NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.1807 8.3349 115.2884 59.2214 62.5043 172.3470 2 Q 2.8198 8.5504 124.2711 57.5158 28.4611 174.9202 3 L 4.6876 8.1944 116.6436 54.6863 42.9966 177.4434 4 T 4.1667 8.5969 113.5561 61.1088 70.7625 175.5030 5 K 3.9043 8.4884 119.7509 60.0095 32.0445 179.2231 6 D 4.3752 8.1301 118.3442 57.3882 40.7157 178.6443 7 E 4.0128 8.6908 119.4367 59.4585 29.4182 179.4456 8 I 3.6427 8.0365 119.8202 64.5514 37.1963 178.0108 9 E 3.8853 8.4053 119.6690 59.8423 29.1848 179.6918 10 E 3.9253 8.3620 118.1620 59.3559 29.5823 179.5068 11 V 3.3904 7.7784 118.3824 66.1669 31.5376 177.3439 12 R 3.8962 8.7654 118.5721 60.2433 29.8916 177.8008 13 E 3.8542 8.5953 117.0734 59.9386 29.6172 179.8287 14 V 3.7224 7.9207 117.5899 66.1336 31.6466 177.7861 15 F 4.1675 8.8226 120.5958 61.6971 39.1067 176.6357 16 D 5.1504 8.8851 119.7861 56.9019 40.7167 178.4128 17 L 3.9335 7.7968 120.1988 58.5285 41.7330 179.2484 18 F 4.1367 8.0323 116.0741 60.6093 39.1044 177.3132 19 D 4.4815 8.1814 118.7486 55.9484 38.9616 178.2329 20 F 3.7275 8.7247 123.3831 60.9939 39.2623 176.9260 21 W 4.3728 8.1955 117.0197 58.2424 28.8735 176.4146 22 D 4.8656 7.5539 117.4685 52.9599 39.2495 177.1093 23 G 3.9556 8.5060 111.1422 46.5840 0.0000 171.1792 24 R 4.0699 6.7489 123.0490 56.5909 29.1093 174.8255 25 D 4.6624 8.4671 119.1938 52.3420 40.8492 177.4485 26 G 4.1240 9.1825 108.2191 45.9353 0.0000 172.9955 27 D 5.4593 8.9490 118.6151 52.4329 44.5168 175.4304 28 V 4.6534 8.5747 120.1964 61.0137 35.4264 173.9018 29 D 4.9207 8.7935 125.3032 53.6689 42.0708 176.6712 30 A 4.1637 8.7408 127.9491 55.6534 18.0159 179.5088 31 A 4.5197 8.9743 120.5842 54.7461 18.3647 179.3197 32 K 4.1989 8.5249 114.3709 57.2288 32.0500 179.3151 33 V 3.6359 8.4171 121.6296 65.6944 31.2737 178.1418 34 G 3.5015 7.6063 106.0077 47.7425 0.0000 175.0409 35 D 4.4219 8.1019 121.5157 56.9018 41.0538 178.4383 36 L 3.1517 7.4060 120.2896 58.4326 41.9247 178.9449 37 L 4.0071 7.8417 118.3140 58.3376 41.5026 180.0629 38 R 4.6770 8.1320 119.1215 58.9106 29.7689 178.6845 39 C 4.3960 8.2262 115.6809 62.0628 28.2634 175.5445 40 L 4.2380 7.5136 119.7730 56.1859 41.3191 176.6436 41 G 3.5672 7.0016 105.9379 45.3340 0.0000 173.6920 42 M 4.5383 8.0375 121.1575 54.5689 33.3828 175.5050 43 N 5.0841 8.1291 116.5327 51.0761 39.4015 172.2233 44 P 4.9853 0.0000 0.0000 61.8649 33.5460 177.3999 45 T 4.3905 9.6590 112.1129 60.8880 71.3479 175.8471 46 E 3.9019 9.6052 122.3823 59.5722 29.4547 179.4389 47 A 4.0379 8.0261 120.2696 55.4960 18.5958 179.2852 48 Q 3.8894 7.9610 116.2625 59.4966 28.8663 180.0891 49 V 3.6465 7.8703 118.6885 66.3186 31.6314 177.8215 50 H 4.2499 8.5439 116.3268 58.9285 28.4403 177.5133 51 Q 4.3774 8.4548 117.9923 57.7833 28.4591 176.6612 52 H 4.8578 7.4846 115.4518 55.6898 29.6518 173.7647 53 G 4.2623 7.8462 111.3991 46.6388 0.0000 175.9470 54 G 3.7431 7.9638 109.1682 46.3652 0.0000 173.1393 55 T 4.5204 8.2615 114.2824 60.1624 71.0463 175.3360 56 K 4.0149 8.4262 122.5271 58.6795 32.7226 177.7246 57 K 4.3694 7.6656 115.9772 56.8187 34.0336 175.5995 58 M 4.7162 8.0085 115.7055 55.2558 32.9067 177.1410 59 G 3.8671 7.9050 105.7697 45.8072 0.0000 174.0392 60 E 3.4321 7.4819 115.3900 59.4593 30.2684 176.5673 61 K 4.7082 7.6978 117.6170 54.8108 36.8338 174.6410 62 A 5.1373 8.1869 124.1882 50.3573 22.3017 174.8987 63 Y 5.2160 8.7434 115.6342 55.8008 42.2419 176.5455 64 K 4.9055 9.1411 124.4944 54.9137 35.1212 177.8691 65 L 2.8705 7.9781 120.0004 58.1377 41.7406 178.3172 66 E 4.0837 7.9174 115.8341 58.0984 29.2055 177.8886 67 E 4.3003 7.8477 118.5267 58.3480 30.3384 178.2378 68 I 3.3893 7.2518 118.7136 63.9523 37.1219 178.0608 69 L 3.9986 7.7950 120.3092 57.6442 41.6026 178.0730 70 P 4.3618 0.0000 0.0000 65.3496 31.2140 178.5664 71 I 3.6224 7.1279 119.8768 