NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 5.1445 8.2787 120.1609 54.1735 43.4764 178.3777 23 A 3.8868 8.2305 124.6449 56.1261 18.1222 178.7305 24 D 4.3827 8.8877 118.2039 57.2128 41.5472 177.4178 25 S 4.1634 8.3661 115.3689 61.6620 62.9501 176.5677 26 K 3.9556 8.0678 120.8828 59.4526 31.7673 179.2962 27 A 4.0078 7.8847 120.8597 55.1529 18.3782 180.1378 28 V 3.7131 8.0887 117.8005 64.8355 31.4848 178.6426 29 L 4.2575 8.3336 119.9219 57.7615 41.4526 178.9589 30 N 4.3862 8.3251 117.1273 56.4631 38.7329 176.7361 31 Q 4.2397 8.4871 121.0335 59.2838 29.1719 178.2302 32 A 4.2108 8.4276 121.8412 55.0884 18.5530 179.6787 33 V 3.5792 7.9781 116.6876 66.0983 31.6039 178.2356 34 A 4.0965 8.3363 120.3371 55.4784 18.3678 179.3495 35 D 4.4217 8.5627 117.7679 57.6220 40.8340 179.1383 36 L 4.2116 8.7086 119.8157 57.8818 41.7271 179.7752 37 S 3.9064 7.7970 114.7708 61.4741 62.5378 176.9303 38 V 3.6601 7.9164 120.7963 65.7166 31.2239 177.9090 39 A 4.0165 8.5450 121.1177 55.3849 18.1891 179.0202 40 H 4.0046 8.5455 116.9837 59.4389 29.9534 177.3853 41 S 4.1153 8.0155 114.4814 61.5073 62.2081 176.2142 42 I 3.7170 8.0802 122.7480 64.4094 36.7795 178.3504 43 L 3.9474 8.2784 120.2437 58.0973 41.3523 179.1308 44 H 3.6991 8.2239 118.2084 58.8882 29.6360 177.1070 45 Q 4.2908 8.0463 121.4014 59.3408 28.8232 178.3137 46 V 3.6659 7.9369 119.2960 66.2781 31.2891 177.2162 47 H 4.1926 8.1642 116.7682 59.2935 29.7529 176.9604 48 W 4.6663 8.2262 119.1492 59.9392 29.2073 177.4930 49 Y 4.4399 8.7471 114.7904 57.2881 37.6964 175.2343 50 M 4.5085 7.5589 121.1594 55.9909 32.9521 175.6512 51 R 4.6614 8.7414 123.3083 55.3176 34.6090 173.7384 52 G 4.3155 8.9773 106.5204 42.8406 0.0000 173.3152 53 R 4.2241 8.2853 120.1055 57.3189 30.4371 177.2867 54 G 4.2782 9.5088 109.8215 45.5864 0.0000 175.1649 55 F 4.1115 8.7278 122.4864 61.9956 39.0657 176.7701 56 M 4.2494 8.4148 115.3554 58.1899 32.0622 177.1748 57 I 3.8087 7.5030 117.9136 63.0662 38.6548 177.4541 58 W 4.0757 8.2184 119.7986 59.2025 28.6389 178.1701 59 H 3.8822 8.1690 118.2148 58.8968 29.6407 175.3900 60 P 4.2339 0.0000 0.0000 65.0807 31.1271 178.5208 61 K 3.5714 7.4126 118.8123 59.5993 31.9410 178.7203 62 M 4.0219 7.8835 118.9427 58.3001 31.7330 178.2380 63 D 4.0811 7.6223 117.8629 57.1084 41.2443 178.1786 64 E 3.8684 7.7097 118.6593 59.5337 29.5153 178.6676 65 Y 4.4533 7.8170 116.7502 61.5040 37.9029 178.6096 66 M 3.9871 8.4189 119.9475 58.3806 32.0237 178.3620 67 E 3.8840 8.2931 119.4595 59.2746 29.8354 178.5303 68 E 3.6825 8.4373 119.4990 59.2218 29.7169 178.7826 69 I 3.7340 8.1301 120.2708 64.5746 37.1291 178.1117 70 D 4.4683 8.5738 120.2393 57.1890 40.5600 179.1314 71 G 3.4387 7.7544 106.2676 48.0269 0.0000 175.4152 72 Y 4.3294 7.2843 119.2538 60.6190 37.7650 178.3262 73 L 4.0262 8.0880 121.3472 58.1579 42.1725 178.8008 74 D 4.3192 8.1881 118.8058 57.4949 40.8952 178.6035 75 E 3.9309 8.2414 118.9347 59.7446 29.4591 179.5142 76 M 3.9199 8.4478 119.2956 58.1507 32.0367 178.9693 77 S 4.1282 8.2771 114.6590 61.6035 63.1067 176.3949 78 E 3.9258 8.2084 122.4465 58.9981 29.1937 179.3848 79 R 3.8240 7.9076 118.6480 59.1040 30.0484 178.2669 80 L 3.9241 8.0256 120.2404 58.2744 42.1247 179.0642 81 I 3.8536 7.8997 119.7365 64.8103 36.8147 178.5913 82 T 3.9224 7.9009 115.5829 66.3199 68.3315 175.7986 83 L 4.3768 7.7986 118.1492 54.7835 41.7769 177.5775 84 G 3.8174 8.0677 107.5630 45.4904 0.0000 174.0966 85 G 3.7871 8.0065 109.3823 43.9288 0.0000 173.5932 86 A 4.4608 7.9847 121.1597 49.2451 20.3557 174.1555 87 P 4.5668 0.0000 0.0000 62.8882 32.2229 176.7140 88 F 4.5302 8.6477 120.7402 58.7775 39.2957 176.2528 89 S 4.8348 8.7136 