NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9774 8.3549 109.7396 45.1439 0.0000 173.0545 2 L 4.0535 8.0021 118.7340 51.9156 42.3322 176.1668 3 S 4.4728 9.7124 118.4171 58.0959 66.0036 174.9290 4 D 4.6517 8.7368 121.8753 57.6824 40.5338 179.3859 5 G 3.6574 8.0906 105.6691 47.4410 0.0000 175.6567 6 E 4.1236 8.0214 122.1486 58.7459 29.4628 179.2533 7 W 4.5344 8.1962 119.1163 59.8854 29.0083 178.3067 8 Q 4.0615 8.4599 119.4235 59.4492 28.6833 178.3733 9 Q 4.0856 8.1414 119.0241 58.9527 28.7589 179.0871 10 V 3.8832 7.9095 119.1335 66.3081 31.6912 178.1952 11 L 4.2578 8.6039 119.0511 57.4230 41.2119 178.8689 12 N 4.3519 8.5111 117.2546 56.8500 39.2228 177.0126 13 V 3.7534 7.9974 120.5064 64.5543 31.3913 177.9136 14 W 3.9909 8.5980 129.1708 60.1490 30.2248 177.8275 15 G 3.8287 8.3394 105.7197 48.1437 0.0000 175.7053 16 K 3.8443 7.5207 119.1181 58.8881 32.1965 179.3124 17 V 2.8932 7.0964 118.8498 65.6087 30.9646 177.9366 18 E 3.8908 7.3858 117.1342 59.0669 29.3662 178.7255 19 A 4.2086 7.7600 118.8797 53.5353 20.1121 177.4538 20 D 4.6600 7.6901 114.5300 52.4605 43.5936 175.6573 21 I 3.6598 7.8333 125.0796 64.0153 37.7212 177.4418 22 A 4.1890 7.4955 122.5503 54.5272 18.2986 179.7963 23 G 3.8065 8.2127 105.4554 47.7855 0.0000 175.6012 24 H 4.1798 8.2967 119.1048 58.5039 28.7451 178.1033 25 G 3.5975 8.3367 107.6425 47.8481 0.0000 175.8541 26 Q 3.8932 8.1015 120.3949 58.7076 28.7982 178.4574 27 E 3.8929 7.8763 119.1049 59.3615 29.4465 179.5424 28 V 3.5398 7.9148 118.2668 66.1144 31.5201 178.1062 29 L 3.4524 7.6117 118.3629 57.6137 41.3335 179.5666 30 I 3.6710 7.6210 119.7143 64.2155 36.9448 178.3708 31 R 3.7925 7.9238 119.4721 59.2658 29.8893 178.0736 32 L 3.9093 7.7690 120.0302 58.5236 41.7609 179.1466 33 F 4.6023 8.0300 118.0931 60.6351 38.5620 177.9133 34 T 4.1558 8.1188 109.2608 64.7019 68.8624 176.9270 35 G 3.6788 8.1169 107.8717 46.3874 0.0000 173.6312 36 H 4.7036 8.2066 117.8127 51.7057 29.9418 171.6828 37 P 4.5230 0.0000 0.0000 64.6827 31.3293 177.4812 38 E 4.5078 8.5208 117.3302 58.9620 29.4694 179.1764 39 T 3.6845 7.9874 110.9890 64.4725 68.8108 176.3299 40 L 3.6791 8.0239 122.9439 57.7032 41.8629 178.5929 41 E 4.0661 8.0391 118.6224 58.8620 29.1091 178.9118 42 K 4.2784 7.9241 116.8017 57.0953 33.1382 177.3300 43 F 4.2260 7.8649 119.2923 55.1980 37.7996 175.7543 44 D 4.3749 8.3103 125.4762 57.1112 41.0120 178.7274 45 K 4.2293 7.8599 117.5167 59.0712 32.5346 177.9312 46 F 5.0580 7.8229 112.0222 56.5781 38.7162 176.3019 47 K 4.0778 8.1413 121.3992 59.7132 32.4730 177.4717 48 H 4.4423 8.1665 114.6469 57.6085 29.0889 175.9410 49 L 4.1012 7.3085 119.9353 54.8462 41.9245 176.8383 50 K 4.4587 9.4326 121.0268 56.5008 34.7618 177.0491 51 T 4.7250 7.5877 107.4380 59.1617 72.9335 174.4338 52 E 3.9183 8.6023 121.5072 59.3001 29.6905 178.7072 53 A 3.9794 7.9671 120.4466 55.1652 18.4100 179.2958 54 E 3.8723 8.1159 116.8541 59.7713 29.3278 179.3876 55 M 3.9595 7.8506 117.4163 58.5221 32.1422 178.7472 56 K 4.0421 8.1756 117.3245 59.3225 32.2584 179.0274 57 A 4.2223 7.8066 120.0707 53.2873 18.7246 177.5814 58 S 4.1395 7.3391 113.3123 58.0131 62.9507 174.6750 59 E 3.9544 8.8861 128.1943 59.4905 29.3294 178.6992 60 D 4.4334 8.0941 118.4892 57.4366 40.8605 178.5884 61 L 3.1570 7.6293 120.6843 57.8030 41.9715 178.9273 62 K 3.8535 7.7397 119.0797 59.4045 32.0909 178.9604 63 K 4.0137 8.1823 118.8724 59.3344 31.9853 179.5763 64 V 3.8217 8.1214 118.7525 66.0271 31.5489 178.1984 65 G 3.7357 8.3814 105.7357 48.2365 0.0000 175.7950 66 T 3.9331 7.9892 117.8570 66.4695 68.4999 177.0723 67 R 3.9986 8.0854 120.0321 59.1881 30.1188 179.2139 68 V 3.6467 7.9671 117.8640 66.3019 31.5525 178.2162 69 L 4.2974 8.0367 118.5597 