64.5874 37.1127 177.2161 72 Y 4.2831 8.4689 120.9385 60.9884 38.2931 178.0020 73 E 4.4078 7.8163 117.6230 57.4831 30.1169 178.4465 74 E 3.9970 8.1290 120.2420 59.5840 29.5161 178.3377 75 M 3.9488 8.2615 118.6734 58.9550 32.1515 177.8294 76 S 4.4193 7.7485 111.1779 59.2155 62.9527 175.3655 77 S 4.3815 9.3394 118.1574 58.6131 63.1527 174.0788 78 K 4.3274 7.1021 123.1937 56.2920 32.6854 176.2270 79 D 4.6527 8.2702 116.3438 54.5089 44.7042 176.1800 80 T 4.4163 7.6520 115.0030 60.6670 66.1918 174.0647 81 G 3.6460 7.5649 111.4897 46.5453 0.0000 173.0191 82 T 3.2619 8.3777 114.2727 65.0933 67.7526 171.4139 83 A 4.5094 7.8916 128.4983 50.7301 21.6623 177.1208 84 A 4.2045 8.5914 118.2983 55.7443 18.5754 179.3632 85 D 4.4833 8.1632 117.0024 58.0403 40.3759 179.4031 86 E 3.8940 8.0566 117.9829 59.3791 29.2948 179.1629 87 F 4.7581 7.7264 117.5381 59.9135 39.0516 177.8686 88 M 4.2917 9.0403 118.9567 58.9212 31.7567 178.0776 89 E 3.9633 8.3439 118.3673 59.2764 29.3179 179.1315 90 A 3.8326 7.3226 120.3528 54.5232 19.0211 179.3232 91 F 4.3387 7.7977 116.7065 60.4946 38.9005 177.8033 92 K 3.8509 8.1533 118.3029 59.9788 31.6346 178.7114 93 T 3.7073 7.0625 111.8437 65.1162 67.0776 174.9803 94 F 4.8189 8.2390 117.8195 57.4945 40.3714 175.8248 95 D 4.6989 8.3096 118.8784 54.0550 39.5071 176.5375 96 R 3.9777 8.7475 124.3585 59.0425 30.1958 177.9752 97 E 4.4178 8.2775 112.8005 55.7832 30.0262 175.9160 98 G 3.8841 8.0012 106.1200 47.2224 0.0000 174.8709 99 Q 4.3699 8.6963 118.4897 57.2378 31.5330 176.3076 100 G 3.8884 7.9890 106.3475 44.5301 0.0000 172.6080 101 L 5.2154 7.7328 118.8976 52.8826 44.5602 176.1209 102 I 4.7308 8.6159 122.0140 59.6070 42.0344 174.5595 103 S 4.7199 9.3110 121.1979 58.3644 62.9432 175.2900 104 S 4.2049 8.7338 119.4372 61.0134 63.2825 176.2487 105 A 3.9410 8.0155 123.8955 55.0340 17.9291 179.3782 106 E 3.8540 8.2161 116.9400 59.5236 29.7513 179.2302 107 I 3.6491 7.5893 119.7008 64.5816 37.1359 178.6826 108 R 4.0691 8.4109 119.1446 59.2609 29.8253 178.8517 109 N 4.2755 7.9485 116.1030 56.4205 38.4807 177.1692 110 V 3.4984 8.1133 119.7214 66.3428 31.5477 177.9883 111 L 3.9378 8.5233 118.7716 57.3799 41.2450 179.4533 112 K 4.4850 8.3513 118.8338 57.9011 32.7370 178.4986 113 M 4.2538 8.4721 118.2291 56.3041 32.3942 176.5555 114 L 4.5781 7.5539 117.2910 53.3870 44.4672 177.7377 115 G 3.8018 8.3979 108.0580 45.2257 0.0000 173.1010 116 E 4.0330 8.7489 120.2558 56.3161 28.7773 176.5471 117 R 4.0610 8.2505 122.8399 56.2434 31.1596 176.1095 118 I 4.7468 8.1424 121.0074 59.5262 40.9834 175.6329 119 T 3.9785 9.7027 122.7964 63.6107 69.5037 175.3687 120 E 3.8549 8.9604 124.0173 59.6047 29.6754 178.3385 121 D 4.2986 8.1177 117.4173 57.8395 41.2710 177.9891 122 Q 3.9728 8.1919 117.6579 59.3730 28.6331 179.1889 123 C 4.1584 8.0739 117.4455 62.8736 28.2590 175.6826 124 N 4.3298 8.1688 118.0060 56.5195 38.0949 177.0111 125 D 3.6512 8.1621 120.2143 57.3251 40.5216 178.6388 126 I 3.7580 7.7032 118.8382 64.3268 37.7013 177.8155 127 F 4.2164 8.1390 118.4319 60.2547 38.7447 177.8133 128 T 3.9762 7.8034 115.5724 66.2424 68.2011 177.0489 129 F 4.6087 8.1581 119.0267 60.0467 38.9838 176.6849 130 C 4.3065 7.7422 114.3508 58.9859 29.6378 172.1569 131 D 4.3018 7.6948 117.4348 54.9934 38.5249 174.1271 132 I 4.5118 7.6316 118.9279 59.7526 39.7457 176.1220 133 R 4.6717 8.5116 123.9985 54.1429 32.9677 175.0205 134 E 5.3942 8.2559 116.6602 54.0666 32.1836 174.7872 135 D 4.7609 8.2392 118.7827 54.0603 45.4925 176.6990 136 I 3.2885 7.4131 121.0811 61.1201 39.2511 177.4345 137 D 4.8673 8.7662 126.5590 52.7988 40.6984 174.3539 138 G 4.2381 9.2071 111.0075 42.4811 0.0000 170.9601 139 N 4.2509 8.5028 119.9151 55.7981 40.6328 177.0077 140 I 4.6363 6.8115 127.2979 59.8673 41.1339 174.4916 141 K 4.5096 8.5254 125.7511 56.4610 32.6177 