NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 4.0004 8.3549 109.7414 45.6714 0.0000 173.4564 5 S 4.3534 8.5978 113.8801 60.2709 62.7687 174.4486 6 R 3.9087 8.3979 121.4377 59.7130 29.7035 177.7125 7 R 3.6833 7.8619 117.1547 58.7795 30.0632 176.8886 8 Y 4.6667 7.7802 113.7493 56.5296 38.3366 174.8478 9 D 4.5961 7.3476 121.4592 53.7363 41.4554 176.5324 10 S 4.1876 8.7287 122.9943 59.3723 63.9530 173.8793 11 R 3.8038 8.6105 120.4139 56.9837 26.7367 177.0758 12 T 4.0237 7.8356 107.7572 63.5502 69.6919 175.5337 13 T 4.5502 7.2290 112.5567 61.3618 69.4758 173.4324 14 I 4.4398 7.3976 113.5931 59.8308 40.7798 174.7386 15 F 4.7114 8.3817 119.8275 56.9772 39.9730 175.7485 16 S 4.5113 8.2358 118.1525 56.0787 64.4578 173.5469 17 P 4.4763 0.0000 0.0000 65.3295 30.9932 177.3834 18 E 4.2080 8.1121 115.2746 56.0508 29.7080 176.3911 19 G 3.6078 8.3699 107.4267 46.4343 0.0000 173.7944 20 R 4.5844 7.5847 117.0458 53.9811 32.9078 175.8482 21 L 4.6209 7.9897 120.3246 53.7937 42.2657 176.9681 22 Y 3.7204 7.2449 120.9526 61.7254 37.9090 178.9693 23 Q 3.9218 8.0079 117.8805 59.1157 28.8855 179.5758 24 V 3.5737 7.5412 118.6374 66.0910 31.7340 177.8059 25 E 4.0082 8.1059 118.3106 59.6977 29.3436 178.9754 26 Y 4.5077 8.1886 116.6794 60.7686 37.9488 177.9448 27 A 4.0945 8.1971 122.0509 55.0592 18.4590 179.6788 28 L 3.9606 8.2087 117.7038 57.8258 41.4207 179.3087 29 E 3.9451 7.8402 118.2816 59.1675 29.8965 178.5416 30 S 4.2792 7.9869 113.0983 61.4448 62.4108 176.1147 31 I 3.7104 7.8522 122.8261 64.2995 36.6820 178.1834 32 S 4.2051 7.8612 113.1210 60.4487 62.7339 174.4336 33 H 4.7368 7.7620 118.0435 55.5585 29.2719 174.5138 34 A 4.4705 7.9253 123.4307 50.5092 19.7810 177.4988 35 G 4.0559 8.4356 106.4274 46.3997 0.0000 173.6504 36 T 4.3795 8.5928 119.3256 63.2387 69.9691 173.2494 37 A 5.2041 8.5070 125.8842 50.2362 21.9614 175.3758 38 I 4.6173 9.5411 123.3976 59.3254 41.2081 174.8927 39 G 4.4242 8.6888 111.8994 44.5404 0.0000 171.8719 40 I 4.7307 8.7708 125.2082 59.6881 41.0442 173.8869 41 M 4.7262 8.8418 126.7965 54.0759 33.4538 174.9200 42 A 4.8480 8.8135 129.3963 49.8955 22.0779 176.1202 43 S 4.3162 8.6726 112.9343 60.8012 63.1799 174.9402 44 D 4.8794 9.0265 118.4623 50.7186 39.6872 176.0347 45 G 4.0393 6.9150 108.0070 46.3168 0.0000 171.3443 46 I 5.1314 7.6342 118.5174 59.4968 41.3376 175.3897 47 V 4.5235 8.8775 124.5049 61.0781 34.7054 174.1818 48 L 5.3669 8.5958 125.9769 52.9444 44.6719 175.7339 49 A 4.8319 9.1998 124.5319 50.3268 22.7099 174.6728 50 A 5.0053 8.4420 121.9064 50.3364 22.6761 174.8802 51 E 4.4160 9.1170 122.2781 54.8036 31.4481 175.6976 52 R 4.2275 8.5215 126.5266 55.5691 30.6199 176.0915 53 K 4.0282 8.5879 124.9576 56.7034 33.0094 173.0902 54 V 3.1917 8.5330 130.7846 62.8135 32.2835 171.4874 55 T 4.6496 8.0343 114.3435 60.8586 71.5608 172.0124 56 S 4.6870 8.0925 115.0629 56.7605 65.8350 174.7778 57 T 3.8923 8.4849 119.6356 66.6404 68.1581 175.8484 58 L 4.2066 7.7319 117.9998 55.2152 42.0641 176.5740 59 L 3.9496 7.3562 122.4597 54.5201 42.1558 176.2591 60 E 4.1324 8.6036 127.4358 55.8505 28.6962 175.6741 61 Q 4.1339 8.4765 128.6260 58.5677 29.7634 177.9392 62 D 4.3277 8.2241 117.1065 57.4416 40.9005 177.0981 63 T 4.3719 7.7999 112.2499 63.2839 68.6911 174.1365 63A S 4.7102 7.3277 116.0467 57.1947 63.9674 174.1566 64 T 4.2988 7.9571 122.1158 63.0189 71.1264 173.2278 65 E 4.8514 8.6205 122.3855 55.5099 31.3646 176.0957 66 K 4.6974 7.7801 116.1759 56.0158 36.2171 175.5900 67 L 5.2208 7.7361 119.3430 53.0594 43.5960 175.7678 68 Y 4.7595 8.9597 121.3293 55.8808 42.1448 174.7525 69 K 4.4828 8.8213 124.4145 55.7558 33.1775 176.0399 70 L 4.4195 8.6476 126.2798 55.8277 42.8757 175.4150 71 N 5.0193 7.5688 113.7302 52.3742 41.9329 172.6235 72 D 4.6535 8.6815 115.9418 55.3827 41.5734 177.1044 73 K 4.6766 7.9584 116.5761 55.9489 34.6771 175.6136 74 I 5.2559 7.6995 120.5506 59.4841 41.3570 174.1690 75 A 5.2143 9.3363 126.6212 50.6499 23.3039 175.1407 76 V 4.9225 8.8887 111.0223 59.5951 36.4681 174.6569 77 A 5.2194 8.8161 124.6714 50.2644 21.5984 175.5744 78 V 4.8191 8.8497 122.0480 61.0569 34.2602 175.1373 