NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 L 4.3155 8.1849 120.5757 54.6862 43.7540 175.1741 4 T 4.3777 7.9936 116.3271 61.8289 69.6228 173.3194 5 S 5.2165 10.1569 123.0624 57.7001 65.7554 172.9388 6 L 5.8896 8.7045 120.6264 52.1820 46.1829 175.3707 7 I 4.9375 8.3078 121.7541 59.5556 41.0132 174.3841 8 I 4.8745 8.3356 125.3936 59.4124 40.2662 174.2530 9 A 5.1683 9.2475 129.3478 50.0773 21.6810 174.5577 10 E 4.6520 9.1297 123.4796 54.8867 32.9255 175.9284 11 D 4.2354 9.0069 126.8054 56.6145 41.7437 176.6436 12 Q 4.3855 8.8072 121.1836 54.5278 30.3408 175.5599 13 N 4.2534 8.7007 125.3408 56.6835 38.7583 176.6679 14 M 3.9453 8.0280 118.8741 58.8655 32.2818 177.9245 15 L 3.9339 7.7694 120.3390 57.8263 42.2265 178.7473 16 R 3.7930 8.2086 119.0066 59.7076 30.0816 178.5564 17 Q 3.9743 8.3467 117.7707 58.8381 28.5883 178.7721 18 A 3.9846 7.9802 121.8579 55.4214 18.3351 179.6531 19 M 3.9714 8.4887 117.6506 58.3223 31.7319 178.9866 20 V 3.5301 7.8236 118.4209 66.2747 31.2073 178.2196 21 Q 3.8940 8.0286 117.5481 58.9491 28.5323 178.5847 22 L 4.0820 8.3346 120.3901 57.5537 41.5613 179.2936 23 I 3.6942 7.9782 120.0411 64.5547 36.8139 178.5905 24 K 4.2375 7.4798 117.6781 59.4251 31.9047 179.0372 25 L 4.2018 7.4571 117.8699 57.4517 41.7650 178.3034 26 H 4.7434 8.5384 114.5047 57.1916 29.2668 174.6385 27 G 4.2051 7.7878 106.5736 45.3841 0.0000 173.3125 28 D 4.6325 7.3039 117.7467 52.5801 39.2954 175.5568 29 F 5.4969 7.9684 118.1814 55.2630 43.6860 174.0660 30 E 4.7372 9.3000 120.0541 54.6374 32.2147 174.8716 31 I 4.5775 8.3224 124.6143 60.4140 37.3399 175.7165 32 L 4.0422 8.9634 128.7336 57.2417 42.4584 177.2769 33 A 4.4905 7.3882 117.1116 51.2525 22.1655 174.9660 34 D 5.2017 8.4253 118.0951 52.6417 42.8650 174.0638 35 T 4.5047 8.6273 113.0559 61.6964 71.3860 173.2232 36 D 5.4362 8.6700 122.0171 52.1830 40.0965 175.8757 37 N 5.1600 8.1374 118.9730 51.6331 41.9587 175.2389 38 G 4.2217 8.7869 116.2249 47.0709 0.0000 175.6575 39 L 3.9465 7.9946 122.2215 57.9936 42.1558 177.9993 40 D 4.2980 8.4215 117.8066 57.5263 41.0899 178.0048 41 A 3.9955 8.3106 121.3316 55.6797 18.3498 179.1978 42 M 3.9819 8.1635 116.3551 58.7282 32.1675 178.6312 43 K 3.9608 8.0687 118.5046 59.4223 32.3028 179.1859 44 L 4.1156 8.2126 119.5236 58.0055 41.5412 179.5486 45 I 3.7561 8.3955 119.8163 64.7246 36.8814 178.3957 46 E 3.9665 7.9874 117.8068 59.1526 29.3206 178.7438 47 E 3.9128 8.2719 118.7737 59.2840 29.8644 177.8644 48 Y 4.4340 8.3911 113.8777 56.9544 39.9975 175.4133 49 N 4.1792 8.2070 116.1644 53.6557 36.4247 171.9051 50 P 4.6019 0.0000 0.0000 62.2839 33.0840 177.1301 51 N 4.5998 8.7353 117.0315 56.0664 39.6553 175.5421 52 V 4.9892 8.0771 116.7469 61.2557 35.6674 174.6720 53 V 5.0137 9.0834 119.2379 59.6050 35.8335 174.4332 54 I 4.9117 8.4879 124.3211 59.5656 39.7985 174.6504 55 L 5.0910 8.8016 126.7275 52.7608 45.3326 176.0774 56 D 4.8991 8.8511 123.7557 53.9773 42.3980 176.1895 57 I 3.8986 8.1558 122.3244 63.2879 37.7906 175.8250 58 E 4.5736 7.7372 131.2050 55.4979 29.0221 175.5244 59 M 4.8936 8.0959 124.7962 52.4648 36.4274 173.7522 60 P 4.3638 0.0000 0.0000 63.7176 31.7915 175.4880 61 G 4.1393 9.2532 112.0519 45.2770 0.0000 173.1932 62 M 4.9447 7.2338 116.7111 51.8909 36.5952 175.3675 63 T 4.6507 9.1626 114.3927 61.2513 71.2151 176.0479 64 G 4.1296 8.6635 110.1963 47.4290 0.0000 176.1689 65 L 4.1261 7.9263 120.7224 57.7452 41.7658 179.1493 66 E 3.9727 8.3938 118.6234 59.2605 29.3324 179.6191 67 V 3.5456 7.9482 118.2764 65.8415 31.6552 177.6286 68 L 3.9147 8.4409 