177.6516 142 Y 3.8977 8.0657 124.6985 59.1425 38.1339 177.6651 143 E 3.9636 7.5514 121.2474 59.2521 29.8859 177.2745 144 D 4.2533 8.0612 117.2951 57.9207 41.0802 178.0201 145 L 3.8506 7.6909 119.2045 58.4967 41.8850 179.0088 146 M 3.9512 7.7565 117.4083 58.5171 32.1042 178.0203 147 K 3.8846 8.2322 117.8906 59.6643 32.5734 179.2139 148 K 4.0939 8.0775 118.2352 59.4192 32.2050 179.4667 149 V 3.5525 7.6348 118.4883 66.3944 31.2354 177.4050 150 M 4.3565 8.1847 114.6456 56.3489 31.8977 177.1548 151 A 4.4994 8.2984 121.0349 50.8047 20.3571 178.0229 152 G 4.0418 7.1747 102.4870 44.8421 0.0000 172.1947 153 P 3.9519 0.0000 0.0000 64.6927 31.3078 176.8866 154 F 4.5129 7.2635 117.9459 53.8707 37.9006 173.3888 155 P 3.7908 0.0000 0.0000 66.7115 31.6263 176.2362 156 D 4.5673 8.5499 125.0849 55.2262 40.6782 176.6033 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 S 8.33 4.18 0.00 3.83 3.88 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 0.00 0.00 0.00 2 Q 8.55 2.82 0.00 2.23 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.66 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 3 L 8.19 4.69 0.00 1.68 1.76 1.15 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.60 4.17 4.26 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 1.33 0.00 0.00 5 K 8.49 3.90 0.00 1.82 1.91 0.00 1.68 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.54 7.81 6 D 8.13 4.38 0.00 2.70 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 7 E 8.69 4.01 0.00 2.20 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 0.00 2.39 2.50 0.00 8 I 8.04 3.64 1.99 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.01 0.89 0.00 0.00 9 E 8.41 3.89 0.00 2.15 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 2.34 2.57 0.00 10 E 8.36 3.93 0.00 2.22 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 2.33 2.50 0.00 11 V 7.78 3.39 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 0.82 0.00 0.00 0.56 0.00 0.00 12 R 8.77 3.90 0.00 2.00 2.12 0.00 3.22 0.00 0.00 3.20 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.74 0.00 13 E 8.60 3.85 0.00 2.24 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 2.36 2.65 0.00 14 V 7.92 3.72 2.30 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 1.34 0.00 0.00 0.99 0.00 0.00 15 F 8.82 4.17 0.00 3.24 3.27 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 0.00 16 D 8.89 5.15 0.00 2.88 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 17 L 7.80 3.93 0.00 1.77 1.77 0.96 0.61 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 18 F 8.03 4.14 0.00 3.12 3.08 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 19 D 8.18 4.48 0.00 2.93 2.47 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 0.00 20 F 8.72 3.73 0.00 3.04 3.05 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 21 W 8.20 4.37 0.00 3.38 3.34 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 22 D 7.55 4.87 0.00 2.70 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 23 G 8.51 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 24 R 6.75 4.07 0.00 1.64 1.70 0.00 3.20 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 25 D 8.47 4.66 0.00 2.74 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 26 G 9.18 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 0.00 0.00 0.00 27 D 8.95 5.46 0.00 2.57 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 28 V 8.57 4.65 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 0.96 0.00 0.00 0.49 0.00 0.00 29 D 8.79 4.92 0.00 2.80 2.56 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 30 A 8.74 4.16 1.40 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 0.00 0.00 31 A 8.97 4.52 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.52 4.20 0.00 1.84 1.78 0.00 1.94 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.54 1.75 7.81 33 V 8.42 3.64 