NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.1319 8.3149 121.7864 56.0747 33.9536 175.6947 4 I 4.2166 7.5090 120.9260 59.3514 37.6765 174.4650 5 I 3.6265 8.6391 129.4202 62.2955 38.6216 174.9515 6 H 4.8992 8.8463 127.1070 55.1624 29.3910 174.5673 7 V 4.3292 8.2105 119.0786 60.5906 32.9941 175.5001 8 T 4.8678 8.4642 112.2243 59.0381 71.9923 174.6814 9 D 4.3842 8.8655 120.8565 57.2664 40.6515 178.0097 10 D 4.5871 8.1020 117.5849 55.9769 41.7473 177.2223 11 S 4.6331 7.8205 112.2664 58.1384 63.4102 175.7219 12 F 3.8516 7.9916 126.2856 61.6309 39.2289 176.4274 13 D 4.4662 8.3912 118.6020 56.8877 38.7525 178.5413 14 T 3.9407 7.6934 109.4276 64.4269 69.3572 176.2477 15 D 4.3740 8.2593 120.9541 55.5983 40.6872 177.5188 16 V 3.7885 7.5364 117.3526 64.3618 32.6258 177.7477 17 L 3.9626 7.4661 116.4077 56.9772 41.6652 177.9362 18 K 4.3398 7.5317 114.5090 55.7880 32.6361 176.5931 19 A 3.9924 7.1739 121.4108 52.0902 18.7057 177.3500 20 D 4.6549 9.8633 120.7655 54.9800 41.8035 176.3666 21 G 3.7869 7.7546 114.1361 44.3991 0.0000 168.6183 22 A 4.9500 8.1423 121.9936 50.8527 20.7363 176.8153 23 I 4.9283 8.5943 123.2774 59.2966 41.0247 174.3239 24 L 5.0785 8.8973 129.0905 53.4988 44.1237 174.9520 25 V 4.5805 9.1636 127.7203 61.3807 33.5814 173.8294 26 D 4.9232 8.6814 128.6102 52.9438 42.3775 175.1342 27 F 5.1652 9.0773 126.5724 56.3269 40.3803 175.1820 28 W 5.3409 8.7404 120.7504 55.5121 32.2676 173.5054 29 A 3.7140 8.0609 117.8299 50.6648 20.9961 177.4991 30 E 4.0310 8.3713 120.6610 59.2968 29.6382 178.6674 31 W 4.3892 7.1785 112.7732 57.5584 28.8571 177.4646 32 C 4.7821 7.6703 120.6620 55.5620 39.8992 173.5098 33 G 3.7525 8.7877 114.2553 47.6612 0.0000 171.0777 34 P 4.3057 0.0000 0.0000 65.2311 31.1935 179.5396 35 C 4.3355 8.0623 114.9467 60.0323 40.0504 176.1772 36 K 3.7807 7.7614 117.9149 58.8406 31.5982 178.5831 37 M 4.1938 7.4812 117.9006 57.5111 32.6881 177.0668 38 I 4.1605 7.4584 110.9477 61.0076 38.2195 177.3263 39 A 3.8304 7.7086 123.4388 54.9686 18.1459 177.7208 40 P 4.1526 0.0000 0.0000 65.7340 31.4429 178.8606 41 I 3.7361 7.6778 118.1824 64.3400 37.0182 178.3474 42 L 3.9716 7.8073 119.4841 57.7677 40.7512 179.1587 43 D 4.3506 7.8594 118.7354 57.4654 40.7227 178.7066 44 E 4.3182 8.0756 118.6225 59.1974 29.5433 179.2817 45 I 3.9249 8.0759 119.8587 64.2685 36.8790 178.2740 46 A 4.1058 7.9308 120.9987 54.9881 18.1827 179.1699 47 D 4.4639 7.3201 117.3543 57.5614 41.1954 178.5871 48 E 4.1218 8.1839 117.2286 57.9676 29.7275 176.9178 49 Y 4.5948 7.9951 117.7500 57.2711 38.8783 175.1885 50 Q 4.0887 8.1246 121.6153 57.2590 29.5652 174.4702 51 G 4.1930 9.1398 114.4488 45.3679 0.0000 174.0259 52 K 4.5699 7.2756 114.2133 55.8676 33.2001 175.3486 53 L 4.6318 7.4102 118.1513 54.8548 44.9915 173.6793 54 T 4.6592 8.5637 121.9915 61.7409 71.8519 172.9198 55 V 4.7080 8.3979 125.5887 61.2911 33.8340 174.2608 56 A 5.3691 8.8888 128.2190 50.2373 23.3171 174.6754 57 K 5.0211 8.9523 117.3572 54.6934 37.1905 175.4887 58 L 4.8177 8.9156 126.0413 53.1171 45.1906 174.9176 59 N 3.9210 8.6305 125.6633 52.2414 39.0821 175.4777 60 I 3.9375 8.0804 121.1514 63.9645 38.0825 177.3582 61 D 4.5135 7.7079 120.4940 57.2937 40.6574 177.7562 62 Q 4.2128 7.9702 115.7304 57.5861 29.4284 175.9465 63 N 5.0413 7.6627 114.6031 50.9460 38.7385 172.2213 64 P 4.6418 0.0000 0.0000 63.0467 31.9014 178.0240 65 G 3.9137 8.1685 109.2617 47.8438 0.0000 175.9581 66 T 3.8582 8.0978 116.5551 66.4048 69.0785 176.2546 67 A 3.9543 8.4647 123.9574 55.0979 18.6657 177.7155 68 P 4.2562 0.0000 0.0000 65.7113 31.1125 178.9755 69 K 3.9669 7.6925 116.2902 58.4887 32.1297 177.8262 70 Y 4.6861 7.8038 116.3510 56.9365 38.5224 176.0951 71 G 3.9892 7.8104 105.8705 46.2558 0.0000 174.2649 72 I 3.6962 7.1535 119.5114 61.2670 36.8270 176.4632 73 R 4.2696 8.3555 124.5436 56.7937 30.8073 176.1008 74 G 4.0917 