NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 G 3.9035 8.3016 109.1158 44.9485 0.0000 174.0325 4 D 4.1945 8.5725 124.2680 53.9973 42.9953 175.5241 5 K 3.9848 9.3557 127.9814 59.4870 32.8346 178.9817 6 K 3.9952 8.0333 118.3825 58.9925 31.9663 179.2701 7 V 3.6361 8.1515 118.7780 66.2681 31.4473 178.0481 8 I 3.7274 7.5299 119.1569 64.6254 36.8198 178.5247 9 Q 3.9735 7.8959 118.3084 59.1168 28.5408 178.3413 10 H 4.0880 8.3762 117.3358 58.9387 28.7069 177.7969 11 L 4.0364 8.5912 121.0173 58.0170 41.3506 179.4528 12 N 4.3715 8.4163 116.4844 55.9241 38.4813 177.4684 13 K 3.9332 8.2568 121.4811 59.4869 32.2318 179.0016 14 I 3.6969 7.9105 120.1363 64.1513 36.9554 177.9157 15 L 4.0172 8.3005 121.7431 58.3604 41.8418 179.1255 16 G 3.7350 8.3761 105.7482 48.2118 0.0000 175.3008 17 N 4.4047 8.0616 118.4918 56.0371 37.9892 177.4639 18 E 3.9900 8.3997 120.3375 59.2944 29.0890 179.3333 19 L 4.0047 8.2892 119.5276 57.7251 41.5385 179.6362 20 I 3.6829 7.5963 119.2563 64.2210 37.0458 178.4097 21 A 3.3335 7.7514 121.5919 54.7651 18.0711 179.3484 22 I 3.5846 7.8330 118.9392 65.0276 37.1710 178.2702 23 N 4.3720 7.6999 115.5232 56.0913 38.4010 177.3615 24 Q 3.8588 8.1533 121.2368 59.5680 29.0958 178.1382 25 Y 4.8345 8.2876 119.3829 60.5129 37.8851 178.0926 26 F 3.9407 8.7502 122.1235 61.2368 39.5807 177.0168 27 L 4.0216 8.4823 120.4173 58.4128 41.7800 178.5936 28 H 3.8938 8.5787 116.7265 58.5916 28.5551 177.4507 29 S 4.3368 8.3421 115.1951 61.8987 62.1154 176.7272 30 R 3.8665 7.8048 120.3416 59.1080 29.7172 179.0526 31 M 3.4749 7.7681 118.7303 57.9537 31.7640 178.7251 32 W 4.4993 8.0577 119.3737 59.8860 29.1669 178.3785 33 N 4.3628 8.3939 116.4845 56.3927 37.7831 176.8838 34 D 4.3471 7.9814 118.4557 56.9978 41.3637 177.5643 35 W 4.8804 7.9424 116.4799 56.6486 28.9724 176.9968 36 G 3.9708 8.3381 108.0005 46.1673 0.0000 174.4170 37 L 4.8801 8.0778 122.0533 53.3468 40.2611 177.6000 38 K 4.0451 8.6004 121.9684 59.1140 32.4511 179.0897 39 R 3.8766 8.0135 119.3503 59.2000 29.8777 178.6093 40 L 3.8276 7.7315 118.6240 57.4865 41.5410 179.4239 41 G 3.7434 8.3112 105.6031 47.8422 0.0000 175.6245 42 A 3.9765 8.3334 123.6409 55.0534 18.4171 179.2380 43 H 3.9668 8.2314 116.8473 59.4152 29.7948 177.2066 44 E 4.0068 8.5878 121.3597 59.2048 29.4807 178.0927 45 Y 4.0177 8.2140 119.8889 61.0419 38.8251 177.8273 46 H 4.0983 8.3309 117.0935 58.7792 28.7147 177.6855 47 E 3.8859 8.1282 120.5792 59.1862 29.1084 179.2446 48 S 4.2672 8.2946 113.3142 61.5174 62.5249 176.3003 49 I 3.5845 7.6104 122.4003 64.4010 36.7980 178.0031 50 D 4.2734 7.9655 119.6711 57.5644 40.5900 178.8555 51 E 4.2397 8.0997 120.1917 59.1956 29.4650 179.3107 52 M 4.0442 8.2853 119.0471 58.3520 32.0807 179.0215 53 K 4.0156 8.0298 118.6664 59.5566 32.1123 179.2316 54 H 4.2479 8.1174 116.3412 58.7791 28.6086 177.3265 55 A 3.9874 8.2807 123.0515 55.5874 18.1443 179.1957 56 D 4.2564 8.1765 116.0867 57.4578 41.2224 178.6808 57 K 4.0210 7.9214 118.5543 59.2241 31.9628 179.1950 58 L 3.9863 8.1442 119.4695 58.0117 41.6401 179.4623 59 I 3.7020 7.9003 119.5878 64.7706 37.1197 178.3995 60 E 4.0363 8.3274 119.1247 59.2370 29.2063 179.4888 61 R 4.0104 8.2847 118.9838 59.4550 30.1312 178.4692 62 I 3.7264 8.0368 119.8871 64.6255 37.1582 178.4719 63 L 4.0006 8.1275 119.6615 57.6583 41.2097 179.2362 64 F 4.2940 8.1979 119.8792 61.1155 39.7813 176.3158 65 L 3.9352 8.1383 116.3368 54.1682 41.2606 177.1125 66 E 3.6136 7.8795 117.5237 57.3279 27.1494 174.7966 67 G 3.8963 7.9989 108.8232 44.3505 0.0000 173.5694 68 L 4.5832 8.0167 118.9225 52.0237 42.6948 175.1462 69 P 4.3972 0.0000 0.0000 62.4060 31.8176 176.2755 70 N 4.6435 8.9451 122.3091 52.5264 37.9000 173.8463 71 L 4.5894 8.2217 123.2097 54.3798 42.1666 