NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4169 8.3044 120.3231 55.5374 32.8842 175.9452 2 H 4.1963 8.6089 126.9203 54.4012 28.0594 171.5306 3 L 4.7346 7.2826 120.3225 52.6395 44.4075 177.2171 4 T 4.1459 8.6683 115.0873 60.7279 70.9717 173.7635 5 P 4.2699 0.0000 0.0000 65.5644 31.2598 178.9543 6 E 3.9830 8.0611 117.3105 59.2262 29.3726 178.9489 7 E 3.8778 7.8782 118.7655 59.1760 29.4819 179.0036 8 K 3.7538 7.8739 119.6707 59.8958 32.1971 178.7146 9 S 4.0652 8.1689 112.7523 60.9844 62.3046 176.0507 10 A 3.9516 8.0089 123.7889 55.1252 18.2084 179.3130 11 V 3.3225 8.3610 117.3745 66.7291 31.3612 178.1313 12 T 3.9647 8.3336 115.1337 66.6536 68.1324 176.4004 13 A 4.0548 7.9783 121.4322 55.2737 18.8333 179.0948 14 L 3.9175 7.9289 118.6055 58.0790 42.2026 178.9663 15 W 4.4170 8.6132 128.1924 59.9740 30.4387 178.1089 16 G 3.7826 7.9622 105.0424 46.8511 0.0000 174.8509 17 K 4.3639 7.7979 118.5214 55.7640 32.8827 176.7143 18 V 3.7968 6.7671 119.7333 61.8920 32.3206 175.9318 19 N 4.5440 8.1738 125.2161 52.2884 38.6866 175.7169 20 V 3.4892 7.9715 122.0264 64.1396 31.4299 177.6657 21 D 4.3813 8.1987 118.1900 57.5041 40.6831 178.6171 22 E 3.8798 8.1288 118.7693 59.4461 29.8233 178.8143 23 V 3.5800 7.9166 118.4895 65.6275 31.4018 178.3240 24 G 3.6404 8.2597 105.8384 47.7529 0.0000 175.9761 25 G 3.6299 7.7253 108.3801 47.4821 0.0000 175.6375 26 E 3.9596 8.2392 120.7639 58.9008 29.4373 179.3759 27 A 3.9242 8.1649 120.9659 55.1860 18.6729 179.5316 28 L 4.0380 8.1762 119.1669 57.9592 42.2430 179.1198 29 G 3.7260 8.2146 105.8920 48.2224 0.0000 175.9154 30 R 3.9806 8.2302 121.0285 58.3218 29.8957 178.8675 31 L 4.1465 7.9398 120.4199 58.4562 42.1076 179.2365 32 L 4.0830 7.9161 118.1313 57.2420 41.2375 179.5631 33 V 3.6874 7.3100 117.2060 65.5779 31.7796 177.9176 34 V 3.6213 8.2028 117.3631 64.2716 32.8859 175.6793 35 Y 4.7609 7.8266 117.0609 54.9789 37.7851 174.3240 36 P 4.9466 0.0000 0.0000 64.2028 31.2450 178.1560 37 E 4.0792 8.2919 118.0015 59.4964 29.6134 178.7885 38 T 4.2812 8.3252 110.6817 64.4482 68.8405 176.2549 39 Q 4.3282 8.1134 121.2093 58.5128 28.4520 178.5590 40 R 3.9388 7.4000 115.2208 58.2933 29.5144 177.9378 41 F 4.3117 7.7692 117.0867 57.8505 39.8161 175.4762 42 F 4.6118 7.8947 118.5797 56.6300 39.7514 176.5851 43 E 4.1781 8.1390 119.3622 58.3722 29.8376 178.2493 44 S 4.4466 7.8743 113.0137 59.6194 63.5991 174.9415 45 F 4.6783 8.1549 119.9611 59.0023 39.8320 176.1035 46 G 4.0451 7.4671 105.4157 44.0001 0.0000 174.4603 47 D 4.5069 8.6090 125.1952 54.3443 41.3603 175.8067 48 L 4.9267 8.3540 126.8540 54.5689 43.0359 177.8712 49 S 4.3521 8.1602 116.4188 60.1937 63.7580 174.5009 50 T 4.7331 7.4594 110.3738 58.2573 72.9272 172.6085 51 P 4.2152 0.0000 0.0000 66.2750 31.3742 178.7295 52 D 4.3634 8.0959 116.5911 57.2385 40.5493 178.4716 53 A 4.0281 7.8839 120.5902 54.8537 18.5061 179.6900 54 V 3.7415 7.6057 116.5488 66.5047 31.5976 178.3503 55 M 4.2077 8.3224 117.5091 57.7164 31.8876 178.0942 56 G 3.9822 7.7943 103.1116 43.5230 0.0000 173.3144 57 N 4.3555 7.5568 121.1711 52.9772 39.4565 173.8142 58 P 4.2333 0.0000 0.0000 65.6012 31.4108 178.7661 59 K 3.7093 8.3431 117.5358 58.7856 31.8032 179.6469 60 V 3.3743 7.4036 118.2096 65.8884 31.4411 178.1297 61 K 3.9282 8.0369 118.0078 59.3587 31.8041 179.2632 62 A 3.9720 8.0457 121.1646 55.3990 18.2290 179.2094 63 H 4.3315 8.3536 116.9741 59.1480 29.9685 177.6712 64 G 3.6517 8.3090 107.8223 47.7103 0.0000 175.5883 65 K 4.0377 7.9208 121.9477 58.9485 32.2329 178.9171 66 K 