7.1952 104.6857 45.1294 0.0000 172.1545 75 I 4.8008 8.1098 112.0741 57.8029 40.7433 173.4697 76 P 4.8124 0.0000 0.0000 63.5213 33.1301 174.9645 77 T 5.0137 8.3249 114.9252 60.9671 71.4373 172.1284 78 L 5.4237 9.3733 128.6583 52.9500 44.9579 175.2534 79 L 5.1266 8.8709 123.1690 52.7930 45.0542 175.2390 80 L 5.0436 8.8546 126.4198 53.6477 43.5043 175.1666 81 F 4.9617 9.3629 126.5516 56.7086 41.1312 175.2812 82 K 4.6216 9.1452 123.4600 55.6601 35.4720 175.8647 83 N 3.9953 9.4802 122.1512 54.3389 36.7323 175.0284 84 G 4.1107 9.6782 104.3270 45.2863 0.0000 173.5627 85 E 4.9616 8.4203 117.9783 54.0316 33.7191 174.9866 86 V 3.4585 8.5531 121.4055 63.5680 31.8428 175.2930 87 A 4.5671 9.1417 129.8469 53.5754 20.3129 176.8366 88 A 4.7039 7.5411 114.3089 51.2166 22.7219 175.5780 89 T 5.1647 8.5656 115.5763 61.8353 72.7107 173.8918 90 K 4.3350 8.8062 125.4848 55.2802 35.5116 174.7055 91 V 4.4461 8.6103 127.6087 62.3349 33.5554 175.5003 92 G 3.8511 8.8688 112.9889 44.5816 0.0000 172.8064 93 A 4.3102 8.0005 121.6202 51.8921 19.1858 176.6393 94 L 4.5090 7.6600 117.7569 53.5503 42.9886 175.6558 95 S 4.4668 8.3638 116.1345 57.2734 65.4599 175.1989 96 K 3.9621 8.5629 121.6422 59.6944 31.7905 178.5093 97 G 3.6802 8.0748 105.2758 48.1629 0.0000 175.4694 98 Q 4.2256 7.8064 120.1390 58.3631 28.5910 178.8187 99 L 3.9589 7.8411 121.1020 57.9299 42.0979 179.0894 100 K 4.0855 8.1664 118.4666 59.5607 32.0259 179.1486 101 E 3.9834 8.4126 118.8543 59.3914 29.2742 179.1419 102 F 4.0913 8.2099 120.4610 61.3043 39.4376 177.2160 103 L 3.9188 8.5151 118.8987 57.9627 40.4684 179.1147 104 D 4.4597 8.8925 119.0509 57.5388 40.5482 178.9142 105 A 4.2782 7.8880 120.1462 54.2412 18.4474 178.3931 106 N 4.6093 7.4238 111.9823 53.3806 39.1802 176.1492 107 L 4.3562 7.5286 120.0023 55.5653 42.3992 176.3063 108 A 4.1753 7.3016 126.5076 52.3071 18.3984 176.9792 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 K 8.31 4.13 0.00 1.72 1.89 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.47 7.81 4 I 7.51 4.22 1.83 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.77 0.86 0.00 0.00 5 I 8.64 3.63 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.55 0.88 0.00 0.00 6 H 8.85 4.90 0.00 3.14 3.27 0.00 5.91 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 V 8.21 4.33 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.93 0.00 0.00 8 T 8.46 4.87 4.38 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 1.26 0.00 0.00 9 D 8.87 4.38 0.00 2.68 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 D 8.10 4.59 0.00 2.69 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 11 S 7.82 4.63 0.00 4.28 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 12 F 7.99 3.85 0.00 3.31 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.39 4.47 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 14 T 7.69 3.94 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 1.21 0.00 0.00 15 D 8.26 4.37 0.00 2.59 2.63 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 16 V 7.54 3.79 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.08 0.00 0.00 17 L 7.47 3.96 0.00 1.89 1.73 1.09 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.53 4.34 0.00 1.86 1.80 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.49 7.81 19 A 7.17 3.99 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 9.86 4.65 0.00 2.59 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 21 G 7.75 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.14 4.95 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 8.59 4.93 1.89 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 1.10 0.86 0.89 0.00 0.00 24 L 8.90 5.08 0.00 1.74 1.51 1.04 0.93 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 25 V 9.16 4.58 2.36 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 0.53 0.00 0.00 1.07 0.00 0.00 26 D 8.68 4.92 