2.16 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 0.99 0.00 0.00 1.18 0.00 0.00 34 G 7.61 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 0.00 0.00 0.00 35 D 8.10 4.42 0.00 2.73 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 36 L 7.41 3.15 0.00 0.64 1.42 0.85 1.01 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 37 L 7.84 4.01 0.00 2.02 1.77 0.96 1.17 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 38 R 8.13 4.68 0.00 2.09 2.03 0.00 3.17 0.00 0.00 3.30 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 39 C 8.23 4.40 0.00 3.31 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 40 L 7.51 4.24 0.00 1.83 1.68 -0.02 0.64 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 41 G 7.00 3.57 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 0.00 42 M 8.04 4.54 0.00 2.14 2.25 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.56 0.00 43 N 8.13 5.08 0.00 2.70 2.75 0.00 0.00 6.87 8.02 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 44 P 0.00 4.99 0.00 2.15 2.03 0.00 3.78 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 1.95 1.94 0.00 45 T 9.66 4.39 4.55 0.00 0.00 0.00 0.00 0.00 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 46 E 9.61 3.90 0.00 2.18 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 2.35 2.53 0.00 47 A 8.03 4.04 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 48 Q 7.96 3.89 0.00 2.35 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 49 V 7.87 3.65 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 0.96 0.00 0.00 0.90 0.00 0.00 50 H 8.54 4.25 0.00 3.35 3.36 0.00 5.68 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 51 Q 8.45 4.38 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.26 0.00 0.00 0.00 0.00 0.00 2.44 2.64 0.00 52 H 7.48 4.86 0.00 3.11 3.25 0.00 5.83 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 53 G 7.85 4.26 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 0.00 54 G 7.96 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 55 T 8.26 4.52 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 1.27 0.00 0.00 56 K 8.43 4.01 0.00 1.78 1.89 0.00 1.71 0.00 0.00 1.82 0.00 0.00 3.20 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.51 7.81 57 K 7.67 4.37 0.00 1.91 1.86 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.48 7.81 58 M 8.01 4.72 0.00 2.03 2.16 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 2.55 2.44 0.00 59 G 7.90 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 60 E 7.48 3.43 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 2.33 2.35 0.00 61 K 7.70 4.71 0.00 1.66 1.42 0.00 1.38 0.00 0.00 1.50 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.73 1.15 7.81 62 A 8.19 5.14 1.14 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 63 Y 8.74 5.22 0.00 3.06 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 64 K 9.14 4.91 0.00 1.83 1.80 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.52 7.81 65 L 7.98 2.87 0.00 0.82 1.30 0.12 0.75 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 66 E 7.92 4.08 0.00 1.92 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 2.39 0.00 67 E 7.85 4.30 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 2.40 2.43 0.00 68 I 7.25 3.39 1.75 0.00 0.00 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 1.48 0.48 0.88 0.00 0.00 69 L 7.80 4.00 0.00 1.66 1.75 0.88 0.82 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 70 P 0.00 4.36 0.00 2.22 2.28 0.00 3.64 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 2.11 2.00 0.00 71 I 7.13 3.62 1.95 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.64 0.93 0.00 0.00 72 Y 8.47 4.28 0.00 2.90 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 73 E 7.82 4.41 0.00 2.01 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 2.25 2.14 0.00 74 E 8.13 4.00 0.00 2.04 