3.9518 7.8242 119.7711 59.4774 32.1575 178.9670 67 V 3.6753 7.9490 118.5692 66.1948 31.4719 178.0617 68 L 4.3900 8.2792 118.7879 57.4591 41.4246 179.6904 69 G 3.7381 8.3868 105.8869 47.8877 0.0000 175.6610 70 A 4.3947 8.1104 124.7197 54.1921 18.3698 179.4525 71 F 4.0590 8.5855 119.3322 61.7089 39.4719 177.5395 72 S 4.0811 8.8059 115.1690 61.7596 62.0967 176.4665 73 D 4.4854 8.2700 121.7827 57.0638 40.3954 179.1263 74 G 3.4524 7.7741 106.1157 47.7903 0.0000 175.8330 75 L 3.7210 7.2758 120.1847 56.9720 41.6214 178.6938 76 A 4.2468 7.4596 117.7420 52.8272 19.6332 176.7543 77 H 4.8457 8.1655 115.0394 54.5532 29.7175 175.2984 78 L 3.8726 7.9116 119.4863 57.4816 41.9781 178.4297 79 D 4.7239 7.8742 116.1417 54.1188 41.6393 176.6190 80 N 4.9684 8.1229 118.4329 51.1665 39.7755 175.5886 81 L 4.0445 7.9719 121.8329 58.0679 41.9817 179.4620 82 K 3.9738 7.9750 117.1508 59.3036 32.2685 179.1909 83 G 3.7019 7.9997 105.8625 47.9238 0.0000 175.8556 84 T 3.6598 7.5402 117.2270 65.9067 68.6267 175.6826 85 F 4.7168 7.7255 116.5347 57.1430 39.2121 177.4644 86 A 4.1063 7.7122 123.1711 55.7188 18.3376 180.4735 87 T 3.9232 7.8669 107.6364 64.6771 68.9144 176.4654 88 L 4.0978 7.9475 122.9384 57.7240 42.1218 178.5748 89 S 4.3987 8.3216 114.7654 61.0521 62.3893 175.8530 90 E 3.7898 8.0629 121.1244 59.3796 29.1898 179.3220 91 L 3.8786 7.8129 119.6638 58.5811 42.2104 178.8098 92 H 4.1598 8.5548 116.2967 59.1008 28.4560 176.9345 93 C 3.6134 8.0140 121.1735 62.1509 31.0590 175.3199 94 D 4.2548 8.6237 121.4282 56.7355 40.6402 177.8356 95 K 4.1559 7.7277 117.5168 57.6782 32.8415 177.5587 96 L 4.3203 7.6040 115.6165 54.0213 43.2243 175.7014 97 H 4.1283 7.3049 115.0971 56.6274 26.5791 175.1727 98 V 3.8449 7.6267 117.8756 60.8843 32.7690 174.7882 99 D 4.2797 8.6278 127.0162 53.8182 41.5837 175.1317 100 P 3.1340 0.0000 0.0000 64.4186 31.8429 178.0985 101 E 3.8546 8.2939 118.6601 59.5832 29.3715 178.9395 102 N 4.2888 7.9512 116.1039 56.1207 38.5476 177.3930 103 F 4.5248 7.6601 119.4082 60.4922 38.8706 177.8529 104 R 4.0172 8.0600 118.0424 59.0626 29.8478 179.0160 105 L 3.8080 7.6182 118.4849 57.5291 41.6515 179.1151 106 L 4.1334 7.9789 120.1169 58.0646 42.0569 179.1662 107 G 3.7406 8.0847 105.5569 48.0228 0.0000 175.4454 108 N 4.4746 8.2430 118.8395 55.9579 38.5585 177.7855 109 V 3.6679 8.0080 119.8241 65.8580 31.6170 177.8402 110 L 3.8938 8.4949 120.5504 58.0440 41.8939 179.0557 111 V 3.5579 7.8662 118.2333 66.2760 31.4014 177.7544 112 C 4.1039 8.1253 116.4246 62.8592 27.9631 176.3644 113 V 3.5572 7.9261 119.8367 65.8257 31.1097 178.0330 114 L 3.8858 7.8715 118.6258 57.7532 41.3912 179.4406 115 A 3.6154 7.3163 120.5795 55.0098 18.0288 179.1478 116 H 4.1099 8.1138 116.2853 59.8458 30.0174 176.9764 117 H 4.0463 8.1095 116.8493 58.0458 28.8880 176.9181 118 F 4.6233 8.4710 117.8607 56.4760 39.8183 177.2885 119 G 3.8081 8.7784 108.7351 46.0088 0.0000 177.3270 120 K 4.0140 8.9018 122.3852 59.1861 32.4253 177.8871 121 E 4.0854 8.1954 120.2828 58.8413 29.9545 177.1671 122 F 4.4958 8.1173 122.8379 57.1996 37.7759 175.0888 123 T 4.2262 7.4001 115.9555 59.9512 71.4586 173.5224 124 P 4.1736 0.0000 0.0000 65.6517 31.2801 177.1669 125 P 4.2179 0.0000 0.0000 65.4979 31.2993 178.8889 126 V 3.5520 7.1713 117.6117 65.6824 31.2578 177.9808 127 Q 3.5891 7.8241 119.1894 59.0163 28.8722 177.7036 128 A 3.9783 7.9738 121.5843 55.3575 18.4168 179.4658 129 A 3.8652 7.9561 118.9149 55.6285 18.4110 179.5350 130 Y 3.8015 8.1510 115.2189 61.1435 37.8842 178.8229 131 Q 4.1067 8.6615 