79 A 4.3779 9.3179 128.1600 52.6004 21.4085 173.9856 80 G 3.7086 8.6783 112.4449 45.1007 0.0000 172.8542 81 L 4.0992 8.4158 125.4514 54.8997 41.7081 177.6885 82 T 3.8706 8.9104 121.5875 66.9046 68.3054 176.2350 83 A 3.9996 8.0041 121.7760 55.3230 18.2850 179.2735 84 D 4.4393 8.1294 116.7666 57.3162 40.9771 178.6854 85 A 3.9762 7.9292 121.4469 55.2401 18.4365 179.4770 86 E 3.7965 8.3249 117.2580 59.3776 29.2075 179.6639 87 I 3.6786 7.4653 119.9400 64.5625 37.2837 178.5292 88 L 3.8225 7.4862 119.5981 57.5795 41.2901 179.5932 89 I 3.4908 8.1384 120.2381 64.4017 37.1622 177.9419 90 N 4.2669 8.1314 118.0165 56.8848 38.6697 177.0022 91 T 3.9605 7.7257 110.8822 64.4583 68.9165 176.6867 92 A 3.9651 8.0439 123.7838 55.0997 18.3005 179.7397 93 R 3.9104 8.2676 116.8998 59.3511 29.9770 179.5034 94 I 3.7022 7.6058 119.2611 64.7236 37.1929 177.7719 95 H 4.1501 8.5858 119.2060 59.3432 29.5510 177.0832 96 A 3.9527 8.1005 122.4668 55.3293 18.2328 179.7080 97 Q 4.0189 7.9705 116.4099 59.0389 28.7506 178.6405 98 N 4.3256 8.5275 117.9670 56.4001 38.5017 176.7832 99 Y 3.9357 8.0215 120.9132 60.6819 38.9446 177.8847 100 L 4.4246 8.1060 122.6531 57.5646 41.9307 178.8777 101 K 3.9606 7.9528 119.0349 59.5103 32.1677 178.8339 102 T 3.7408 7.5947 115.3157 66.0534 68.5147 175.6811 103 Y 4.5592 7.4956 114.8111 56.4668 39.1175 175.3955 104 N 4.4164 8.3536 116.1893 53.8085 36.9397 173.8826 105 E 4.8413 7.8755 114.6492 54.6147 33.8625 175.0348 106 D 4.5777 8.5906 121.9266 54.0816 41.6065 176.1911 107 I 2.8679 8.0226 122.7027 59.6234 38.6611 174.1117 108 P 4.1718 0.0000 0.0000 62.3944 32.1699 176.9983 109 V 3.4838 8.5247 122.9747 66.4474 31.3409 178.1675 110 E 3.8065 7.9928 118.0596 59.2709 29.5571 178.6036 111 I 3.6736 7.3528 120.0205 64.2480 37.2219 178.2019 112 L 3.9809 7.6105 120.7190 57.9875 42.0264 178.9945 113 V 2.9688 7.5437 118.2799 65.6948 31.2839 177.9964 114 R 3.8300 8.3177 118.8824 59.2514 29.8911 178.4436 115 R 3.8137 7.8238 118.2918 59.5211 30.1714 178.5588 116 L 4.0132 7.7621 118.4993 57.9189 41.4945 179.7468 117 S 4.2425 8.2183 115.1921 61.6451 62.7267 176.4567 118 D 4.3930 8.4687 121.9774 57.2380 40.2849 178.8320 119 I 3.8188 7.5706 119.6062 64.3807 37.2234 178.2785 120 K 4.2526 8.0393 119.1350 59.5957 31.8349 179.0827 121 Q 4.1983 8.6014 120.3047 59.0994 28.9043 178.5473 122 G 3.7084 8.2430 106.7382 48.1717 0.0000 174.8402 123 Y 4.0370 7.8536 114.9983 59.4916 37.8641 177.4868 124 T 4.3224 7.9018 116.3119 63.8956 69.3689 174.9273 125 Q 4.4615 7.8402 119.7094 56.0967 31.1772 174.4879 126 H 4.7654 7.6764 110.5925 54.8986 30.2137 173.0768 127 G 3.8052 8.9202 108.6017 44.1966 0.0000 174.8950 128 G 4.0620 7.8320 105.7730 46.3430 0.0000 173.1453 129 L 4.7179 6.8835 118.6208 52.0168 44.0467 176.8401 130 R 4.1105 8.1377 116.7915 55.3980 30.1067 174.7298 131 P 4.5096 0.0000 0.0000 62.0316 32.2607 175.8377 132 F 4.3222 8.3707 118.5489 57.3323 40.1616 177.4080 133 G 4.0261 8.8134 115.0867 45.0072 0.0000 172.8313 134 V 4.8438 7.2404 117.8875 61.4240 35.8356 175.1234 135 S 4.6110 8.4071 121.1241 56.7089 66.5897 173.0819 136 F 5.4061 8.7211 121.7799 55.6720 42.2990 174.7308 137 I 4.5116 8.3067 121.8817 59.9113 39.8884 174.0406 138 Y 5.0629 8.8958 124.8423 56.3821 39.7507 175.0143 139 A 4.7413 9.3798 126.2622 50.3031 21.5648 175.3123 140 G 4.9700 8.5215 108.1075 45.6618 0.0000 170.8658 141 Y 4.9929 8.4130 120.1780 55.7856 41.7240 173.8578 142 D 4.6482 7.4948 123.8926 51.6740 42.5741 174.5868 143 D 4.4854 8.4849 117.5038 53.6911 39.3981 176.3802 144 R 4.0914 8.3230 126.3310 56.7394 30.0578 175.4595 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 4 G 8.35 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 5 S 8.60 4.35 0.00 4.02 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 6 R 8.40 3.91 0.00 1.87 1.95 0.00 3.15 0.00 0.00 3.