119.8444 56.5342 63.4005 174.4934 90 T 4.4878 6.7883 109.4994 60.0435 72.9614 173.3764 91 L 3.9921 8.2459 122.3412 57.7111 41.6218 179.7172 92 K 3.8544 7.8157 119.1530 59.5878 32.1195 178.5701 93 E 3.6937 7.7553 118.3854 59.1646 29.3254 179.2733 94 F 4.4063 7.5731 117.7948 60.8891 38.8285 177.7554 95 S 4.1573 8.2490 111.5602 61.4136 62.2505 175.6499 96 E 4.1005 8.2145 120.6121 58.8071 29.3486 178.2084 97 N 4.4947 7.9972 115.3669 53.7972 39.3048 175.8365 98 S 4.4975 7.4416 114.6879 58.3861 62.9534 173.8037 99 Q 4.3065 8.7775 124.1320 56.0613 29.1261 176.2685 100 L 4.0213 7.6449 121.1387 54.3494 42.5638 176.8436 101 K 4.5855 8.2362 122.5591 52.7444 34.4702 175.7004 102 E 4.7486 8.5143 122.4389 54.0142 31.6522 175.5273 103 V 4.5429 7.7116 113.1491 58.9739 35.6680 175.6694 104 L 4.0339 8.2759 121.2942 54.4433 42.0230 177.8862 105 G 2.5936 8.0346 111.2285 45.3850 0.0000 172.6535 106 D 4.4464 7.3501 120.7295 52.6281 43.8701 175.7161 107 Y 5.0756 8.7242 123.6819 59.9814 38.3635 176.6968 108 N 4.5554 9.1012 117.2644 55.3294 38.9667 176.0732 109 V 3.5977 7.0736 118.3452 63.3776 32.0641 176.4911 110 T 4.1723 8.5806 117.3271 61.4167 70.6141 175.6182 111 I 3.6841 8.3058 123.1435 64.9193 37.2356 178.5552 112 E 3.8269 8.1080 118.6574 59.3774 29.2985 179.1761 113 E 3.9437 8.1796 118.6912 59.3410 29.5100 179.3935 114 Q 3.9430 8.1269 118.1807 59.0206 28.7385 178.8693 115 L 3.7213 7.9691 119.9189 57.5155 41.5415 179.4156 116 A 3.8566 7.9732 120.8327 55.0551 18.2946 179.6582 117 R 3.7605 7.8882 117.2608 59.4744 30.0715 178.9668 118 V 3.2571 7.5580 118.1192 65.6697 31.4498 178.0791 119 V 3.5181 7.8657 120.6700 66.6607 31.3241 178.4985 120 E 4.0152 8.1645 117.9375 61.0591 29.4670 181.0502 121 V 3.8466 7.7878 119.3555 66.0131 31.5457 178.2339 122 F 4.4033 8.6025 117.9648 60.6425 38.7084 177.8720 123 R 3.9393 8.7210 118.1773 59.3310 29.7803 178.4690 124 Y 3.9405 8.0875 119.2717 60.6567 38.8240 178.0246 125 L 3.3828 8.1646 119.8094 57.5653 41.6669 179.4126 126 A 3.7609 8.0368 120.7565 54.9431 18.2841 179.5970 127 A 3.8036 7.7303 119.3312 54.9687 18.3231 179.5892 128 L 3.6183 7.4635 119.2114 58.3070 42.0954 179.3218 129 F 4.3542 8.1341 118.1335 60.4358 38.7242 177.4590 130 Q 4.0009 8.3185 121.8285 59.6649 28.7780 179.0784 131 K 4.0049 8.0389 124.8006 59.7222 31.7365 180.9637 132 G 2.5515 7.7155 107.4452 47.0628 0.0000 175.4287 133 F 4.0793 8.2896 123.5836 61.0376 39.4157 176.9496 134 D 4.4073 8.5271 118.7595 57.6625 40.7428 179.2602 135 V 3.6466 8.0149 113.4331 64.3592 31.4921 178.8807 136 S 4.5101 8.0700 115.4813 60.7671 62.9737 176.0694 137 D 4.1385 8.1164 124.1450 57.7347 40.7320 178.6949 138 E 4.0020 7.9449 117.5624 61.0147 29.9834 180.1256 139 E 4.4414 8.1396 117.7301 56.7836 29.5895 178.3646 140 G 3.9507 7.6946 106.8434 45.6369 0.0000 174.8737 141 D 4.6015 7.6426 120.4621 52.8177 38.7403 176.2600 142 S 4.0662 8.0134 119.4648 60.7888 63.4313 176.7469 143 V 3.5135 7.6555 121.2386 66.2498 31.5341 177.9681 144 T 3.7390 7.7378 115.3064 66.4553 68.2461 176.0097 145 N 4.5356 7.9936 120.3009 56.2063 38.8567 176.3854 146 D 4.3727 8.1365 119.2564 57.3222 41.3251 178.1053 147 I 3.5276 7.5275 120.0909 64.5629 37.0607 178.4720 148 F 3.9214 7.7983 118.1359 60.2835 38.6658 177.3282 149 N 4.3570 8.3930 116.8440 56.6994 38.9347 177.1888 150 V 3.5526 8.0414 119.6321 65.9135 31.6276 177.9047 151 A 3.4944 7.6017 120.5065 54.6822 17.9012 179.4955 152 K 4.1032 8.4165 118.4302 59.5013 32.3890 178.6740 153 A 3.9691 7.9368 121.0941 55.5076 18.3322 179.6577 154 S 4.0804 7.9701 110.9529 61.5366 62.4730 176.3639 155 I 3.5597 7.8612 122.6414 64.3822 36.7878 178.3048 156 E 4.0548 8.4782 119.6059 