119.5342 58.9813 28.7828 178.9501 132 K 3.9827 7.9282 119.3041 59.3128 31.9458 179.6555 133 V 3.5077 7.7003 118.3670 66.1759 31.4668 178.6155 134 V 3.8144 8.2717 111.9442 63.9714 31.3252 178.5632 135 A 4.0890 8.3545 121.2202 55.0439 18.1839 179.8217 136 G 3.5295 8.2503 104.4321 47.9839 0.0000 176.0947 137 V 3.3093 8.0828 120.7310 65.5199 31.4764 178.0295 138 A 3.8224 8.1407 120.6839 55.1612 17.9803 179.4233 139 N 4.3167 8.1653 114.0962 56.2847 38.7606 177.2202 140 A 4.0913 8.1418 122.4230 55.1720 18.3216 179.7115 141 L 3.8018 7.9949 117.1796 57.0683 41.6410 178.8069 142 A 4.4022 7.8057 119.6890 53.5627 18.6975 178.8852 143 H 4.3409 8.0686 113.6396 58.1440 28.5406 176.3238 144 K 4.3976 7.7710 118.8108 56.1909 32.0158 176.2567 145 Y 4.0454 7.9103 117.7401 58.2639 38.3887 175.6426 146 H 4.4631 8.2480 118.1441 56.1520 28.2835 173.2498 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 M 8.30 4.42 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 2 H 8.61 4.20 0.00 3.19 3.21 0.00 5.70 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.28 4.73 0.00 1.57 1.51 0.86 0.86 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 4 T 8.67 4.15 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 1.26 0.00 0.00 5 P 0.00 4.27 0.00 2.15 2.11 0.00 3.57 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 6 E 8.06 3.98 0.00 1.95 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 2.33 0.00 7 E 7.88 3.88 0.00 2.07 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 2.28 0.00 8 K 7.87 3.75 0.00 1.77 1.93 0.00 1.58 0.00 0.00 1.50 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.41 7.81 9 S 8.17 4.07 0.00 3.93 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 10 A 8.01 3.95 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 11 V 8.36 3.32 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 0.70 0.00 0.00 0.40 0.00 0.00 12 T 8.33 3.96 4.39 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 1.26 0.00 0.00 13 A 7.98 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.93 3.92 0.00 1.84 1.91 0.15 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.61 4.42 0.00 3.85 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 16 G 7.96 3.78 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 0.00 0.00 0.00 17 K 7.80 4.36 0.00 2.16 2.15 0.00 1.75 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.51 7.81 18 V 6.77 3.80 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 0.10 0.00 0.00 0.87 0.00 0.00 19 N 8.17 4.54 0.00 2.78 2.60 0.00 0.00 7.21 7.71 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 20 V 7.97 3.49 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 0.84 0.00 0.00 0.98 0.00 0.00 21 D 8.20 4.38 0.00 2.91 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 22 E 8.13 3.88 0.00 1.98 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 2.36 2.33 0.00 23 V 7.92 3.58 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 0.89 0.00 0.00 0.64 0.00 0.00 24 G 8.26 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.73 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.24 3.96 0.00 2.11 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 2.49 0.00 27 A 8.16 3.92 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 28 L 8.18 4.04 0.00 1.80 1.67 0.90 1.01 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 29 G 8.21 3.73 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 0.00 0.00 0.00 30 R 8.23 3.98 0.00 1.94 1.98 0.00 3.11 0.00 0.00 3.04 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 