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.72 0.00 7 R 7.86 3.68 0.00 1.54 1.10 0.00 2.40 0.00 0.00 2.94 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.41 0.00 8 Y 7.78 4.67 0.00 2.95 2.98 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 9 D 7.35 4.60 0.00 2.64 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 10 S 8.73 4.19 0.00 3.91 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 11 R 8.61 3.80 0.00 2.03 1.98 0.00 3.13 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 12 T 7.84 4.02 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 1.21 0.00 0.00 13 T 7.23 4.55 4.28 0.00 0.00 0.00 0.00 0.00 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 14 I 7.40 4.44 1.93 0.00 0.00 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 1.49 1.06 0.92 0.00 0.00 15 F 8.38 4.71 0.00 3.07 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.24 4.51 0.00 3.68 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 17 P 0.00 4.48 0.00 2.08 2.19 0.00 3.74 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 18 E 8.11 4.21 0.00 1.89 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 2.28 2.35 0.00 19 G 8.37 3.61 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 0.00 0.00 0.00 20 R 7.58 4.58 0.00 1.67 1.71 0.00 3.08 0.00 0.00 3.14 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 21 L 7.99 4.62 0.00 1.58 1.47 0.80 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 22 Y 7.24 3.72 0.00 2.82 2.40 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 0.00 23 Q 8.01 3.92 0.00 2.11 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.92 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 24 V 7.54 3.57 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 1.07 0.00 0.00 0.89 0.00 0.00 25 E 8.11 4.01 0.00 2.05 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 2.48 2.44 0.00 26 Y 8.19 4.51 0.00 2.96 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 27 A 8.20 4.09 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 28 L 8.21 3.96 0.00 1.92 1.75 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 29 E 7.84 3.95 0.00 2.01 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 0.00 2.34 2.39 0.00 30 S 7.99 4.28 0.00 4.00 4.10 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 31 I 7.85 3.71 1.99 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 1.88 0.79 0.92 0.00 0.00 32 S 7.86 4.21 0.00 3.97 3.94 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 33 H 7.76 4.74 0.00 3.30 3.33 0.00 5.64 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 34 A 7.93 4.47 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 35 G 8.44 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 0.00 0.00 0.00 36 T 8.59 4.38 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 37 A 8.51 5.20 1.19 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 38 I 9.54 4.62 1.88 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 1.17 0.82 0.92 0.00 0.00 39 G 8.69 4.42 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 40 I 8.77 4.73 1.88 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 1.12 0.84 0.92 0.00 0.00 41 M 8.84 4.73 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 42 A 8.81 4.85 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 43 S 8.67 4.32 0.00 4.00 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 44 D 9.03 4.88 0.00 2.77 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 45 G 6.91 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 0.00 0.00 0.00 46 I 7.63 5.13 1.90 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 1.27 0.76 0.97 0.00 0.00 47 V 8.88 4.52 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 0.98 0.00 0.00 0.94 0.00 0.00 48 L 8.60 5.37 0.00 1.52 1.53 0.94 0.74 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 49 A 9.20 4.83 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 50 A 8.44 5.01 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 51 E 9.12 4.42 0.00 2.03 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 2.25 2.28 0.00 52 R 8.52 4.23 0.00 1.84 1.95 0.00 3.24 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 53 K 8.59 4.03 0.00 1.79 1.71 0.00 2.02 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.43 7.81 54 V 8.53 3.19 2.08 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 0.84 0.00 0.00 0.93 0.00 0.00 55 T 8.03 4.65 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 