120.1948 58.3384 41.8218 178.7197 69 A 4.0000 8.2587 120.7654 55.3012 18.3047 179.2726 70 E 3.8795 8.1761 117.7395 59.3488 29.7190 178.9320 71 I 3.7213 7.9526 120.0194 64.4533 37.0611 178.6759 72 R 3.8936 8.0603 118.8209 59.0903 29.7718 178.8693 73 K 3.7881 8.0096 117.4424 59.2791 32.1813 178.4721 74 K 4.2947 7.7725 115.0575 55.5305 32.5266 176.1798 75 H 4.1023 8.0064 115.5402 56.5639 26.8878 175.1518 76 L 4.1911 7.6618 118.1445 54.7873 42.4192 178.2419 77 N 4.7259 8.4187 122.0259 52.5299 37.2050 173.4699 78 I 4.8496 7.2036 118.9382 59.2907 41.7421 175.7258 79 K 4.5194 9.2196 127.4243 56.1879 33.6845 176.1983 80 V 4.8165 9.6652 123.9960 61.1747 34.6614 174.0145 81 I 4.9821 8.8823 129.0321 59.6015 39.9015 174.7672 82 I 4.5815 8.4565 128.4619 60.5139 38.9835 175.2589 83 V 4.6116 8.6588 126.0004 61.4912 34.3430 174.0501 84 T 4.6612 8.3768 121.8753 60.5548 70.7308 174.7071 85 T 3.8568 8.0747 115.1919 63.5914 69.3505 174.7901 86 F 4.6960 7.4416 122.0025 57.5044 38.7512 175.4969 87 K 4.2757 8.9217 125.8533 58.1292 32.4832 177.7691 88 R 3.9231 8.2898 117.6186 55.9343 30.6793 175.1975 89 P 4.4391 0.0000 0.0000 66.0896 31.0623 178.7070 90 G 3.5628 8.0986 104.8253 47.9572 0.0000 175.1000 91 Y 4.2542 7.7931 118.8717 60.7375 37.9600 178.1503 92 F 3.4913 8.2577 121.2336 61.0600 39.5254 176.9376 93 E 3.6950 8.0920 118.0295 59.2256 29.0722 179.5089 94 K 3.9411 8.1217 118.4029 59.2355 32.0521 179.3212 95 A 4.0369 7.9926 121.2527 54.9973 18.2435 179.9548 96 V 3.3047 7.4221 116.9712 66.0716 31.4156 178.6984 97 V 3.6288 7.5379 117.4572 64.4878 31.0560 176.9132 98 N 4.6660 7.5772 115.0435 52.0782 38.9805 174.2867 99 D 4.3661 8.3356 118.8070 55.0036 40.0327 174.5296 100 V 3.8626 7.5432 116.9024 61.8413 32.2624 175.9750 101 D 4.6962 8.7717 122.2419 57.0923 41.5552 176.6840 102 A 4.8034 7.8698 117.7649 50.6305 23.0296 174.5770 103 Y 4.9957 8.8369 121.4019 55.9014 41.2223 174.8892 104 V 4.4209 8.7060 127.3755 60.9146 34.4078 174.8143 105 L 4.6851 8.4098 127.4815 54.3196 42.9518 177.6117 106 K 4.2661 8.6001 120.2912 57.4382 31.6202 178.2805 107 E 4.0313 8.2700 120.6242 58.5935 29.6916 177.3959 108 R 4.4978 7.6228 117.6768 55.0157 31.4449 176.9076 109 S 4.4871 8.7762 116.3819 57.7053 65.5220 175.5619 110 I 3.6171 8.0941 122.4596 64.3153 36.7536 178.3183 111 E 3.7905 8.0401 119.0092 59.6803 29.2526 179.2111 112 E 3.9678 8.1502 118.2666 59.2037 29.3908 179.1765 113 L 3.8774 8.0855 120.5552 58.0645 42.0557 179.1566 114 V 3.5353 8.3311 118.4221 66.1021 31.4002 177.6222 115 E 3.9997 8.2693 118.2153 59.9386 29.2460 179.6176 116 T 3.8832 8.2208 115.7698 66.6471 68.5312 176.7198 117 I 3.7134 8.0459 121.9630 64.4980 36.9232 178.1294 118 N 4.4213 8.3244 116.1347 56.3714 38.5779 177.2703 119 K 4.1321 8.3810 120.0150 59.4948 31.9548 179.5554 120 V 3.6347 7.8952 117.5148 65.9772 31.6248 176.9942 121 N 4.5875 8.6293 113.8794 54.7526 38.9967 174.9310 122 N 4.6765 7.7767 122.2244 54.1735 39.0013 174.4362 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 L 8.18 4.32 0.00 1.52 1.78 0.91 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.99 4.38 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 1.44 0.00 0.00 5 S 10.16 5.22 0.00 3.90 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 6 L 8.70 5.89 0.00 1.59 1.47 0.88 0.27 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 7 I 8.31 4.94 1.87 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.69 0.95 0.00 0.00 8 I 8.34 4.87 1.81 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 1.07 0.99 0.84 0.00 0.00 9 A 9.25 5.17 