NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.4192 8.1927 115.2904 58.5148 64.9570 175.5453 4 S 4.3219 7.6610 115.4419 60.2434 62.3022 175.1462 5 I 3.7117 8.4376 123.5489 64.4613 37.3652 177.9122 6 R 3.8951 7.9660 118.3929 59.3317 29.3934 178.8466 7 E 4.0059 8.7600 118.7633 59.3768 29.4601 179.0331 8 E 4.0164 8.0986 119.2304 58.9141 29.6513 179.0269 9 V 3.5405 8.0073 118.8325 66.4367 31.7607 177.8443 10 H 4.2560 8.3954 116.1940 58.8620 28.4046 178.0587 11 R 3.9653 8.2435 120.0731 59.3560 29.8793 178.5829 12 H 4.1028 8.3490 118.0209 59.3595 29.7069 177.3035 13 L 4.1173 7.9625 119.5991 57.7600 41.1598 179.4343 14 G 3.7552 8.0844 105.2923 47.6928 0.0000 176.1486 15 T 3.9226 8.1381 118.3856 66.5477 68.5049 177.1360 16 V 3.6791 7.8492 113.5878 63.7073 31.5451 178.3278 17 A 4.0490 7.6800 120.0694 54.9170 17.9182 179.5436 18 L 4.0242 7.8958 116.8864 57.4655 41.7176 178.4721 19 M 4.4662 7.5008 116.1464 53.6576 32.4042 175.8423 20 Q 3.9113 7.2811 121.0928 55.8130 29.4584 174.9271 21 P 4.3738 0.0000 0.0000 63.0414 32.0337 175.2524 22 A 4.3946 7.9928 121.7588 51.6535 21.6714 176.4930 23 L 4.2938 8.3191 120.3010 53.7173 41.0972 176.4902 24 H 4.4257 8.5540 124.7078 54.6665 29.1780 174.5430 25 Q 4.3810 8.1502 129.1707 54.0792 28.6537 175.1596 26 Q 4.0861 8.4936 125.0879 55.8357 29.4602 176.0529 27 T 4.5495 8.2494 111.7928 60.3877 70.5191 174.4462 28 H 4.6225 8.4146 123.5611 54.7161 29.3176 173.0486 29 A 3.6900 8.0837 127.7786 52.2594 16.0194 175.6689 30 P 4.3913 0.0000 0.0000 61.7213 32.8985 177.1259 31 A 4.2154 8.2777 122.1380 51.4138 19.2374 176.8592 32 P 4.4478 0.0000 0.0000 65.9881 31.4710 178.7905 33 T 4.1027 7.8832 105.9535 63.3677 68.8189 174.5066 34 E 4.3427 8.4716 121.1560 56.4159 30.0712 175.6978 35 I 4.3534 7.4634 121.3047 59.9272 37.8313 176.3472 36 T 4.4209 8.2167 116.6804 60.8093 71.4337 174.9446 37 H 4.1849 8.6737 119.9939 59.7357 29.7934 177.1321 38 T 3.8108 7.9259 117.0420 66.7330 68.3489 176.4454 39 L 3.9548 7.9742 120.6745 57.4588 41.6402 179.2343 40 F 4.0814 8.5541 121.0854 61.4028 39.1411 177.2300 41 R 3.9474 8.1764 117.0196 59.3046 30.1933 178.0386 42 A 4.0356 7.9378 120.7067 55.3240 18.1274 179.2949 43 Y 4.2391 8.1298 115.0029 60.7968 38.0202 177.5417 44 T 4.2744 7.4757 108.1281 60.5229 69.3698 174.9299 45 R 3.8997 6.7461 117.2436 56.6700 30.0678 176.2115 46 V 4.0019 7.9899 118.0007 60.7332 31.6742 174.3669 47 P 4.0405 0.0000 0.0000 65.9679 31.1859 177.4494 48 H 4.3822 6.9872 111.2346 56.7613 28.8659 175.8219 49 D 4.5496 7.8207 121.3861 53.2438 39.2876 175.7335 50 V 4.7539 7.1121 113.1856 59.5200 33.2187 176.3465 51 G 3.8743 7.9562 109.7449 47.3093 0.0000 173.7121 52 G 4.0173 8.9318 112.7314 45.1929 0.0000 173.7483 53 E 4.0328 8.0168 120.0128 55.8692 30.0055 176.3337 54 A 4.2974 8.3882 126.4160 52.3721 19.0412 176.0630 55 D 4.6795 8.2032 120.1942 53.1118 44.5761 174.5078 56 V 4.2045 7.9074 115.4381 59.1746 33.3131 174.0438 57 P 4.5271 0.0000 0.0000 62.0059 31.9857 176.1619 58 I 4.3969 7.3284 114.2743 58.6656 40.4847 175.0762 59 E 3.9680 8.4278 123.1467 55.4117 28.5643 175.8408 60 Y 4.3181 8.0706 124.3700 58.4676 38.4951 175.9116 61 H 5.0662 8.4022 118.3668 53.6856 31.6792 172.8669 62 E 4.4933 8.4694 119.5379 55.1394 30.9320 175.7634 63 K 4.5781 8.0340 120.7446 54.1495 35.2185 175.7097 64 E 3.9810 8.6814 126.7295 55.9988 30.2215 175.6894 65 E 4.1761 8.4558 126.8037 55.7658 30.6850 176.6421 66 E 4.2321 9.1669 126.2306 55.7126 31.7231 178.0782 67 I 3.7213 8.3365 123.1786 64.3851 37.3197 178.8724 68 W 5.0593 8.2644 118.2238 58.9465 27.9359 178.2298 69 E 2.8396 6.9263 119.3379 58.6794 28.8335 178.6596 70 L 3.8125 7.3879 120.2227 58.2173 42.0514 178.8200 71 N 4.4400 8.2497 116.4505 56.5108 38.3630 177.6331 72 T 4.0423 8.0298 