177.4192 72 Q 4.1776 8.7424 122.4344 57.0459 29.5653 175.3999 73 D 4.7172 8.1127 117.7086 52.3573 41.9000 175.1786 74 L 4.5486 8.3726 126.2981 52.9157 43.8266 176.4643 75 G 3.8286 8.3394 115.9778 44.3571 0.0000 171.6574 76 K 4.0659 8.3725 121.1480 55.7677 32.1847 177.1120 77 L 4.0510 8.3952 127.1894 54.7442 42.0977 177.3488 78 L 4.3466 8.6921 124.3712 53.4548 40.6310 175.3701 79 I 4.2345 7.9776 124.1247 59.3151 37.5543 176.5683 80 G 3.9492 8.7450 115.0308 45.1509 0.0000 172.1710 81 E 4.6672 8.7605 116.0119 56.1332 30.8083 175.6525 82 N 5.0704 7.6818 116.7390 50.6128 41.9068 175.0054 83 T 4.4372 8.6325 116.5227 67.2837 68.5361 176.6919 84 Q 4.0425 8.1616 119.1682 59.1861 28.7427 178.7151 85 E 4.0526 8.9410 119.8761 59.6304 29.3926 179.3753 86 M 3.9766 8.3766 119.1651 58.1123 31.8573 178.8288 87 L 4.1378 8.2931 119.2602 57.9512 41.8683 179.2576 88 Q 3.9779 8.1446 119.4978 59.4056 28.9546 178.1526 89 C 4.2269 8.5538 118.1245 63.0047 28.1465 175.7880 90 D 4.6659 8.5024 120.6175 57.3339 40.3029 178.7135 91 L 3.9675 8.1681 120.9659 58.2034 42.0332 178.6229 92 N 4.3228 8.6618 116.9208 56.3450 38.3980 177.1695 93 L 4.0054 8.1610 121.5877 58.2955 42.2532 178.9115 94 E 4.0608 8.5590 118.6144 59.3125 29.3145 179.3631 95 L 4.0700 8.3145 119.6159 57.4300 41.6206 179.4305 96 K 3.9504 8.0151 119.3512 59.4272 32.2023 178.6936 97 A 4.0422 8.3202 121.3637 55.6154 18.2717 179.8182 98 T 3.9117 8.0371 114.2274 66.4490 68.6923 177.0695 99 K 3.9494 7.9159 121.2166 59.7512 32.2636 178.6930 100 D 4.4574 8.1948 119.0578 57.1157 40.6680 178.7711 101 L 4.0547 7.9700 119.8796 57.7250 41.5008 179.6581 102 R 3.9490 8.0055 118.0207 59.2293 29.9917 178.8450 103 E 3.9435 8.1545 117.8678 59.5112 29.4067 179.3718 104 A 3.6272 8.0662 120.6634 54.9339 18.2860 179.8750 105 I 3.6458 7.7126 118.5090 64.3208 37.2237 178.3637 106 V 3.5677 7.9657 119.5563 66.5809 31.2438 177.5969 107 H 4.0576 8.1029 117.4505 59.4439 29.6940 176.7446 108 C 3.9306 8.2530 118.7996 62.8147 27.9433 175.8013 109 E 3.8777 8.3429 120.7752 59.4373 29.0911 178.3982 110 Q 3.9536 7.6843 118.0599 59.0347 29.0623 178.1384 111 V 3.9045 7.1521 109.8282 60.6691 31.7900 175.6967 112 H 3.1473 7.5004 114.3608 57.1470 26.6688 176.3104 113 D 4.5019 7.4073 120.5944 53.4035 38.1934 175.6616 114 Y 4.2966 7.2265 121.4351 60.4436 38.4572 177.7433 115 V 3.6781 7.8637 119.0631 66.0487 31.7327 178.1019 116 S 4.1642 8.5132 114.9834 61.5663 62.6136 176.5339 117 R 3.8972 8.0317 121.4494 59.4766 29.8015 178.1000 118 D 4.2892 8.2932 117.7545 57.1173 41.2353 177.5757 119 L 3.9379 7.9245 120.9212 58.6166 42.0607 179.2091 120 L 4.0064 8.1061 118.5170 57.5179 41.4115 179.4853 121 K 4.0094 8.3705 119.9825 59.3006 32.2060 178.6081 122 D 4.3478 8.1709 119.2732 57.5501 40.7332 178.7242 123 I 3.4818 7.8271 120.2076 64.3035 37.0825 178.2811 124 L 3.9267 8.0265 121.0143 58.0285 41.9507 178.4179 125 E 3.9327 8.3893 119.5178 59.4744 29.5389 178.7282 126 S 4.2918 7.9939 112.7247 61.6725 62.3990 176.0961 127 E 4.1479 8.4578 121.3708 59.3605 29.0945 179.1608 128 E 4.0213 8.8284 119.2369 59.4226 29.4863 179.1942 129 E 4.0376 8.3607 118.7817 59.5947 29.4196 178.8983 130 H 4.4055 8.2874 118.4394 59.3086 29.8590 177.3944 131 I 3.7136 8.1322 121.9045 64.2984 36.9319 177.7478 132 D 4.3418 8.5322 119.2912 57.5622 40.9806 177.7673 133 Y 4.0829 8.2511 119.8596 60.7111 38.8204 178.1248 134 L 3.7405 8.2257 119.9211 57.8868 41.8086 179.3495 135 E 3.9409 8.4485 118.8275 59.6495 29.3137 179.6171 136 T 3.8271 7.8851 115.8280 66.5776 68.4605 176.7747 137 Q 3.7717 7.8772 120.0473 58.8829 28.2110 178.7588 138 L 3.8843 7.6977 120.0989 57.6358 41.5821 179.8502 139 G 3.5667 8.0221 105.6729 47.7614 0.0000 175.7996 140 L 4.0174 7.8532 121.3666 57.4836 41.5928 