59.0888 29.3565 179.3000 157 K 4.2725 7.9909 119.6624 59.9484 32.2245 178.6700 158 H 4.4425 8.2086 116.5892 58.8497 28.5129 177.7906 159 I 3.8377 8.0526 121.8008 64.0492 36.9529 178.0428 160 W 4.3622 8.3263 129.1295 60.9716 30.5259 177.8583 161 M 3.3923 7.5639 117.8966 58.1255 31.3819 178.7322 162 L 3.9866 8.3206 119.3987 58.0259 41.8320 179.6818 163 Q 3.9711 8.5077 118.0260 58.8440 28.6064 178.6071 164 A 4.1844 8.4971 122.2226 55.2667 18.1878 179.2201 165 E 4.0038 8.1545 116.6657 59.3822 29.7705 178.2946 166 L 4.3814 7.5294 115.6686 54.3773 41.5098 177.3002 167 G 3.9569 8.0282 106.3192 46.3268 0.0000 173.6500 168 Q 4.6584 8.3277 117.1187 53.1587 32.1824 175.2603 169 A 4.4231 8.2707 122.0306 51.1954 19.2795 176.2021 170 P 4.3863 0.0000 0.0000 64.2473 31.8689 177.4586 171 K 3.8267 8.1073 115.2061 57.1692 29.5998 174.8134 172 L 4.1778 7.8475 121.3183 55.2400 41.4848 177.7803 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 22 L 8.28 5.14 0.00 1.59 1.70 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.23 3.89 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 24 D 8.89 4.38 0.00 2.94 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 25 S 8.37 4.16 0.00 4.04 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 26 K 8.07 3.96 0.00 1.97 1.85 0.00 1.64 0.00 0.00 1.80 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.60 7.81 27 A 7.88 4.01 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 28 V 8.09 3.71 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 0.98 0.00 0.00 0.80 0.00 0.00 29 L 8.33 4.26 0.00 1.96 1.79 0.92 0.14 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 30 N 8.33 4.39 0.00 2.85 2.61 0.00 0.00 6.84 6.95 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 31 Q 8.49 4.24 0.00 2.37 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.76 0.00 32 A 8.43 4.21 1.73 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 33 V 7.98 3.58 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1.04 0.00 0.00 34 A 8.34 4.10 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 D 8.56 4.42 0.00 2.89 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.71 4.21 0.00 1.74 1.80 1.15 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.80 3.91 0.00 3.47 3.24 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 38 V 7.92 3.66 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 1.09 0.00 0.00 0.98 0.00 0.00 39 A 8.55 4.02 1.52 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 0.00 0.00 40 H 8.55 4.00 0.00 3.39 3.46 0.00 5.79 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 41 S 8.02 4.12 0.00 4.04 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 8.08 3.72 1.99 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.59 0.87 0.00 0.00 43 L 8.28 3.95 0.00 1.75 1.67 1.09 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 44 H 8.22 3.70 0.00 3.07 2.81 0.00 5.59 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 45 Q 8.05 4.29 0.00 2.27 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.55 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 46 V 7.94 3.67 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 0.96 0.00 0.00 1.03 0.00 0.00 47 H 8.16 4.19 0.00 3.05 3.36 0.00 6.01 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.23 4.67 0.00 3.68 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 8.75 4.44 0.00 3.12 3.03 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 50 M 7.56 4.51 0.00 2.29 2.38 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.89 0.00 51 R 8.74 4.66 0.00 2.02 1.79 0.00 3.48 0.00 0.00 3.18 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.97 0.00 52 G 8.98 