117.3639 66.4855 68.5913 176.4896 73 F 4.2571 8.1784 122.4187 61.3055 39.3443 176.9583 74 A 3.9176 8.2169 120.3167 55.4964 18.1119 179.6659 75 T 3.8930 8.2935 114.4381 67.1658 68.4323 176.6832 76 C 4.6253 8.6293 118.7529 63.1042 28.2411 176.0758 77 E 4.1261 8.4193 120.1987 59.4055 28.9263 179.1411 78 C 4.6701 8.6627 117.4198 62.8711 28.1317 176.0545 79 L 3.9092 8.5060 120.7350 57.5662 41.1269 179.5081 80 A 5.1944 8.2924 122.2114 54.4816 18.2562 179.1910 81 W 4.4781 8.6338 126.1722 60.7863 30.7326 177.4432 82 R 4.2823 8.0632 115.3802 55.7658 29.7042 177.4609 83 G 3.9941 8.0901 106.2808 45.7275 0.0000 175.4894 84 V 3.6479 7.9927 120.8524 65.2243 31.8139 175.5119 85 W 5.0203 7.9231 114.7184 55.0654 30.6087 172.8658 86 T 4.8199 8.7123 109.6042 59.8651 71.5695 175.3307 87 A 3.5919 8.2440 123.1799 55.3667 18.3291 179.8780 88 E 3.7823 7.9585 116.4753 59.5413 29.5875 179.2305 89 E 3.9418 7.7458 117.7725 59.1804 29.4006 179.4029 90 R 3.1395 7.0589 118.2295 59.1158 29.9737 178.6694 91 R 3.6337 7.7146 118.0501 59.2102 29.9940 178.9577 92 R 3.7562 7.8494 118.2278 59.4876 29.7632 178.7628 93 K 4.2315 7.9923 119.5342 58.7438 31.5564 179.1901 94 Q 4.2974 8.7363 121.7570 57.7030 27.8115 176.7187 95 N 5.0606 8.5342 115.3224 53.2660 39.2646 175.3113 96 C 4.1729 7.4874 116.0985 61.3782 30.7445 176.0522 97 D 4.4193 8.2393 119.1774 57.2770 40.5070 179.2884 98 V 3.7136 7.1016 111.4954 62.4414 31.8964 177.4814 99 G 4.1326 8.1245 104.9873 45.7751 0.0000 174.0838 100 Q 4.0376 8.8147 120.6272 59.6495 28.8169 179.3203 101 T 3.9433 7.9229 115.7170 66.9103 68.7607 176.7328 102 V 3.6341 7.8185 119.5122 66.0514 31.4852 177.0271 103 Y 4.2078 8.3811 119.5280 60.0512 38.3661 177.3758 104 L 4.5751 7.7097 116.4402 54.6302 43.4129 178.1466 105 G 3.8484 8.2911 105.0193 45.3728 0.0000 173.7821 106 M 4.6176 7.1238 119.1373 52.8700 34.2833 174.0383 107 P 4.5702 0.0000 0.0000 62.2713 32.2798 176.3157 108 Y 4.1764 8.6007 120.2566 62.3484 38.5236 178.4014 109 Y 4.3428 8.2286 116.6876 60.1180 38.1566 178.5115 110 G 3.9551 8.5531 107.7631 47.9380 0.0000 176.1521 111 R 4.1228 8.2460 120.0383 58.6757 30.0876 179.0697 112 W 4.4904 8.4378 119.7741 59.1471 29.1993 178.0973 113 L 4.2077 8.5655 120.0845 58.3801 41.6460 178.7915 114 L 4.0811 8.2374 118.9472 58.4711 41.6807 179.8449 115 T 4.0819 8.4036 115.1577 66.2794 67.9794 176.8760 116 A 4.0273 8.3400 122.9772 55.0405 18.1468 179.5438 117 A 4.0194 8.2343 119.4171 55.0982 18.4227 179.8570 118 R 3.8523 8.1254 117.3731 59.6682 30.2581 178.5823 119 I 3.7493 7.8979 118.4735 64.0233 37.7565 177.7724 120 L 4.1056 7.4803 118.6781 57.6867 41.4268 179.7145 121 V 3.8476 7.4114 119.1572 65.5025 31.3794 177.9308 122 D 4.4116 8.3861 117.6966 56.6067 40.6277 177.9055 123 K 4.1892 7.5951 116.3779 54.9246 32.4055 176.2518 124 Q 3.3949 7.5635 116.6588 56.9673 26.7397 175.1240 125 F 4.5353 7.9917 117.5620 59.4955 39.1865 176.6506 126 V 4.6906 7.3348 112.6302 58.9077 35.7308 174.3684 127 T 4.2780 9.0238 113.8494 60.7716 71.4518 175.9142 128 L 3.9010 8.2758 123.0767 58.5140 41.9911 179.3646 129 T 3.8801 7.7867 115.4264 66.5965 68.3674 176.2129 130 E 3.9644 8.2038 120.5148 59.1389 29.4675 179.1823 131 L 3.9247 7.7681 120.2916 58.5263 42.2825 178.6722 132 H 4.2588 8.6012 116.4698 59.1862 28.6512 177.6273 133 N 4.3972 8.5998 118.5729 56.0379 38.2486 177.4712 134 K 3.9631 8.2410 121.3654 59.5161 32.2910 178.9701 135 I 3.6854 7.9230 120.1795 64.3010 36.9603 178.5329 136 V 3.5632 7.7471 119.0036 65.8671 31.2998 177.6015 137 E 3.9155 8.2322 119.0377 59.6876 29.5183 178.7383 138 M 4.0690 8.2249 118.6948 58.5061 31.9198 179.0155 139 R 3.9268 8.0037 118.1945 59.3646 30.2581 179.0446 140 E 3.9643 8.4239 118.4856 59.1652 29.4158 179.2937 141 R 3.9198 8.1918 119.0834 