179.4223 141 I 3.5694 7.3098 119.8226 64.5745 36.7509 178.4888 142 Q 3.9565 7.4165 116.9536 58.8815 28.6243 178.5861 143 K 4.1505 7.8400 118.5422 58.6520 32.2864 178.9198 144 V 4.2536 8.4183 109.9641 59.7547 33.1767 177.1418 145 G 4.1243 7.5935 104.4557 45.8275 0.0000 174.5482 146 L 4.0116 8.3929 121.5405 57.9495 42.1197 179.2251 147 E 3.9705 8.1462 118.0661 59.6804 29.5032 179.0180 148 N 4.3344 8.1383 115.9410 56.2986 38.4078 176.7271 149 Y 4.0023 7.9226 120.2838 60.6076 39.1920 177.8482 150 L 4.0229 8.2373 120.0163 57.7322 41.8141 178.9054 151 Q 3.9085 8.1677 119.6737 59.6015 28.7372 178.7431 152 S 4.2873 7.9187 112.9880 60.1541 63.0312 174.4752 153 H 4.6053 7.9057 118.8995 55.6412 29.4971 176.0274 154 M 4.1775 8.0018 120.9357 58.0229 31.9030 175.9603 155 H 5.0879 7.6369 114.1741 54.0793 30.3339 175.1798 156 E 4.1297 8.7420 122.0692 56.7934 29.2455 176.8224 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 G 8.30 3.90 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 0.00 0.00 0.00 4 D 8.57 4.19 0.00 2.86 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 5 K 9.36 3.98 0.00 1.94 1.76 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.90 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.50 1.09 7.81 6 K 8.03 4.00 0.00 1.90 1.57 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.44 7.81 7 V 8.15 3.64 2.26 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 1.13 0.00 0.00 1.01 0.00 0.00 8 I 7.53 3.73 2.06 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 1.52 0.54 0.90 0.00 0.00 9 Q 7.90 3.97 0.00 2.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.51 0.00 10 H 8.38 4.09 0.00 3.44 3.33 0.00 5.62 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 11 L 8.59 4.04 0.00 1.81 1.74 0.96 0.78 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 12 N 8.42 4.37 0.00 2.96 2.85 0.00 0.00 6.64 7.21 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 13 K 8.26 3.93 0.00 1.85 1.96 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 I 7.91 3.70 2.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.75 0.92 0.00 0.00 15 L 8.30 4.02 0.00 1.79 1.92 0.92 0.95 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 16 G 8.38 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.06 4.40 0.00 2.93 2.88 0.00 0.00 7.04 7.62 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 18 E 8.40 3.99 0.00 2.13 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 2.56 2.52 0.00 19 L 8.29 4.00 0.00 1.77 1.68 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.60 3.68 1.96 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 1.42 0.81 0.89 0.00 0.00 21 A 7.75 3.33 1.04 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 22 I 7.83 3.58 1.97 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 1.50 0.82 0.87 0.00 0.00 23 N 7.70 4.37 0.00 2.80 2.82 0.00 0.00 6.74 7.62 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 24 Q 8.15 3.86 0.00 2.06 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.49 2.39 0.00 25 Y 8.29 4.83 0.00 3.05 2.97 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 26 F 8.75 3.94 0.00 3.33 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 27 L 8.48 4.02 0.00 1.80 1.65 0.88 0.94 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 28 H 8.58 3.89 0.00 3.35 2.77 0.00 5.71 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.34 4.34 0.00 4.01 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 30 R 7.80 3.87 0.00 1.88 1.88 0.00 2.96 0.00 0.00 2.56 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.66 0.00 31 M 7.77 3.47 0.00 0.87 1.62 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.15 0.00 32 W 8.06 4.50 0.00 3.66 3.25 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 