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 0.00 0.00 0.00 0.00 53 R 8.29 4.22 0.00 1.87 1.96 0.00 3.39 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.51 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 0.00 0.00 0.00 0.00 55 F 8.73 4.11 0.00 3.38 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 56 M 8.41 4.25 0.00 2.09 2.25 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 2.59 2.71 0.00 57 I 7.50 3.81 1.65 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.23 0.48 0.00 0.00 58 W 8.22 4.08 0.00 3.49 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 59 H 8.17 3.88 0.00 1.57 2.60 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.23 0.00 2.02 1.98 0.00 3.57 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.07 0.00 61 K 7.41 3.57 0.00 1.46 1.80 0.00 0.99 0.00 0.00 1.08 0.00 0.00 2.59 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.05 0.47 7.81 62 M 7.88 4.02 0.00 2.03 2.20 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 2.97 0.00 63 D 7.62 4.08 0.00 2.57 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 64 E 7.71 3.87 0.00 1.95 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.24 0.00 65 Y 7.82 4.45 0.00 3.21 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 M 8.42 3.99 0.00 1.75 2.05 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.17 0.00 67 E 8.29 3.88 0.00 1.98 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 0.00 2.25 2.27 0.00 68 E 8.44 3.68 0.00 2.06 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 1.76 2.04 0.00 69 I 8.13 3.73 2.10 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.13 1.05 0.00 0.00 70 D 8.57 4.47 0.00 2.84 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 7.75 3.44 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 0.00 72 Y 7.28 4.33 0.00 3.21 2.87 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 73 L 8.09 4.03 0.00 1.78 1.85 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.19 4.32 0.00 2.90 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 E 8.24 3.93 0.00 2.08 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 2.31 2.49 0.00 76 M 8.45 3.92 0.00 1.93 2.15 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.01 0.00 77 S 8.28 4.13 0.00 4.07 4.18 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 78 E 8.21 3.93 0.00 2.14 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 2.32 2.37 0.00 79 R 7.91 3.82 0.00 1.96 1.95 0.00 3.10 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 80 L 8.03 3.92 0.00 1.86 1.82 0.92 0.82 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 81 I 7.90 3.85 2.00 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 1.52 0.88 0.91 0.00 0.00 82 T 7.90 3.92 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 1.19 0.00 0.00 83 L 7.80 4.38 0.00 1.76 1.68 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.07 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 0.00 0.00 0.00 0.00 85 G 8.01 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 86 A 7.98 4.46 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 87 P 0.00 4.57 0.00 2.28 2.08 0.00 3.79 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.01 0.00 88 F 8.65 4.53 0.00 3.40 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 89 S 8.71 4.83 0.00 4.02 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 90 T 6.79 4.49 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 1.18 0.00 0.00 91 L 8.25 3.99 0.00 1.70 1.81 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 92 K 7.82 3.85 0.00 1.76 1.71 0.00 1.69 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.49 7.81 93 E 7.76 3.69 0.00 1.91 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 