59.2871 30.1017 178.8520 142 V 3.5463 7.8027 117.6772 66.0915 31.4311 177.8590 143 A 4.0396 8.0514 119.6184 54.9984 18.3029 178.9151 144 S 4.4160 8.4734 110.3255 58.4320 63.4031 174.9046 145 G 3.8681 7.8661 110.3972 46.9208 0.0000 174.3709 146 Q 4.1743 8.2435 116.5025 54.9799 28.9057 176.9101 147 G 4.0040 8.1092 105.4555 45.2967 0.0000 173.6900 148 L 4.5643 8.6232 120.2406 53.3948 43.6439 177.0256 149 G 3.6741 8.3733 119.5669 46.7756 0.0000 172.2593 150 E 4.2278 8.2541 120.7964 56.7500 30.4447 177.1664 151 Y 4.4039 7.7628 118.9577 60.3830 38.6057 175.4582 152 L 4.7122 7.6397 121.8875 52.7594 44.6951 173.1592 153 P 4.6762 0.0000 0.0000 61.5458 32.2397 174.4926 154 P 4.5729 0.0000 0.0000 63.2911 31.1565 176.1306 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 3 S 8.19 4.42 0.00 3.87 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 4 S 7.66 4.32 0.00 4.01 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 5 I 8.44 3.71 1.86 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 1.63 0.82 0.89 0.00 0.00 6 R 7.97 3.90 0.00 1.98 2.02 0.00 3.27 0.00 0.00 3.33 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.68 0.00 7 E 8.76 4.01 0.00 2.11 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 0.00 2.35 2.65 0.00 8 E 8.10 4.02 0.00 2.16 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 2.30 2.32 0.00 9 V 8.01 3.54 2.13 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 0.85 0.00 0.00 0.93 0.00 0.00 10 H 8.40 4.26 0.00 3.21 3.33 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 R 8.24 3.97 0.00 2.03 1.99 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 12 H 8.35 4.10 0.00 3.29 3.50 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 13 L 7.96 4.12 0.00 1.84 1.74 0.94 0.85 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 14 G 8.08 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 0.00 0.00 0.00 15 T 8.14 3.92 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 1.19 0.00 0.00 16 V 7.85 3.68 2.03 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 0.56 0.00 0.00 0.96 0.00 0.00 17 A 7.68 4.05 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 18 L 7.90 4.02 0.00 1.70 1.74 0.91 0.67 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 19 M 7.50 4.47 0.00 1.99 2.17 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 2.56 2.51 0.00 20 Q 7.28 3.91 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.88 6.88 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 21 P 0.00 4.37 0.00 2.08 1.97 0.00 3.77 0.00 0.00 3.80 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 22 A 7.99 4.39 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 23 L 8.32 4.29 0.00 1.65 1.67 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 24 H 8.55 4.43 0.00 3.11 3.25 0.00 5.71 0.00 0.00 0.00 0.00 6.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Q 8.15 4.38 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.72 0.00 0.00 0.00 0.00 0.00 2.27 2.37 0.00 26 Q 8.49 4.09 0.00 2.13 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.49 0.00 0.00 0.00 0.00 0.00 2.44 2.43 0.00 27 T 8.25 4.55 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 1.27 0.00 0.00 28 H 8.41 4.62 0.00 3.13 3.24 0.00 5.85 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.08 3.69 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 30 P 0.00 4.39 0.00 2.20 2.08 0.00 3.70 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.95 0.00 31 A 8.28 4.22 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 32 P 0.00 4.45 0.00 2.20 2.16 0.00 3.61 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 33 T 7.88 4.10 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 1.22 0.00 0.00 34 E 8.47 4.34 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 