33 N 8.39 4.36 0.00 2.89 2.84 0.00 0.00 6.64 7.69 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 34 D 7.98 4.35 0.00 2.57 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 35 W 7.94 4.88 0.00 3.71 3.14 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 36 G 8.34 3.97 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 37 L 8.08 4.88 0.00 1.94 1.58 1.28 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 38 K 8.60 4.05 0.00 2.02 1.85 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.47 7.81 39 R 8.01 3.88 0.00 1.97 1.92 0.00 3.14 0.00 0.00 2.97 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 40 L 7.73 3.83 0.00 1.21 0.13 0.34 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.31 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 42 A 8.33 3.98 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 43 H 8.23 3.97 0.00 3.35 3.26 0.00 5.79 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.59 4.01 0.00 2.54 2.25 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 2.74 2.67 0.00 45 Y 8.21 4.02 0.00 2.94 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 46 H 8.33 4.10 0.00 3.25 3.22 0.00 5.69 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 8.13 3.89 0.00 1.97 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 2.24 2.09 0.00 48 S 8.29 4.27 0.00 4.12 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 49 I 7.61 3.58 1.82 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.34 0.83 0.00 0.00 50 D 7.97 4.27 0.00 2.83 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.10 4.24 0.00 2.18 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 2.77 2.45 0.00 52 M 8.29 4.04 0.00 2.00 2.21 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.54 0.00 53 K 8.03 4.02 0.00 1.84 1.81 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.64 7.81 54 H 8.12 4.25 0.00 3.49 3.32 0.00 5.66 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 55 A 8.28 3.99 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 56 D 8.18 4.26 0.00 2.92 2.86 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 57 K 7.92 4.02 0.00 2.02 1.86 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.65 7.81 58 L 8.14 3.99 0.00 1.87 1.74 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 59 I 7.90 3.70 2.02 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 1.53 0.97 0.92 0.00 0.00 60 E 8.33 4.04 0.00 2.17 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 2.34 2.54 0.00 61 R 8.28 4.01 0.00 2.05 2.13 0.00 3.32 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 62 I 8.04 3.73 2.03 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 1.54 0.65 0.95 0.00 0.00 63 L 8.13 4.00 0.00 1.96 1.77 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.20 4.29 0.00 3.03 3.33 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 65 L 8.14 3.94 0.00 1.85 1.60 0.96 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.88 3.61 0.00 2.03 2.02 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 2.17 2.15 0.00 67 G 8.00 3.90 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 0.00 0.00 0.00 68 L 8.02 4.58 0.00 1.61 1.60 0.91 0.99 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 69 P 0.00 4.40 0.00 2.04 1.99 0.00 3.66 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 70 N 8.95 4.64 0.00 2.66 2.83 0.00 0.00 7.11 7.34 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 71 L 8.22 4.59 0.00 1.62 1.63 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.74 4.18 0.00 1.93 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.37 6.65 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 73 D 8.11 4.72 0.00 2.68 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 74 L 8.37 4.55 0.00 1.51 1.51 0.88 