94 F 7.57 4.41 0.00 3.23 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.25 4.16 0.00 3.94 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 96 E 8.21 4.10 0.00 1.94 1.92 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 2.30 2.40 0.00 97 N 8.00 4.49 0.00 2.30 2.73 0.00 0.00 6.97 8.33 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 98 S 7.44 4.50 0.00 4.08 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 99 Q 8.78 4.31 0.00 1.87 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.64 0.00 0.00 0.00 0.00 0.00 2.41 2.66 0.00 100 L 7.64 4.02 0.00 1.52 1.45 0.97 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.24 4.59 0.00 1.73 1.55 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.24 0.98 7.81 102 E 8.51 4.75 0.00 1.92 1.87 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 2.22 2.29 0.00 103 V 7.71 4.54 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 0.70 0.00 0.00 0.86 0.00 0.00 104 L 8.28 4.03 0.00 1.55 1.51 0.90 0.86 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 0.00 105 G 8.03 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 D 7.35 4.45 0.00 2.48 2.35 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 0.00 107 Y 8.72 5.08 0.00 3.11 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 N 9.10 4.56 0.00 2.80 2.92 0.00 0.00 6.89 7.56 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 0.00 109 V 7.07 3.60 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 0.81 0.00 0.00 0.96 0.00 0.00 110 T 8.58 4.17 4.25 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 1.28 0.00 0.00 111 I 8.31 3.68 1.89 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.06 0.85 0.00 0.00 112 E 8.11 3.83 0.00 1.97 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 2.34 2.37 0.00 113 E 8.18 3.94 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 2.30 2.33 0.00 114 Q 8.13 3.94 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.58 2.60 0.00 115 L 7.97 3.72 0.00 1.35 1.23 -0.23 0.14 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 0.00 116 A 7.97 3.86 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 0.00 117 R 7.89 3.76 0.00 1.87 2.06 0.00 3.08 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 118 V 7.56 3.26 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 -0.04 0.00 0.00 0.83 0.00 0.00 119 V 7.87 3.52 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 0.77 0.00 0.00 0.86 0.00 0.00 120 E 8.16 4.02 0.00 2.03 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 2.24 2.19 0.00 121 V 7.79 3.85 2.14 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 1.18 0.00 0.00 0.95 0.00 0.00 122 F 8.60 4.40 0.00 3.21 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 R 8.72 3.94 0.00 2.00 2.00 0.00 3.14 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.85 0.00 124 Y 8.09 3.94 0.00 3.11 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 0.00 125 L 8.16 3.38 0.00 1.60 0.87 1.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.04 3.76 1.28 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 0.00 0.00 0.00 127 A 7.73 3.80 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 0.00 128 L 7.46 3.62 0.00 1.05 1.31 0.88 1.08 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 0.00 129 F 8.13 4.35 0.00 3.10 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 0.00 130 Q 8.32 4.00 0.00 2.18 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.38 0.00 131 K 8.04 4.00 0.00 1.82 1.81 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.38 1.33 7.81 132 G 7.72 2.55 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 0.00 0.00 0.00 0.00 133 F 8.29 4.08 0.00 3.25 