2.30 2.43 0.00 35 I 7.46 4.35 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.88 1.15 0.00 0.00 36 T 8.22 4.42 4.29 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 1.25 0.00 0.00 37 H 8.67 4.18 0.00 3.27 3.39 0.00 5.87 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.93 3.81 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 1.19 0.00 0.00 39 L 7.97 3.95 0.00 2.01 1.92 1.06 0.80 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 40 F 8.55 4.08 0.00 3.31 3.25 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 41 R 8.18 3.95 0.00 1.80 2.04 0.00 3.35 0.00 0.00 3.23 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 42 A 7.94 4.04 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 Y 8.13 4.24 0.00 2.87 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 44 T 7.48 4.27 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 0.54 0.00 0.00 45 R 6.75 3.90 0.00 1.95 2.16 0.00 3.09 0.00 0.00 3.11 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.52 0.00 46 V 7.99 4.00 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 0.79 0.00 0.00 0.90 0.00 0.00 47 P 0.00 4.04 0.00 1.65 1.81 0.00 3.51 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 2.07 2.00 0.00 48 H 6.99 4.38 0.00 3.35 3.37 0.00 5.57 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 49 D 7.82 4.55 0.00 2.66 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 50 V 7.11 4.75 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 1.22 0.00 0.00 1.00 0.00 0.00 51 G 7.96 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 0.00 0.00 0.00 52 G 8.93 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 0.00 0.00 0.00 53 E 8.02 4.03 0.00 2.20 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 2.33 0.00 54 A 8.39 4.30 1.24 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 0.00 0.00 55 D 8.20 4.68 0.00 2.61 2.52 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 56 V 7.91 4.20 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 0.77 0.00 0.00 0.90 0.00 0.00 57 P 0.00 4.53 0.00 1.97 1.90 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.04 0.00 58 I 7.33 4.40 1.73 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.77 0.82 0.00 0.00 59 E 8.43 3.97 0.00 1.88 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 2.28 2.30 0.00 60 Y 8.07 4.32 0.00 3.02 2.77 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 61 H 8.40 5.07 0.00 3.22 3.25 0.00 5.51 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 62 E 8.47 4.49 0.00 1.97 1.88 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 2.26 2.21 0.00 63 K 8.03 4.58 0.00 1.69 1.59 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.29 1.40 7.81 64 E 8.68 3.98 0.00 1.95 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 2.27 2.27 0.00 65 E 8.46 4.18 0.00 1.85 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 2.08 2.06 0.00 66 E 9.17 4.23 0.00 1.16 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.35 0.00 67 I 8.34 3.72 2.16 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 1.71 0.81 0.90 0.00 0.00 68 W 8.26 5.06 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 69 E 6.93 2.84 0.00 1.45 1.12 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 1.47 1.47 0.00 70 L 7.39 3.81 0.00 1.80 1.72 0.96 0.66 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 71 N 8.25 4.44 0.00 3.10 2.98 0.00 0.00 7.05 6.77 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 72 T 8.03 4.04 4.31 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 1.64 0.00 0.00 73 F 8.18 4.26 0.00 2.82 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 74 A 8.22 3.92 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 75 T 8.29 3.89 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 76 C 8.63 