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 75 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 76 K 8.37 4.07 0.00 1.70 1.74 0.00 1.67 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.52 7.81 77 L 8.40 4.05 0.00 1.63 1.56 0.92 1.00 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 78 L 8.69 4.35 0.00 1.77 1.68 1.02 0.78 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 79 I 7.98 4.23 1.88 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.77 0.89 0.00 0.00 80 G 8.75 3.95 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 0.00 0.00 0.00 81 E 8.76 4.67 0.00 2.43 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 2.21 2.08 0.00 82 N 7.68 5.07 0.00 2.88 2.85 0.00 0.00 6.25 7.22 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 83 T 8.63 4.44 4.49 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 1.55 0.00 0.00 84 Q 8.16 4.04 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 85 E 8.94 4.05 0.00 2.15 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 2.53 0.00 86 M 8.38 3.98 0.00 1.32 2.11 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.11 0.00 87 L 8.29 4.14 0.00 1.76 1.74 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 88 Q 8.14 3.98 0.00 2.19 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 89 C 8.55 4.23 0.00 3.28 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 90 D 8.50 4.67 0.00 2.95 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 91 L 8.17 3.97 0.00 1.86 1.85 0.93 0.57 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 92 N 8.66 4.32 0.00 2.91 2.89 0.00 0.00 6.70 6.65 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 93 L 8.16 4.01 0.00 1.95 1.94 0.93 0.80 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 94 E 8.56 4.06 0.00 2.21 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 2.63 2.47 0.00 95 L 8.31 4.07 0.00 1.86 1.73 0.94 0.83 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 96 K 8.02 3.95 0.00 1.85 1.98 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.51 7.81 97 A 8.32 4.04 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.04 3.91 4.62 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 1.32 0.00 0.00 99 K 7.92 3.95 0.00 1.83 1.82 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 100 D 8.19 4.46 0.00 2.77 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 0.00 101 L 7.97 4.05 0.00 1.95 1.73 0.93 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.01 3.95 0.00 2.04 1.99 0.00 3.15 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 1.66 1.89 0.00 103 E 8.15 3.94 0.00 2.25 2.07 0.00 0.00 0.00 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 2.53 0.00 104 A 8.07 3.63 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 7.71 3.65 1.99 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 1.42 0.68 0.93 0.00 0.00 106 V 7.97 3.57 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.98 0.00 0.00 107 H 8.10 4.06 0.00 3.26 3.27 0.00 5.85 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 0.00 108 C 8.25 3.93 0.00 3.11 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 0.00 109 E 8.34 3.88 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 2.36 2.44 0.00 110 Q 7.68 3.95 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 111 V 7.15 3.90 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 0.66 0.00 0.00 0.82 0.00 0.00 112 H 7.50 3.15 0.00 3.18 3.25 0.00 5.66 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.41 4.50 0.00 2.61 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 Y 7.23 4.30 0.00 3.10 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 0.00 115 V 7.86 3.68 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 1.08 0.00 0.00 1.00 0.00 0.00 116 S 8.51 4.16 0.00 4.07 