31 L 7.94 4.15 0.00 1.88 1.95 1.07 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.92 4.08 0.00 1.92 1.75 0.79 0.73 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 33 V 7.31 3.69 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 0.76 0.00 0.00 0.94 0.00 0.00 34 V 8.20 3.62 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 0.05 0.00 0.00 0.84 0.00 0.00 35 Y 7.83 4.76 0.00 3.20 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 36 P 0.00 4.95 0.00 2.36 2.32 0.00 3.64 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 2.08 1.99 0.00 37 E 8.29 4.08 0.00 2.21 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 0.00 2.46 2.37 0.00 38 T 8.33 4.28 4.57 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 1.43 0.00 0.00 39 Q 8.11 4.33 0.00 2.30 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 40 R 7.40 3.94 0.00 1.73 1.86 0.00 2.89 0.00 0.00 2.62 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.71 0.00 41 F 7.77 4.31 0.00 2.53 2.34 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 42 F 7.89 4.61 0.00 2.80 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 0.00 0.00 0.00 43 E 8.14 4.18 0.00 2.15 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 2.42 2.25 0.00 44 S 7.87 4.45 0.00 4.12 4.08 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 45 F 8.15 4.68 0.00 3.14 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 46 G 7.47 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 0.00 0.00 0.00 47 D 8.61 4.51 0.00 2.65 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 48 L 8.35 4.93 0.00 1.66 1.64 1.02 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.16 4.35 0.00 3.95 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 50 T 7.46 4.73 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 1.21 0.00 0.00 51 P 0.00 4.22 0.00 2.16 2.14 0.00 3.59 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 2.10 2.18 0.00 52 D 8.10 4.36 0.00 2.68 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 53 A 7.88 4.03 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 54 V 7.61 3.74 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 1.03 0.00 0.00 1.01 0.00 0.00 55 M 8.32 4.21 0.00 1.98 2.10 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 2.61 2.86 0.00 56 G 7.79 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 0.00 0.00 0.00 57 N 7.56 4.36 0.00 2.99 2.78 0.00 0.00 7.12 8.97 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 58 P 0.00 4.23 0.00 2.13 2.04 0.00 3.60 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 2.07 2.14 0.00 59 K 8.34 3.71 0.00 1.39 0.74 0.00 1.69 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.27 1.30 7.81 60 V 7.40 3.37 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 1.04 0.00 0.00 1.02 0.00 0.00 61 K 8.04 3.93 0.00 1.79 1.80 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.58 7.81 62 A 8.05 3.97 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 63 H 8.35 4.33 0.00 3.42 3.41 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 8.31 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.92 4.04 0.00 1.79 1.96 0.00 1.76 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.47 7.81 66 K 7.82 3.95 0.00 1.96 1.76 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.48 7.81 67 V 7.95 3.68 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 1.06 0.00 0.00 1.01 0.00 0.00 68 L 8.28 4.39 0.00 2.03 1.89 1.16 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 69 G 8.39 3.74 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 