4.63 0.00 3.60 3.39 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.42 4.13 0.00 1.80 1.93 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 1.92 1.91 0.00 78 C 8.66 4.67 0.00 3.26 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 79 L 8.51 3.91 0.00 2.05 1.34 0.67 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.29 5.19 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 81 W 8.63 4.48 0.00 3.26 3.50 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 82 R 8.06 4.28 0.00 1.67 1.68 0.00 2.96 0.00 0.00 2.32 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.32 0.00 83 G 8.09 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 84 V 7.99 3.65 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 0.49 0.00 0.00 0.45 0.00 0.00 85 W 7.92 5.02 0.00 3.65 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 T 8.71 4.82 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 1.26 0.00 0.00 87 A 8.24 3.59 1.21 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 0.00 0.00 88 E 7.96 3.78 0.00 1.93 1.95 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 2.34 2.31 0.00 89 E 7.75 3.94 0.00 2.22 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 2.33 0.00 90 R 7.06 3.14 0.00 0.67 1.25 0.00 2.68 0.00 0.00 2.44 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.87 0.00 91 R 7.71 3.63 0.00 1.87 1.86 0.00 3.32 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.62 0.00 92 R 7.85 3.76 0.00 1.78 2.01 0.00 3.30 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.78 0.00 93 K 7.99 4.23 0.00 1.94 1.93 0.00 1.90 0.00 0.00 2.02 0.00 0.00 3.07 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.52 7.81 94 Q 8.74 4.30 0.00 1.93 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.67 0.00 0.00 0.00 0.00 0.00 2.16 2.27 0.00 95 N 8.53 5.06 0.00 2.76 2.90 0.00 0.00 6.78 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 96 C 7.49 4.17 0.00 3.00 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 97 D 8.24 4.42 0.00 2.92 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 98 V 7.10 3.71 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 0.82 0.00 0.00 1.11 0.00 0.00 99 G 8.12 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 0.00 100 Q 8.81 4.04 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.85 0.00 0.00 0.00 0.00 0.00 2.47 2.60 0.00 101 T 7.92 3.94 4.29 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 1.25 0.00 0.00 102 V 7.82 3.63 2.35 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 1.11 0.00 0.00 0.98 0.00 0.00 103 Y 8.38 4.21 0.00 3.28 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 0.00 104 L 7.71 4.58 0.00 1.68 1.68 1.08 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.29 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 0.00 106 M 7.12 4.62 0.00 2.14 2.22 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.68 0.00 107 P 0.00 4.57 0.00 2.47 2.15 0.00 3.78 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.19 0.00 108 Y 8.60 4.18 0.00 2.96 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 0.00 109 Y 8.23 4.34 0.00 2.93 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.55 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 0.00 0.00 0.00 111 R 8.25 4.12 0.00 2.16 2.08 0.00 3.28 0.00 0.00 3.37 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.97 0.00 112 W 8.44 4.49 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 0.00 113 L 8.57 4.21 0.00 2.17 2.06 1.07 0.35 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 0.00 114 L 8.24 4.08 0.00 1.99 1.79 0.99 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 115 T 8.40 4.08 4.59 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 1.47 0.00 0.00 116 A 8.34 4.03 1.57 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 