57.8840 41.4399 179.7546 70 T 3.9695 8.1865 115.7443 66.6244 68.4751 176.5234 71 A 4.0004 8.0678 122.6895 54.9704 18.3141 179.4188 72 L 3.5730 8.0793 118.9345 58.0639 42.1647 179.0945 73 G 3.3437 8.1451 106.0708 47.7618 0.0000 175.4865 74 G 3.6693 7.7611 106.8096 47.5917 0.0000 175.4760 75 I 3.8146 7.4538 122.2616 64.0305 37.1628 178.5771 76 L 3.9589 7.8156 120.1196 57.7099 41.1707 179.7508 77 K 3.9510 7.6490 117.0998 58.7267 32.2344 178.8302 78 K 3.9449 7.6813 117.5753 56.0413 32.2275 176.9138 79 K 2.0000 8.1309 117.7097 56.2818 29.7015 176.1545 80 G 3.9899 8.0278 107.4233 45.8237 0.0000 174.4217 81 H 4.5104 7.4402 118.9562 55.3596 27.6465 174.9665 82 H 5.2589 7.1270 109.9681 54.4583 29.8416 176.7995 83 E 3.9891 8.3931 123.1804 60.1260 29.2045 178.0600 84 A 4.0483 7.9245 119.5979 55.1490 18.5326 178.9443 85 E 4.1104 8.1198 116.6908 59.1894 29.6607 178.9075 86 L 4.0893 8.1779 120.4780 57.5316 42.2425 178.6165 87 K 3.8720 7.9723 118.7715 59.3920 32.1048 177.3166 88 P 4.3512 0.0000 0.0000 65.4862 31.2820 178.2619 89 L 3.9877 7.4887 117.2591 58.0176 42.1882 178.5354 90 A 4.1027 8.3497 121.1822 55.2709 17.9499 179.2731 91 Q 3.9408 8.0324 117.7694 59.5449 29.1648 178.8468 92 S 4.1542 8.1671 115.2283 61.6543 63.1416 175.5956 93 H 4.3398 8.6019 118.2688 56.9295 28.4769 176.3547 94 A 3.4903 7.7292 121.1716 52.0640 19.4633 176.3567 95 T 4.1287 6.9885 102.8998 63.0009 71.1152 175.8480 96 K 3.8770 7.7111 123.5689 58.6362 32.5518 177.8488 97 H 4.3250 7.8427 114.0672 55.7062 29.6035 175.6353 98 K 2.6336 7.3018 116.5542 56.8430 28.7388 174.2781 99 I 4.3181 7.7606 117.7217 58.7638 38.1675 174.8323 100 P 4.4997 0.0000 0.0000 62.3343 32.0656 177.8615 101 I 3.7182 8.6543 122.4836 64.4504 36.8739 178.6904 102 K 3.6512 7.8914 119.9843 59.8506 31.9152 178.2543 103 Y 4.0253 7.7739 116.5050 60.8057 37.7288 178.2373 104 L 4.2191 7.8703 119.7688 57.3986 41.7859 178.8348 105 E 3.9557 8.1637 119.5091 59.3180 29.6028 178.6726 106 F 4.4525 8.0564 117.8551 61.0259 39.0455 177.6631 107 I 3.8727 8.2163 117.9412 63.8926 37.7604 177.9848 108 S 4.2422 8.2650 116.3537 61.9370 62.6737 176.4549 109 D 4.4884 8.2912 121.1110 57.2826 40.5309 178.7615 110 A 4.0348 8.1223 121.4263 55.1092 18.3689 179.8001 111 I 3.6923 7.9985 118.2736 64.6172 37.2502 178.6320 112 I 3.8558 7.9089 120.5987 64.7529 37.0130 177.7747 113 H 4.1533 8.5495 119.1550 59.5333 29.6811 177.4374 114 V 3.5533 7.9671 119.8213 65.8969 31.2777 177.9911 115 L 3.8057 7.9284 118.8515 57.9181 41.0840 179.0212 116 H 4.5719 8.0431 117.3848 59.3657 29.9214 177.0169 117 S 4.0967 7.9468 114.1760 60.8432 62.2825 175.5134 118 K 4.1590 7.8231 119.5642 57.2245 33.7840 176.6944 119 H 5.0325 8.1677 115.3780 53.7853 29.5137 172.8105 120 P 4.4322 0.0000 0.0000 65.7970 31.7149 179.0719 121 G 3.7904 8.1188 105.8259 47.1121 0.0000 173.5475 122 D 4.9598 8.1225 118.6725 53.9572 41.7395 177.2565 123 F 5.0001 8.0817 120.1191 56.2530 39.9711 173.5884 124 G 3.8823 7.6965 110.3312 43.4964 0.0000 171.5652 125 A 3.8484 8.4723 120.8401 55.7238 18.1115 179.7187 126 D 4.2311 7.9457 116.2380 57.3171 40.9168 178.7309 127 A 3.9917 7.7596 120.8856 55.0106 18.3394 179.4572 128 Q 3.2564 7.7106 116.9517 58.8984 28.7296 179.4356 129 G 3.4758 7.8232 105.9890 47.4375 0.0000 175.6331 130 A 3.8551 7.9635 123.0687 55.2748 18.3900 179.4571 131 M 4.0768 8.3292 116.8880 58.9914 32.3624 178.3447 132 T 3.9119 8.1903 116.1686 66.7534 68.6757 176.6409 133 K 4.0667 8.0802 119.9266 59.2922 32.0528 179.2579 134 A 3.8608 7.8680 120.9813 55.2973 18.3494 179.7977 135 L 4.1688 8.2332 117.4739 57.7542 41.5389 179.6077 136 E 4.0000 8.3563 118.9050 59.1169 29.3308 178.8014 137 L 3.9537 8.0047 120.4030 58.2609 42.1535 178.5636 138 