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 2.64 2.40 0.00 75 M 8.26 3.95 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.63 0.00 76 S 7.75 4.42 0.00 3.85 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 77 S 9.34 4.38 0.00 4.09 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 78 K 7.10 4.33 0.00 1.62 1.69 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.51 7.81 79 D 8.27 4.65 0.00 2.62 2.58 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 0.00 80 T 7.65 4.42 4.20 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 1.18 0.00 0.00 81 G 7.56 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 82 T 8.38 3.26 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 -0.05 0.00 0.00 83 A 7.89 4.51 1.20 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 0.00 0.00 84 A 8.59 4.20 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 85 D 8.16 4.48 0.00 2.66 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 86 E 8.06 3.89 0.00 1.72 1.71 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 2.28 2.27 0.00 87 F 7.73 4.76 0.00 3.31 3.05 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 88 M 9.04 4.29 0.00 2.21 2.32 0.00 0.00 0.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.77 0.00 89 E 8.34 3.96 0.00 2.02 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 2.58 2.48 0.00 90 A 7.32 3.83 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 91 F 7.80 4.34 0.00 2.86 1.80 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 92 K 8.15 3.85 0.00 1.94 1.92 0.00 1.77 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.56 1.68 7.81 93 T 7.06 3.71 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 0.60 0.00 0.00 94 F 8.24 4.82 0.00 3.21 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 95 D 8.31 4.70 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 96 R 8.75 3.98 0.00 1.90 2.04 0.00 3.29 0.00 0.00 3.27 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.76 0.00 97 E 8.28 4.42 0.00 1.98 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 2.27 2.32 0.00 98 G 8.00 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.70 4.37 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 100 G 7.99 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 101 L 7.73 5.22 0.00 1.52 1.56 0.90 0.72 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 0.00 102 I 8.62 4.73 2.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.27 0.97 0.00 0.00 103 S 9.31 4.72 0.00 3.90 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 0.00 104 S 8.73 4.20 0.00 3.80 3.88 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 0.00 0.00 0.00 105 A 8.02 3.94 1.31 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 0.00 0.00 106 E 8.22 3.85 0.00 2.18 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 2.32 2.35 0.00 107 I 7.59 3.65 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 1.56 0.75 1.13 0.00 0.00 108 R 8.41 4.07 0.00 1.86 2.00 0.00 3.06 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.81 0.00 109 N 7.95 4.28 0.00 2.97 2.82 0.00 0.00 6.63 7.59 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 0.00 110 V 8.11 3.50 2.12 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 1.04 0.00 0.00 0.18 0.00 0.00 111 L 8.52 3.94 0.00 1.71 1.71 0.91 0.64 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 0.00 112 K 8.35 4.48 0.00 1.74 1.86 0.00 1.73 0.00 0.00 1.56 0.00 0.00 3.03 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.57 1.44 7.81 113 M 8.47 4.25 0.00 1.95 2.30 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 2.70 2.75 0.00 114 L 7.55 4.58 0.00 1.75 1.61 1.03 1.25 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 0.00 115 G 8.40 3.80 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 0.00 0.00 0.00 116 E 8.75 4.03 0.00 1.99 