0.00 0.00 117 A 8.23 4.02 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 0.00 118 R 8.13 3.85 0.00 2.14 2.21 0.00 3.18 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.94 0.00 119 I 7.90 3.75 1.43 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.87 0.16 0.00 0.00 120 L 7.48 4.11 0.00 1.91 1.73 0.89 0.65 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 0.00 121 V 7.41 3.85 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 1.20 0.00 0.00 0.97 0.00 0.00 122 D 8.39 4.41 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 0.00 123 K 7.60 4.19 0.00 1.74 1.21 0.00 2.09 0.00 0.00 1.82 0.00 0.00 3.08 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.45 7.81 124 Q 7.56 3.39 0.00 1.96 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.46 7.01 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 125 F 7.99 4.54 0.00 3.13 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 0.00 126 V 7.33 4.69 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 0.96 0.00 0.00 0.93 0.00 0.00 127 T 9.02 4.28 4.21 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 1.19 0.00 0.00 128 L 8.28 3.90 0.00 1.70 1.61 0.83 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 129 T 7.79 3.88 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 1.21 0.00 0.00 130 E 8.20 3.96 0.00 2.19 1.99 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 2.33 2.31 0.00 131 L 7.77 3.92 0.00 1.77 1.80 0.93 1.09 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 0.00 132 H 8.60 4.26 0.00 3.30 3.31 0.00 5.69 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 0.00 133 N 8.60 4.40 0.00 2.84 2.87 0.00 0.00 6.70 7.33 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 0.00 134 K 8.24 3.96 0.00 1.95 2.02 0.00 1.54 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.53 7.81 135 I 7.92 3.69 2.02 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 1.40 0.54 0.89 0.00 0.00 136 V 7.75 3.56 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 1.02 0.00 0.00 0.95 0.00 0.00 137 E 8.23 3.92 0.00 2.21 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 2.31 2.36 0.00 138 M 8.22 4.07 0.00 2.07 2.20 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.96 0.00 139 R 8.00 3.93 0.00 2.03 1.96 0.00 3.11 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 1.62 1.80 0.00 140 E 8.42 3.96 0.00 2.12 2.00 0.00 0.00 0.00 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 2.56 0.00 141 R 8.19 3.92 0.00 2.03 2.13 0.00 3.12 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.65 0.00 142 V 7.80 3.55 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 0.96 0.00 0.00 0.96 0.00 0.00 143 A 8.05 4.04 1.30 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 0.00 144 S 8.47 4.42 0.00 3.99 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 0.00 145 G 7.87 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 0.00 0.00 0.00 146 Q 8.24 4.17 0.00 2.20 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.69 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 147 G 8.11 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.62 4.56 0.00 1.68 1.64 0.98 1.22 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 0.00 149 G 8.37 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 0.00 150 E 8.25 4.23 0.00 1.93 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 1.59 1.80 0.00 151 Y 7.76 4.40 0.00 3.24 3.02 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 0.00 152 L 7.64 4.71 0.00 1.74 1.61 0.95 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 153 P 0.00 4.68 0.00 2.22 2.04 0.00 3.85 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 2.00 1.96 0.00 154 P 0.00 4.57 0.00 2.20 2.21 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00