F 4.1955 8.2853 120.2681 61.6993 39.2419 177.2086 139 R 3.4561 8.0052 117.2916 59.0696 29.8837 178.5904 140 N 4.1833 8.3242 116.9704 56.8937 38.9051 176.7322 141 D 4.3138 8.1923 120.3287 57.2065 40.8619 178.7692 142 I 3.3487 7.4351 120.1311 64.2028 37.1158 178.1999 143 A 3.7233 7.9139 121.6253 55.0409 17.9055 179.5240 144 A 3.9423 7.8132 119.1140 55.2726 18.3676 180.0962 145 K 3.9003 7.8726 116.7234 59.5776 32.1054 178.8900 146 Y 4.5143 8.3935 117.6849 61.3038 37.8516 178.7917 147 K 3.8962 7.9976 119.5623 59.7463 32.0752 178.5301 148 E 4.0016 7.5087 116.7424 59.4452 29.5720 178.9297 149 L 4.3130 8.0412 116.1190 55.2125 41.7222 177.7288 150 G 3.7903 8.0208 107.2422 45.8012 0.0000 172.9728 151 F 4.7290 8.0992 121.9337 55.8499 40.1818 175.3987 152 Q 3.9329 8.2978 130.4720 55.0085 28.0836 175.7250 153 G 3.0525 7.9169 113.4495 45.3017 0.0000 171.8158 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 G 8.35 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 2 L 8.00 4.05 0.00 0.55 0.88 0.42 -0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.71 4.47 0.00 4.03 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 4 D 8.74 4.65 0.00 2.77 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 5 G 8.09 3.66 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 0.00 0.00 0.00 6 E 8.02 4.12 0.00 1.96 1.72 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 2.22 2.12 0.00 7 W 8.20 4.53 0.00 3.54 3.15 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 0.00 0.00 0.00 8 Q 8.46 4.06 0.00 2.40 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 9 Q 8.14 4.09 0.00 2.34 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.50 0.00 10 V 7.91 3.88 2.49 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 1.24 0.00 0.00 0.94 0.00 0.00 11 L 8.60 4.26 0.00 1.81 1.79 0.94 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.51 4.35 0.00 2.80 3.09 0.00 0.00 7.23 7.25 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 13 V 8.00 3.75 2.45 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 0.97 0.00 0.00 0.76 0.00 0.00 14 W 8.60 3.99 0.00 3.68 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 15 G 8.34 3.83 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 0.00 0.00 0.00 16 K 7.52 3.84 0.00 1.47 1.23 0.00 1.58 0.00 0.00 1.52 0.00 0.00 2.98 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.35 1.42 7.81 17 V 7.10 2.89 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 -0.09 0.00 0.00 18 E 7.39 3.89 0.00 1.98 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 2.41 2.48 0.00 19 A 7.76 4.21 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 20 D 7.69 4.66 0.00 2.73 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 I 7.83 3.66 1.86 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 1.64 0.74 0.93 0.00 0.00 22 A 7.50 4.19 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 23 G 8.21 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 24 H 8.30 4.18 0.00 3.25 3.23 0.00 5.82 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 25 G 8.34 3.60 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 0.00 0.00 0.00 26 Q 8.10 3.89 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.73 0.00 0.00 0.00 0.00 0.00 2.30 2.57 0.00 27 E 7.88 3.89 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 2.26 2.34 0.00 28 V 7.91 3.54 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 1.10 0.00 0.00 0.99 0.00 0.00 29 L 7.61 3.45 0.00 1.53 1.15 0.92 0.58 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 30 I 7.62 3.67 1.87 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 1.41 0.63 0.89 0.00 0.00 31 R 7.92 3.79 0.00 1.97 2.06 0.00 3.07 0.00 0.00 2.99 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 