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 2.33 2.35 0.00 117 R 8.25 4.06 0.00 1.70 2.10 0.00 3.56 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 118 I 8.14 4.75 2.14 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 0.81 0.95 0.00 0.00 119 T 9.70 3.98 4.36 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 1.26 0.00 0.00 120 E 8.96 3.85 0.00 2.07 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 0.00 2.37 2.42 0.00 121 D 8.12 4.30 0.00 2.74 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 0.00 122 Q 8.19 3.97 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 2.47 2.48 0.00 123 C 8.07 4.16 0.00 3.22 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 0.00 124 N 8.17 4.33 0.00 2.84 2.81 0.00 0.00 7.10 7.35 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 0.00 125 D 8.16 3.65 0.00 2.69 2.32 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 0.00 126 I 7.70 3.76 1.81 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.03 0.75 0.00 0.00 127 F 8.14 4.22 0.00 3.45 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 0.00 128 T 7.80 3.98 3.82 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 0.00 0.00 1.17 0.00 0.00 129 F 8.16 4.61 0.00 2.96 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 0.00 130 C 7.74 4.31 0.00 2.93 2.96 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 0.00 131 D 7.69 4.30 0.00 2.96 2.78 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 0.00 132 I 7.63 4.51 2.18 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 1.33 0.74 1.14 0.00 0.00 133 R 8.51 4.67 0.00 1.74 1.78 0.00 3.31 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 134 E 8.26 5.39 0.00 2.03 1.80 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 2.09 2.15 0.00 135 D 8.24 4.76 0.00 2.63 2.57 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 0.00 136 I 7.41 3.29 1.85 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 1.17 0.57 0.90 0.00 0.00 137 D 8.77 4.87 0.00 2.57 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 0.00 138 G 9.21 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 0.00 0.00 0.00 0.00 139 N 8.50 4.25 0.00 2.65 2.21 0.00 0.00 6.76 7.32 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 0.00 140 I 6.81 4.64 2.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.84 1.02 0.00 0.00 141 K 8.53 4.51 0.00 1.63 1.58 0.00 1.76 0.00 0.00 1.81 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.37 7.81 142 Y 8.07 3.90 0.00 1.72 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 0.00 143 E 7.55 3.96 0.00 1.94 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 2.39 2.43 0.00 144 D 8.06 4.25 0.00 2.68 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 0.00 145 L 7.69 3.85 0.00 1.75 1.71 0.40 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 146 M 7.76 3.95 0.00 2.38 2.21 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.68 0.00 147 K 8.23 3.88 0.00 1.84 1.89 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.52 1.59 7.81 148 K 8.08 4.09 0.00 1.78 1.82 0.00 1.59 0.00 0.00 1.80 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.43 7.81 149 V 7.63 3.55 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 0.92 0.00 0.00 0.83 0.00 0.00 150 M 8.18 4.36 0.00 2.08 2.27 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.68 0.00 151 A 8.30 4.50 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 0.00 152 G 7.17 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 0.00 153 P 0.00 3.95 0.00 0.91 1.72 0.00 3.71 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.89 0.00 154 F 7.26 4.51 0.00 3.12 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 0.00 155 P 0.00 3.79 0.00 2.04 1.94 0.00 3.67 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 2.22 0.00 156 D 8.55 4.57 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