1.17 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 0.00 0.00 10 E 9.13 4.65 0.00 1.96 1.67 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 2.13 2.44 0.00 11 D 9.01 4.24 0.00 2.72 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 12 Q 8.81 4.39 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.56 0.00 0.00 0.00 0.00 0.00 2.27 2.36 0.00 13 N 8.70 4.25 0.00 2.75 2.84 0.00 0.00 6.74 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 14 M 8.03 3.95 0.00 2.06 2.05 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 2.66 2.59 0.00 15 L 7.77 3.93 0.00 1.84 1.61 0.87 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 16 R 8.21 3.79 0.00 1.96 1.98 0.00 3.20 0.00 0.00 3.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 17 Q 8.35 3.97 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 18 A 7.98 3.98 1.38 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 0.00 0.00 19 M 8.49 3.97 0.00 1.95 2.18 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.48 0.00 20 V 7.82 3.53 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 1.00 0.00 0.00 0.93 0.00 0.00 21 Q 8.03 3.89 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.61 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 22 L 8.33 4.08 0.00 1.77 1.80 0.93 0.66 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 23 I 7.98 3.69 1.92 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.10 0.51 0.00 0.00 24 K 7.48 4.24 0.00 1.95 1.91 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.26 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.74 1.52 7.81 25 L 7.46 4.20 0.00 1.70 1.65 0.89 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 26 H 8.54 4.74 0.00 3.29 3.40 0.00 5.69 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 7.79 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 0.00 0.00 0.00 0.00 28 D 7.30 4.63 0.00 2.22 2.39 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 29 F 7.97 5.50 0.00 2.88 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 9.30 4.74 0.00 1.98 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 2.20 2.25 0.00 31 I 8.32 4.58 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.82 0.85 0.00 0.00 32 L 8.96 4.04 0.00 1.38 1.09 0.85 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 33 A 7.39 4.49 1.05 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 0.00 0.00 34 D 8.43 5.20 0.00 2.66 2.54 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 0.00 0.00 0.00 0.00 35 T 8.63 4.50 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 1.28 0.00 0.00 36 D 8.67 5.44 0.00 2.79 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 37 N 8.14 5.16 0.00 2.74 2.66 0.00 0.00 7.08 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 8.79 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 39 L 7.99 3.95 0.00 1.78 1.89 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 40 D 8.42 4.30 0.00 2.85 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 41 A 8.31 4.00 1.39 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 0.00 0.00 42 M 8.16 3.98 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.81 0.00 43 K 8.07 3.96 0.00 1.99 1.84 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.65 1.63 7.81 44 L 8.21 4.12 0.00 1.91 1.91 1.06 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.40 3.76 2.09 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 1.55 0.74 0.94 0.00 0.00 46 E 7.99 3.97 0.00 1.95 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 2.35 2.44 0.00 47 E 8.27 3.91 0.00 1.85 1.87 