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 D 8.53 4.41 0.00 2.87 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 0.00 135 V 8.01 3.65 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 0.85 0.00 0.00 0.95 0.00 0.00 136 S 8.07 4.51 0.00 4.22 4.18 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 0.00 137 D 8.12 4.14 0.00 2.43 2.65 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 0.00 138 E 7.94 4.00 0.00 2.12 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 2.26 2.23 0.00 139 E 8.14 4.44 0.00 2.01 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 2.30 2.45 0.00 140 G 7.69 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 0.00 141 D 7.64 4.60 0.00 2.73 2.55 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 0.00 142 S 8.01 4.07 0.00 4.05 4.07 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 0.00 0.00 0.00 143 V 7.66 3.51 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.74 3.74 4.43 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 1.30 0.00 0.00 145 N 7.99 4.54 0.00 2.66 2.88 0.00 0.00 6.48 8.52 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 0.00 146 D 8.14 4.37 0.00 2.79 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 0.00 147 I 7.53 3.53 1.63 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.73 0.50 0.00 0.00 148 F 7.80 3.92 0.00 3.40 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 0.00 149 N 8.39 4.36 0.00 3.31 3.03 0.00 0.00 6.82 7.73 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 0.00 150 V 8.04 3.55 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 0.98 0.00 0.00 1.04 0.00 0.00 151 A 7.60 3.49 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 K 8.42 4.10 0.00 2.08 1.84 0.00 1.60 0.00 0.00 1.64 0.00 0.00 2.73 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.59 1.51 7.81 153 A 7.94 3.97 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 0.00 154 S 7.97 4.08 0.00 4.02 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 0.00 155 I 7.86 3.56 1.97 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.91 0.63 0.00 0.00 156 E 8.48 4.05 0.00 2.22 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 2.33 2.43 0.00 157 K 7.99 4.27 0.00 2.08 2.01 0.00 1.74 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.70 1.94 7.81 158 H 8.21 4.44 0.00 3.39 3.43 0.00 5.68 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 0.00 159 I 8.05 3.84 2.16 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 1.58 1.07 1.00 0.00 0.00 160 W 8.33 4.36 0.00 3.43 3.45 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 0.00 0.00 0.00 0.00 161 M 7.56 3.39 0.00 1.95 2.03 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.13 0.00 162 L 8.32 3.99 0.00 1.90 1.61 0.83 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.51 3.97 0.00 2.37 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.51 2.73 0.00 164 A 8.50 4.18 1.39 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 0.00 0.00 0.00 165 E 8.15 4.00 0.00 2.22 2.20 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 2.29 2.41 0.00 166 L 7.53 4.38 0.00 1.80 1.63 0.81 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 167 G 8.03 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 0.00 168 Q 8.33 4.66 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 169 A 8.27 4.42 1.27 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 0.00 0.00 170 P 0.00 4.39 0.00 2.12 2.28 0.00 3.89 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 2.08 2.39 0.00 171 K 8.11 3.83 0.00 1.88 1.85 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.46 7.81 172 L 7.85 4.18 0.00 1.63 1.58 0.97 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00