32 L 7.77 3.91 0.00 1.75 1.42 1.07 0.95 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 33 F 8.03 4.60 0.00 3.06 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 34 T 8.12 4.16 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 1.26 0.00 0.00 35 G 8.12 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 36 H 8.21 4.70 0.00 3.08 2.86 0.00 5.65 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 P 0.00 4.52 0.00 2.16 2.13 0.00 3.84 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 2.11 2.13 0.00 38 E 8.52 4.51 0.00 2.29 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 0.00 2.30 2.42 0.00 39 T 7.99 3.68 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 0.92 0.00 0.00 40 L 8.02 3.68 0.00 1.30 1.73 0.14 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 41 E 8.04 4.07 0.00 2.21 2.03 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 2.35 2.38 0.00 42 K 7.92 4.28 0.00 1.72 1.61 0.00 1.87 0.00 0.00 1.72 0.00 0.00 3.18 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.70 1.89 7.81 43 F 7.86 4.23 0.00 2.66 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.31 4.37 0.00 2.61 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 45 K 7.86 4.23 0.00 1.78 2.15 0.00 1.93 0.00 0.00 2.12 0.00 0.00 3.13 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.49 7.81 46 F 7.82 5.06 0.00 3.09 3.19 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 47 K 8.14 4.08 0.00 1.85 2.17 0.00 1.56 0.00 0.00 1.91 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.44 7.81 48 H 8.17 4.44 0.00 3.31 3.47 0.00 5.53 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.31 4.10 0.00 1.64 1.59 0.88 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 50 K 9.43 4.46 0.00 1.77 1.80 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.49 7.81 51 T 7.59 4.72 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 52 E 8.60 3.92 0.00 2.05 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 2.36 2.36 0.00 53 A 7.97 3.98 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 54 E 8.12 3.87 0.00 2.22 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 2.34 0.00 55 M 7.85 3.96 0.00 1.99 2.26 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 2.74 2.65 0.00 56 K 8.18 4.04 0.00 1.79 1.84 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.44 1.67 7.81 57 A 7.81 4.22 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 58 S 7.34 4.14 0.00 3.79 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 59 E 8.89 3.95 0.00 2.01 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 2.34 0.00 60 D 8.09 4.43 0.00 2.74 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 61 L 7.63 3.16 0.00 0.61 1.39 0.82 0.91 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 62 K 7.74 3.85 0.00 1.83 1.89 0.00 1.66 0.00 0.00 1.61 0.00 0.00 3.13 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.44 7.81 63 K 8.18 4.01 0.00 2.03 1.89 0.00 1.74 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.53 7.81 64 V 8.12 3.82 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 1.38 0.00 0.00 1.27 0.00 0.00 65 G 8.38 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 66 T 7.99 3.93 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 67 R 8.09 4.00 0.00 2.08 2.06 0.00 3.23 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.98 0.00 68 V 7.97 3.65 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 1.13 0.00 0.00 1.18 0.00 0.00 69 L 8.04 4.30 0.00 1.85 1.92 0.88 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.19 3.97 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 1.26 0.00 0.00 71 A 8.07 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 8.08 3.57 0.00 1.66 1.68 0.19 