0.00 2.78 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 F 9.08 5.17 0.00 3.13 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 28 W 8.74 5.34 0.00 3.39 3.09 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 0.00 0.00 0.00 0.00 29 A 8.06 3.71 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.37 4.03 0.00 1.88 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 0.00 2.33 2.31 0.00 31 W 7.18 4.39 0.00 3.51 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 32 C 7.67 4.78 0.00 2.37 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.79 3.75 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 0.00 0.00 0.00 34 P 0.00 4.31 0.00 2.20 2.17 0.00 3.68 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 35 C 8.06 4.34 0.00 3.21 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.76 3.78 0.00 1.92 1.87 0.00 1.76 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.50 1.52 7.81 37 M 7.48 4.19 0.00 2.18 2.08 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 2.60 2.53 0.00 38 I 7.46 4.16 1.82 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 1.60 0.42 0.97 0.00 0.00 39 A 7.71 3.83 1.11 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 0.00 0.00 40 P 0.00 4.15 0.00 2.13 2.07 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 2.07 2.11 0.00 41 I 7.68 3.74 1.99 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 1.62 0.57 0.90 0.00 0.00 42 L 7.81 3.97 0.00 1.84 1.63 0.86 0.73 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 43 D 7.86 4.35 0.00 2.83 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 44 E 8.08 4.32 0.00 2.01 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 2.55 0.00 45 I 8.08 3.92 2.05 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.93 0.85 0.00 0.00 46 A 7.93 4.11 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 47 D 7.32 4.46 0.00 3.04 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 48 E 8.18 4.12 0.00 1.98 1.81 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 2.32 2.62 0.00 49 Y 8.00 4.59 0.00 3.20 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 50 Q 8.12 4.09 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.97 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 51 G 9.14 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 0.00 0.00 0.00 52 K 7.28 4.57 0.00 1.97 1.91 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.74 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 1.47 7.81 53 L 7.41 4.63 0.00 1.65 1.81 0.98 0.71 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 54 T 8.56 4.66 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 1.18 0.00 0.00 55 V 8.40 4.71 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 0.93 0.00 0.00 0.91 0.00 0.00 56 A 8.89 5.37 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 0.00 0.00 0.00 0.00 0.00 57 K 8.95 5.02 0.00 1.67 1.64 0.00 1.41 0.00 0.00 1.35 0.00 0.00 2.59 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.25 1.28 7.81 58 L 8.92 4.82 0.00 1.49 1.06 0.93 0.82 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 59 N 8.63 3.92 0.00 2.36 2.42 0.00 0.00 6.94 7.98 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 60 I 8.08 3.94 1.90 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 1.34 0.64 1.07 0.00 0.00 61 D 7.71 4.51 0.00 2.68 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Q 7.97 4.21 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 7.29 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 63 N 7.66 5.04 0.00 2.73 2.91 0.00 0.00 7.01 7.58 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 64 P 0.00 4.64 0.00 2.18 2.15 0.00 3.74 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 1.98 1.96 0.00 65 G 8.17 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 66 T 8.10 3.86 4.17 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 0.47 0.00 0.00 