0.00 0.00 0.00 70 A 8.11 4.39 1.59 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 0.00 0.00 0.00 71 F 8.59 4.06 0.00 3.31 3.37 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 72 S 8.81 4.08 0.00 4.24 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 0.00 73 D 8.27 4.49 0.00 2.68 2.59 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 0.00 74 G 7.77 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 75 L 7.28 3.72 0.00 1.47 1.48 -0.41 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.46 4.25 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 0.00 0.00 77 H 8.17 4.85 0.00 3.06 3.12 0.00 5.82 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 78 L 7.91 3.87 0.00 1.55 1.66 0.79 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 79 D 7.87 4.72 0.00 2.62 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.12 4.97 0.00 2.71 2.61 0.00 0.00 7.20 7.02 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 81 L 7.97 4.04 0.00 1.73 1.81 0.88 0.75 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 82 K 7.98 3.97 0.00 1.65 1.65 0.00 1.66 0.00 0.00 1.56 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.44 7.81 83 G 8.00 3.70 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 0.00 0.00 0.00 84 T 7.54 3.66 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 0.50 0.00 0.00 85 F 7.73 4.72 0.00 3.18 2.95 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 86 A 7.71 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 87 T 7.87 3.92 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 1.21 0.00 0.00 88 L 7.95 4.10 0.00 2.02 1.83 1.04 1.10 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 89 S 8.32 4.40 0.00 4.08 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 0.00 90 E 8.06 3.79 0.00 2.23 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 2.30 0.00 91 L 7.81 3.88 0.00 1.79 1.84 0.90 0.93 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 92 H 8.55 4.16 0.00 3.59 3.73 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 8.01 3.61 0.00 1.23 2.33 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 94 D 8.62 4.25 0.00 2.62 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 95 K 7.73 4.16 0.00 1.84 1.79 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.51 7.81 96 L 7.60 4.32 0.00 1.64 1.57 0.71 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.30 4.13 0.00 3.34 3.38 0.00 5.64 0.00 0.00 0.00 0.00 8.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.63 3.84 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 0.12 0.00 0.00 0.17 0.00 0.00 99 D 8.63 4.28 0.00 2.72 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 3.13 0.00 1.91 1.75 0.00 3.36 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.61 0.00 101 E 8.29 3.85 0.00 1.86 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 2.25 2.44 0.00 102 N 7.95 4.29 0.00 2.57 2.76 0.00 0.00 7.00 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 0.00 103 F 7.66 4.52 0.00 3.05 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 0.00 104 R 8.06 4.02 0.00 2.00 1.95 0.00 3.10 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 105 L 7.62 3.81 0.00 1.61 1.16 0.58 0.05 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 0.00 106 L 7.98 4.13 0.00 1.88 1.75 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.08 3.74 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 0.00 0.00 0.00 108 N 8.24 4.47 0.00 2.94 2.94 0.00 0.00 6.66 7.72 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 