.00 3.09 3.41 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 62 K 8.75 4.86 0.00 1.83 1.63 0.00 1.57 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.33 1.35 7.81 63 D 8.32 4.91 0.00 2.84 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 64 D 8.94 4.40 0.00 2.73 2.81 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 65 Q 8.37 4.16 0.00 2.08 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.24 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 66 N 9.01 5.00 0.00 2.71 2.77 0.00 0.00 7.01 7.74 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 67 P 0.00 4.50 0.00 2.24 2.19 0.00 3.47 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.00 0.00 68 H 8.21 4.63 0.00 3.10 3.36 0.00 5.93 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.62 4.19 0.00 4.24 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 70 S 8.86 3.98 0.00 3.92 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 71 N 7.98 4.12 0.00 2.96 2.78 0.00 0.00 7.07 7.76 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 72 I 7.92 3.84 1.79 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 1.19 0.54 1.02 0.00 0.00 73 C 8.59 4.45 0.00 3.39 3.32 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 74 N 8.03 4.04 0.00 2.88 2.85 0.00 0.00 6.87 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 75 I 7.85 4.25 1.95 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.75 0.79 0.00 0.00 76 S 8.21 4.53 0.00 3.78 3.56 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 77 C 8.97 3.79 0.00 2.13 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 78 D 7.37 4.06 0.00 2.62 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 79 K 7.51 4.13 0.00 1.38 1.78 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.45 7.81 80 F 7.64 5.34 0.00 3.33 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 81 L 7.99 5.49 0.00 1.81 1.78 1.17 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 82 D 7.82 4.86 0.00 2.78 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 83 D 8.54 4.60 0.00 2.69 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 84 D 8.06 4.63 0.00 2.67 2.61 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 85 L 8.35 4.63 0.00 1.74 1.73 0.92 0.77 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 86 T 8.17 3.85 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 1.19 0.00 0.00 87 D 8.05 4.42 0.00 3.00 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 88 D 8.41 4.32 0.00 3.03 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 89 I 7.91 3.30 1.85 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 1.24 0.55 0.66 0.00 0.00 90 M 7.82 3.85 0.00 2.04 2.20 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.48 0.00 91 C 8.20 4.18 0.00 3.13 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 92 V 7.25 3.25 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 0.26 0.00 0.00 -0.62 0.00 0.00 93 K 7.85 3.58 0.00 1.67 1.38 0.00 1.35 0.00 0.00 0.81 0.00 0.00 2.45 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.30 1.02 7.81 94 K 7.70 3.95 0.00 2.02 2.01 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.52 7.81 95 I 7.79 2.83 1.54 0.00 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.12 0.00 0.00 96 L 8.37 4.20 0.00 2.08 1.96 1.29 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 97 D 8.62 4.48 0.00 2.72 2.82 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 0.00 0.00 0.00 98 K 7.62 4.45 0.00 2.14 2.10 0.00 1.88 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.52 1.63 7.81 99 V 8.13 4.29 2.24 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 0.94 0.00 0.00 1.21 0.00 0.00 100 G 8.15 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 0.00 0.00 0.00 101 I 8.21 4.07 1.76 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 1.26 0.85 0.00 0.00 102 N 8.18 4.72 0.00 2.80 2.87 0.00 0.00 6.83 7.46 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 0.00 103 Y 7.82 3.79 0.00 2.56 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 0.00 0.00 0.00 104 W 8.61 4.42 0.00 3.69 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 0.00 105 L 8.25 4.04 0.00 1.68 1.70 0.88 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 106 A 8.11 4.08 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 0.00 107 H 8.31 3.88 0.00 3.16 3.39 0.00 5.59 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 0.00 108 K 7.94 3.89 0.00 1.82 1.83 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.51 7.81 109 A 7.46 4.16 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 0.00 110 L 7.94 4.68 0.00 1.73 1.56 0.88 0.59 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 0.00 111 C 8.06 5.04 0.00 2.82 2.82 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 0.00 0.00 0.00 112 S 8.20 4.65 0.00 3.92 3.76 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 0.00 113 E 8.05 4.49 0.00 2.04 1.89 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 2.19 2.34 0.00 114 K 8.98 3.61 0.00 1.99 1.92 0.00 1.44 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.36 1.56 7.81 115 L 8.25 5.19 0.00 1.81 1.79 1.05 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.21 4.54 0.00 2.74 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 0.00 117 Q 7.62 3.90 0.00 1.43 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 7.51 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 118 W 7.79 4.85 0.00 3.45 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 0.00 119 L 7.77 4.59 0.00 1.56 1.53 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 120 C 7.67 4.42 0.00 1.23 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 0.00 0.00 0.00 0.00 121 E 8.41 3.63 0.00 2.07 2.20 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 2.18 1.88 0.00 122 K 8.25 4.27 0.00 1.88 1.67 0.00 1.81 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.29 1.24 7.81