56 S 8.09 4.69 0.00 3.81 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 57 T 8.48 3.89 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 58 L 7.73 4.21 0.00 1.63 1.71 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.36 3.95 0.00 1.54 1.70 0.92 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.60 4.13 0.00 1.95 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 2.35 0.00 61 Q 8.48 4.13 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.45 6.68 0.00 0.00 0.00 0.00 0.00 2.40 2.36 0.00 62 D 8.22 4.33 0.00 2.68 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 63 T 7.80 4.37 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 63A S 7.33 4.71 0.00 3.99 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 64 T 7.96 4.30 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 0.53 0.00 0.00 65 E 8.62 4.85 0.00 2.06 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 2.15 2.30 0.00 66 K 7.78 4.70 0.00 1.66 1.83 0.00 1.69 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.45 1.45 7.81 67 L 7.74 5.22 0.00 1.35 1.47 0.92 0.72 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 68 Y 8.96 4.76 0.00 2.79 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 69 K 8.82 4.48 0.00 1.73 1.75 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.46 7.81 70 L 8.65 4.42 0.00 1.80 1.68 0.89 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 71 N 7.57 5.02 0.00 2.62 2.87 0.00 0.00 6.95 8.47 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 72 D 8.68 4.65 0.00 2.72 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 73 K 7.96 4.68 0.00 1.72 2.04 0.00 1.68 0.00 0.00 1.99 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.47 7.81 74 I 7.70 5.26 1.88 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.78 0.96 0.00 0.00 75 A 9.34 5.21 1.19 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 76 V 8.89 4.92 1.79 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 0.18 0.00 0.00 0.84 0.00 0.00 77 A 8.82 5.22 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 78 V 8.85 4.82 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 0.77 0.00 0.00 1.26 0.00 0.00 79 A 9.32 4.38 1.19 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 80 G 8.68 3.71 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 0.00 0.00 0.00 81 L 8.42 4.10 0.00 1.69 1.65 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 82 T 8.91 3.87 4.28 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 83 A 8.00 4.00 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 84 D 8.13 4.44 0.00 2.94 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 85 A 7.93 3.98 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 86 E 8.32 3.80 0.00 2.11 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 2.08 2.46 0.00 87 I 7.47 3.68 2.07 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 1.84 1.15 0.98 0.00 0.00 88 L 7.49 3.82 0.00 1.83 1.69 0.58 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.14 3.49 1.77 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.77 0.76 0.00 0.00 90 N 8.13 4.27 0.00 2.82 2.92 0.00 0.00 7.03 6.56 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 91 T 7.73 3.96 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 1.23 0.00 0.00 92 A 8.04 3.97 1.35 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 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.27 3.91 0.00 2.02 2.00 0.00 3.12 0.00 0.00 3.17 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.80 0.00 94 I 7.61 3.70 2.05 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 1.71 0.99 0.94 0.00 0.00 95 H 8.59 4.15 0.00 3.30 3.47 0.00 5.78 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 96 A 8.10 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 97 Q 7.97 4.02 0.00 2.19 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 98 N 8.53 4.33 0.00 2.93 2.88 0.00 0.00 6.62 8.21 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 99 Y 8.02 3.94 0.00 3.18 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 0.00 100 L 8.11 4.42 0.00 1.93 1.88 1.02 0.47 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 