0.00 109 V 8.01 3.67 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 1.08 0.00 0.00 1.20 0.00 0.00 110 L 8.49 3.89 0.00 1.64 1.80 0.87 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.87 3.56 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 1.29 0.00 0.00 1.16 0.00 0.00 112 C 8.13 4.10 0.00 3.19 2.95 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 0.00 113 V 7.93 3.56 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 0.91 0.00 0.00 0.94 0.00 0.00 114 L 7.87 3.89 0.00 1.20 1.07 0.49 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 115 A 7.32 3.62 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 0.00 116 H 8.11 4.11 0.00 3.22 3.50 0.00 5.77 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 8.11 4.05 0.00 2.83 2.67 0.00 5.71 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.47 4.62 0.00 3.22 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 0.00 119 G 8.78 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 0.00 0.00 0.00 120 K 8.90 4.01 0.00 1.92 2.02 0.00 1.64 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.42 7.81 121 E 8.20 4.09 0.00 2.17 2.21 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 2.36 2.31 0.00 122 F 8.12 4.50 0.00 3.05 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 0.00 123 T 7.40 4.23 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 1.26 0.00 0.00 124 P 0.00 4.17 0.00 2.15 2.15 0.00 3.58 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 2.12 2.21 0.00 125 P 0.00 4.22 0.00 2.11 2.06 0.00 3.49 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.17 3.55 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 0.93 0.00 0.00 0.88 0.00 0.00 127 Q 7.82 3.59 0.00 1.83 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.51 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 128 A 7.97 3.98 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 0.00 129 A 7.96 3.87 1.23 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 0.00 0.00 130 Y 8.15 3.80 0.00 3.47 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 0.00 131 Q 8.66 4.11 0.00 2.09 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.70 2.61 0.00 132 K 7.93 3.98 0.00 1.91 1.84 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.44 7.81 133 V 7.70 3.51 2.22 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 1.04 0.00 0.00 0.75 0.00 0.00 134 V 8.27 3.81 2.21 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 1.02 0.00 0.00 1.07 0.00 0.00 135 A 8.35 4.09 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 0.00 136 G 8.25 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.08 3.31 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 0.55 0.00 0.00 0.64 0.00 0.00 138 A 8.14 3.82 1.43 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 0.00 0.00 139 N 8.17 4.32 0.00 2.68 2.88 0.00 0.00 7.02 6.86 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 0.00 140 A 8.14 4.09 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 0.00 141 L 7.99 3.80 0.00 0.94 0.38 -0.02 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.81 4.40 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 0.00 143 H 8.07 4.34 0.00 3.33 3.60 0.00 5.57 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.77 4.40 0.00 1.73 1.81 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.01 1.59 7.81 145 Y 7.91 4.05 0.00 3.09 2.93 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 0.00 0.00 0.00 146 H 8.25 4.46 0.00 3.18 3.25 0.00 5.75 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