67 A 8.46 3.95 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.26 0.00 2.14 2.09 0.00 3.73 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 2.10 2.17 0.00 69 K 7.69 3.97 0.00 1.58 1.44 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.39 7.81 70 Y 7.80 4.69 0.00 3.03 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 71 G 7.81 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 72 I 7.15 3.70 1.78 0.00 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.49 0.72 0.00 0.00 73 R 8.36 4.27 0.00 1.78 1.97 0.00 3.43 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.54 0.00 74 G 7.20 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 8.11 4.80 2.00 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.80 1.03 0.00 0.00 76 P 0.00 4.81 0.00 2.15 2.25 0.00 3.72 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 77 T 8.32 5.01 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 78 L 9.37 5.42 0.00 1.42 1.50 0.79 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.87 5.13 0.00 1.70 1.15 0.76 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 80 L 8.85 5.04 0.00 1.87 1.70 1.03 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 81 F 9.36 4.96 0.00 2.91 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 82 K 9.15 4.62 0.00 1.80 1.62 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.48 7.81 83 N 9.48 4.00 0.00 2.99 2.90 0.00 0.00 7.34 7.53 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 84 G 9.68 4.11 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 0.00 0.00 0.00 85 E 8.42 4.96 0.00 2.09 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 2.36 2.36 0.00 86 V 8.55 3.46 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 0.64 0.00 0.00 0.52 0.00 0.00 87 A 9.14 4.57 1.25 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 0.00 0.00 88 A 7.54 4.70 1.13 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 89 T 8.57 5.16 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 90 K 8.81 4.34 0.00 0.92 1.11 0.00 1.29 0.00 0.00 1.42 0.00 0.00 2.61 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.75 1.16 7.81 91 V 8.61 4.45 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 0.84 0.00 0.00 0.91 0.00 0.00 92 G 8.87 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 0.00 0.00 0.00 93 A 8.00 4.31 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 94 L 7.66 4.51 0.00 1.89 1.54 0.77 0.52 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 95 S 8.36 4.47 0.00 4.03 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.56 3.96 0.00 1.82 1.87 0.00 1.78 0.00 0.00 1.86 0.00 0.00 3.09 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.52 1.47 7.81 97 G 8.07 3.68 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 0.00 0.00 0.00 98 Q 7.81 4.23 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.77 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 99 L 7.84 3.96 0.00 1.74 1.82 0.82 0.65 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 0.00 100 K 8.17 4.09 0.00 2.06 2.00 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.10 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.62 1.78 7.81 101 E 8.41 3.98 0.00 2.08 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 2.37 2.53 0.00 102 F 8.21 4.09 0.00 3.15 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 8.52 3.92 0.00 1.89 1.41 1.04 0.32 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 0.00 104 D 8.89 4.46 0.00 2.69 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 0.00 105 A 7.89 4.28 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 0.00 106 N 7.42 4.61 0.00 2.21 2.61 0.00 0.00 6.99 8.20 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 0.00 107 L 7.53 4.36 0.00 1.69 1.75 1.02 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 108 A 7.30 4.18 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