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.15 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 0.00 0.00 0.00 74 G 7.76 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 I 7.45 3.81 1.79 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 1.50 0.88 0.82 0.00 0.00 76 L 7.82 3.96 0.00 1.15 1.55 0.14 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.65 3.95 0.00 1.69 1.79 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.17 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.45 1.43 7.81 78 K 7.68 3.94 0.00 1.85 1.80 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.63 1.74 7.81 79 K 8.13 2.00 0.00 1.25 0.74 0.00 1.47 0.00 0.00 1.58 0.00 0.00 2.81 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.42 1.01 7.81 80 G 8.03 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 81 H 7.44 4.51 0.00 3.18 3.23 0.00 5.61 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 82 H 7.13 5.26 0.00 3.27 3.44 0.00 5.64 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.39 3.99 0.00 2.03 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 2.40 2.33 0.00 84 A 7.92 4.05 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 85 E 8.12 4.11 0.00 2.22 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 2.38 2.42 0.00 86 L 8.18 4.09 0.00 1.98 1.68 1.03 0.36 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 87 K 7.97 3.87 0.00 2.00 1.89 0.00 1.82 0.00 0.00 1.98 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.50 7.81 88 P 0.00 4.35 0.00 2.30 2.34 0.00 3.83 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 2.24 2.05 0.00 89 L 7.49 3.99 0.00 1.93 1.94 0.99 1.37 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 90 A 8.35 4.10 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Q 8.03 3.94 0.00 2.25 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 92 S 8.17 4.15 0.00 4.07 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 H 8.60 4.34 0.00 3.61 3.63 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 94 A 7.73 3.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 6.99 4.13 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 96 K 7.71 3.88 0.00 1.53 1.62 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.25 1.28 7.81 97 H 7.84 4.32 0.00 2.99 3.11 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.30 2.63 0.00 1.64 1.45 0.00 1.00 0.00 0.00 1.07 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.01 1.15 7.81 99 I 7.76 4.32 2.13 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 1.33 0.96 1.17 0.00 0.00 100 P 0.00 4.50 0.00 1.66 1.68 0.00 3.05 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 1.73 0.00 101 I 8.65 3.72 1.80 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 1.58 1.11 0.82 0.00 0.00 102 K 7.89 3.65 0.00 1.65 1.58 0.00 1.82 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.72 1.02 7.81 103 Y 7.77 4.03 0.00 3.27 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 0.00 104 L 7.87 4.22 0.00 1.86 1.80 0.73 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 105 E 8.16 3.96 0.00 2.00 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 2.40 2.39 0.00 106 F 8.06 4.45 0.00 3.29 2.81 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 0.00 107 I 8.22 3.87 2.04 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.40 1.16 0.00 0.00 108 S 8.27 4.24 0.00 4.21 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 0.00 109 D 8.29 4.49 0.00 3.00 2.81 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 0.00 110 A 8.12 4.03 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 0.00 111 I 8.00 3.69 2.13 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.85 1.07 0.00 0.00 112 I 7.91 3.86 2.03 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.82 