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 1.66 2.06 0.00 48 Y 8.39 4.43 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 49 N 8.21 4.18 0.00 2.81 2.83 0.00 0.00 6.99 7.78 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 50 P 0.00 4.60 0.00 2.38 2.07 0.00 3.82 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 2.01 2.01 0.00 51 N 8.74 4.60 0.00 2.93 2.95 0.00 0.00 6.72 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 52 V 8.08 4.99 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 0.94 0.00 0.00 1.00 0.00 0.00 53 V 9.08 5.01 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 0.67 0.00 0.00 0.99 0.00 0.00 54 I 8.49 4.91 1.78 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.59 0.81 0.00 0.00 55 L 8.80 5.09 0.00 1.53 1.48 0.91 0.88 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 56 D 8.85 4.90 0.00 2.86 2.43 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 0.00 57 I 8.16 3.90 1.62 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.39 1.11 0.00 0.00 58 E 7.74 4.57 0.00 2.18 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 2.36 2.46 0.00 59 M 8.10 4.89 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 60 P 0.00 4.36 0.00 2.22 2.19 0.00 3.91 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.96 0.00 61 G 9.25 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 M 7.23 4.94 0.00 2.05 2.01 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 2.59 2.53 0.00 63 T 9.16 4.65 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 64 G 8.66 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 65 L 7.93 4.13 0.00 1.80 1.80 1.21 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 66 E 8.39 3.97 0.00 2.20 2.02 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 2.36 2.36 0.00 67 V 7.95 3.55 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 1.00 0.00 0.00 1.04 0.00 0.00 68 L 8.44 3.91 0.00 1.76 1.94 0.97 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 69 A 8.26 4.00 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 70 E 8.18 3.88 0.00 2.18 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 2.30 2.34 0.00 71 I 7.95 3.72 2.02 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 1.53 0.62 0.92 0.00 0.00 72 R 8.06 3.89 0.00 1.93 1.93 0.00 3.31 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.02 0.00 73 K 8.01 3.79 0.00 1.82 1.87 0.00 1.69 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.72 1.64 7.81 74 K 7.77 4.29 0.00 1.75 1.84 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.61 7.81 75 H 8.01 4.10 0.00 3.31 3.37 0.00 5.66 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 L 7.66 4.19 0.00 1.67 1.62 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 77 N 8.42 4.73 0.00 2.68 2.77 0.00 0.00 6.82 7.94 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 78 I 7.20 4.85 1.89 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 1.49 0.75 0.98 0.00 0.00 79 K 9.22 4.52 0.00 1.68 1.74 0.00 1.64 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.56 7.81 80 V 9.67 4.82 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 0.99 0.00 0.00 0.94 0.00 0.00 81 I 8.88 4.98 1.83 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.70 0.86 0.00 0.00 82 I 8.46 4.58 1.84 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 1.12 0.84 0.69 0.00 0.00 83 V 8.66 4.61 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 0.81 0.00 0.00 0.81 0.00 0.00 84 T 8.38 4.66 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 0.90 0.00 0.00 85 T 8.07 3.86 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 