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.03 3.90 0.00 1.93 2.19 0.00 3.26 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 118 D 8.29 4.29 0.00 3.16 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 0.00 119 L 7.92 3.94 0.00 1.78 1.91 0.94 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 120 L 8.11 4.01 0.00 1.92 1.71 0.93 0.62 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 0.00 121 K 8.37 4.01 0.00 1.90 2.01 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.49 7.81 122 D 8.17 4.35 0.00 2.99 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 0.00 123 I 7.83 3.48 1.95 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 1.14 0.71 0.78 0.00 0.00 124 L 8.03 3.93 0.00 1.89 1.88 0.94 0.66 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 0.00 125 E 8.39 3.93 0.00 2.08 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 2.33 2.35 0.00 126 S 7.99 4.29 0.00 4.10 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 0.00 127 E 8.46 4.15 0.00 2.06 2.24 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 2.64 2.54 0.00 128 E 8.83 4.02 0.00 1.99 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 2.52 0.00 129 E 8.36 4.04 0.00 2.25 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 2.45 0.00 130 H 8.29 4.41 0.00 3.28 3.51 0.00 5.61 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 I 8.13 3.71 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.60 0.93 0.00 0.00 132 D 8.53 4.34 0.00 2.89 2.97 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 0.00 133 Y 8.25 4.08 0.00 3.17 3.21 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 0.00 134 L 8.23 3.74 0.00 1.96 1.67 1.10 0.68 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 0.00 135 E 8.45 3.94 0.00 1.96 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 2.31 2.45 0.00 136 T 7.89 3.83 4.30 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 1.17 0.00 0.00 137 Q 7.88 3.77 0.00 1.85 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 1.34 1.91 0.00 138 L 7.70 3.88 0.00 1.72 1.61 0.83 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.02 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 0.00 140 L 7.85 4.02 0.00 1.80 1.85 1.01 0.84 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 0.00 141 I 7.31 3.57 1.78 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 -0.36 0.80 0.00 0.00 142 Q 7.42 3.96 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.98 0.00 0.00 0.00 0.00 0.00 2.52 2.49 0.00 143 K 7.84 4.15 0.00 1.74 1.86 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.63 7.81 144 V 8.42 4.25 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 0.78 0.00 0.00 1.08 0.00 0.00 145 G 7.59 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 0.00 146 L 8.39 4.01 0.00 1.77 1.68 0.97 0.91 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 0.00 147 E 8.15 3.97 0.00 2.06 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 2.40 2.41 0.00 148 N 8.14 4.33 0.00 3.05 2.88 0.00 0.00 6.72 7.48 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 0.00 149 Y 7.92 4.00 0.00 3.04 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 L 8.24 4.02 0.00 1.88 1.71 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.17 3.91 0.00 2.15 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 152 S 7.92 4.29 0.00 3.79 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 0.00 153 H 7.91 4.61 0.00 2.97 3.04 0.00 5.81 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 M 8.00 4.18 0.00 2.00 1.98 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.46 0.00 155 H 7.64 5.09 0.00 3.09 3.16 0.00 5.72 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 E 8.74 4.13 0.00 1.95 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 2.41 2.30 0.00