0.00 101 K 7.95 3.96 0.00 1.84 1.93 0.00 1.82 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.43 7.81 102 T 7.59 3.74 3.47 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 -0.01 0.00 0.00 103 Y 7.50 4.56 0.00 2.62 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 0.00 104 N 8.35 4.42 0.00 2.90 2.93 0.00 0.00 6.71 7.24 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 0.00 105 E 7.88 4.84 0.00 2.15 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 2.35 2.56 0.00 106 D 8.59 4.58 0.00 2.70 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 0.00 107 I 8.02 2.87 1.51 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 -0.36 0.76 0.00 0.00 108 P 0.00 4.17 0.00 2.02 1.82 0.00 2.90 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 109 V 8.52 3.48 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 0.92 0.00 0.00 0.87 0.00 0.00 110 E 7.99 3.81 0.00 1.98 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 111 I 7.35 3.67 1.78 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 1.36 0.82 0.91 0.00 0.00 112 L 7.61 3.98 0.00 1.59 1.67 0.88 0.79 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 0.00 113 V 7.54 2.97 1.86 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 0.53 0.00 0.00 -0.21 0.00 0.00 114 R 8.32 3.83 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 115 R 7.82 3.81 0.00 1.98 1.99 0.00 3.13 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 1.02 1.56 0.00 116 L 7.76 4.01 0.00 1.90 1.82 0.86 0.73 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 0.00 117 S 8.22 4.24 0.00 4.04 3.94 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 0.00 118 D 8.47 4.39 0.00 2.90 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 0.00 119 I 7.57 3.82 2.04 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 1.80 0.73 0.98 0.00 0.00 120 K 8.04 4.25 0.00 2.10 1.94 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.48 1.56 7.81 121 Q 8.60 4.20 0.00 2.22 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 122 G 8.24 3.71 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 0.00 0.00 0.00 123 Y 7.85 4.04 0.00 3.14 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 0.00 124 T 7.90 4.32 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 1.14 0.00 0.00 125 Q 7.84 4.46 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.66 0.00 0.00 0.00 0.00 0.00 2.25 2.20 0.00 126 H 7.68 4.77 0.00 3.17 3.19 0.00 5.74 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 0.00 127 G 8.92 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 0.00 128 G 7.83 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 0.00 0.00 0.00 129 L 6.88 4.72 0.00 1.72 1.58 0.82 0.81 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 0.00 130 R 8.14 4.11 0.00 1.90 1.92 0.00 3.00 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 131 P 0.00 4.51 0.00 2.07 2.07 0.00 3.66 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 132 F 8.37 4.32 0.00 2.87 2.85 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 0.00 133 G 8.81 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 0.00 0.00 0.00 134 V 7.24 4.84 1.74 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 -0.31 0.00 0.00 0.79 0.00 0.00 135 S 8.41 4.61 0.00 3.70 3.62 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 0.00 136 F 8.72 5.41 0.00 2.44 1.86 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 0.00 137 I 8.31 4.51 1.88 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 1.26 0.73 0.95 0.00 0.00 138 Y 8.90 5.06 0.00 2.78 2.85 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 0.00 139 A 9.38 4.74 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 0.00 140 G 8.52 4.97 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 0.00 0.00 0.00 141 Y 8.41 4.99 0.00 2.97 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 0.00 142 D 7.49 4.65 0.00 2.60 2.42 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 0.00 143 D 8.48 4.49 0.00 2.82 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 R 8.32 4.09 0.00 1.64 1.84 0.00 3.23 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00