1.10 0.00 0.00 86 F 7.44 4.70 0.00 2.86 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 8.92 4.28 0.00 1.82 1.93 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.44 7.81 88 R 8.29 3.92 0.00 2.15 2.18 0.00 3.19 0.00 0.00 3.38 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 89 P 0.00 4.44 0.00 2.41 2.36 0.00 3.76 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 2.08 2.06 0.00 90 G 8.10 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 0.00 0.00 0.00 91 Y 7.79 4.25 0.00 3.42 3.33 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 92 F 8.26 3.49 0.00 2.67 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 93 E 8.09 3.69 0.00 2.15 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 2.29 2.52 0.00 94 K 8.12 3.94 0.00 2.06 1.90 0.00 1.68 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.40 7.81 95 A 7.99 4.04 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 96 V 7.42 3.30 1.78 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 0.95 0.00 0.00 -0.00 0.00 0.00 97 V 7.54 3.63 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 0.85 0.00 0.00 0.89 0.00 0.00 98 N 7.58 4.67 0.00 2.80 2.87 0.00 0.00 6.96 8.45 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 99 D 8.34 4.37 0.00 2.76 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 0.00 100 V 7.54 3.86 2.26 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 0.82 0.00 0.00 1.12 0.00 0.00 101 D 8.77 4.70 0.00 2.78 2.79 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 0.00 102 A 7.87 4.80 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 0.00 103 Y 8.84 5.00 0.00 3.18 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.71 4.42 1.98 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 0.86 0.00 0.00 0.92 0.00 0.00 105 L 8.41 4.69 0.00 1.67 1.61 1.07 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.60 4.27 0.00 1.55 1.77 0.00 1.56 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.36 7.81 107 E 8.27 4.03 0.00 1.93 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 2.30 2.32 0.00 108 R 7.62 4.50 0.00 1.82 1.89 0.00 3.31 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.67 0.00 109 S 8.78 4.49 0.00 4.16 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 0.00 110 I 8.09 3.62 1.83 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.62 0.89 0.00 0.00 111 E 8.04 3.79 0.00 1.97 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 2.33 2.13 0.00 112 E 8.15 3.97 0.00 2.15 1.98 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 2.32 2.29 0.00 113 L 8.09 3.88 0.00 1.68 1.76 0.84 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 114 V 8.33 3.54 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 1.42 0.00 0.00 0.95 0.00 0.00 115 E 8.27 4.00 0.00 2.25 2.02 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 2.36 2.61 0.00 116 T 8.22 3.88 4.40 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 1.23 0.00 0.00 117 I 8.05 3.71 2.01 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.68 0.94 0.00 0.00 118 N 8.32 4.42 0.00 2.91 2.94 0.00 0.00 7.13 8.45 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 0.00 119 K 8.38 4.13 0.00 1.78 1.88 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.81 1.62 7.81 120 V 7.90 3.63 2.29 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 0.82 0.00 0.00 1.01 0.00 0.00 121 N 8.63 4.59 0.00 2.88 2.89 0.00 0.00 7.25 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 0.00 122 N 7.78 4.68 0.00 2.71 2.71 0.00 0.00 6.78 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00