1.19 0.00 0.00 113 H 8.55 4.15 0.00 3.30 3.51 0.00 5.78 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.97 3.55 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 0.89 0.00 0.00 0.94 0.00 0.00 115 L 7.93 3.81 0.00 1.27 0.52 0.66 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 116 H 8.04 4.57 0.00 3.58 3.58 0.00 5.95 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 7.95 4.10 0.00 3.76 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 0.00 118 K 7.82 4.16 0.00 1.50 1.36 0.00 1.76 0.00 0.00 1.43 0.00 0.00 2.45 0.00 0.00 2.41 0.00 0.00 0.00 0.00 1.23 1.29 7.81 119 H 8.17 5.03 0.00 3.10 3.19 0.00 5.63 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.43 0.00 2.24 2.38 0.00 3.78 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 2.08 1.94 0.00 121 G 8.12 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 0.00 122 D 8.12 4.96 0.00 2.72 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 0.00 123 F 8.08 5.00 0.00 2.97 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 0.00 124 G 7.70 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 0.00 125 A 8.47 3.85 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 0.00 126 D 7.95 4.23 0.00 2.65 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.76 3.99 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 0.00 128 Q 7.71 3.26 0.00 1.91 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.22 1.16 0.00 129 G 7.82 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 7.96 3.86 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 0.00 131 M 8.33 4.08 0.00 2.50 2.51 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.90 0.00 132 T 8.19 3.91 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 1.23 0.00 0.00 133 K 8.08 4.07 0.00 1.80 1.69 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.49 7.81 134 A 7.87 3.86 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 0.00 135 L 8.23 4.17 0.00 1.79 1.86 1.02 0.80 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 0.00 136 E 8.36 4.00 0.00 2.17 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 137 L 8.00 3.95 0.00 1.90 2.02 1.04 0.93 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 0.00 138 F 8.29 4.20 0.00 3.12 3.29 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 0.00 139 R 8.01 3.46 0.00 1.97 1.84 0.00 3.17 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.95 0.00 140 N 8.32 4.18 0.00 2.93 2.88 0.00 0.00 7.26 9.02 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 0.00 141 D 8.19 4.31 0.00 2.69 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 I 7.44 3.35 1.37 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 -0.36 0.03 0.00 0.00 143 A 7.91 3.72 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 0.00 144 A 7.81 3.94 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 0.00 145 K 7.87 3.90 0.00 1.89 1.92 0.00 1.74 0.00 0.00 1.80 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.57 1.60 7.81 146 Y 8.39 4.51 0.00 3.12 3.18 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 0.00 147 K 8.00 3.90 0.00 1.91 2.03 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.55 7.81 148 E 7.51 4.00 0.00 2.30 2.03 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 2.36 2.37 0.00 149 L 8.04 4.31 0.00 1.84 1.75 1.11 1.06 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 0.00 150 G 8.02 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 0.00 151 F 8.10 4.73 0.00 2.75 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 8.30 3.93 0.00 1.90 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.86 0.00 0.00 0.00 0.00 0.00 2.21 2.21 0.00 153 G 7.92 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 0.00 0.00 0.00