NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4458 8.3049 120.3270 55.3870 33.4787 173.9597 2 R 4.4194 8.0754 118.4946 53.7625 33.6216 173.3606 3 R 4.7823 8.7406 121.3092 54.9314 33.7083 173.6700 4 Y 5.3842 9.2315 121.7332 56.5882 42.8418 174.3064 5 E 5.1862 9.9371 121.7219 54.2731 30.8984 175.3472 6 V 3.9466 8.2026 123.4324 61.6173 33.2802 175.2940 7 N 5.3935 9.7966 121.6732 51.7657 41.3080 172.8676 8 I 4.8848 8.3829 125.0754 59.3732 40.3465 174.9683 9 V 4.6109 8.2926 125.2903 61.1695 33.8427 174.6540 10 L 5.1044 8.8150 127.7418 52.5950 44.7011 175.3142 11 N 4.7668 8.2837 120.6649 53.3193 39.1379 174.3481 12 P 4.4798 0.0000 0.0000 65.3499 31.9613 177.3945 13 N 4.4357 7.4827 116.4407 55.4198 38.6254 175.4307 14 L 4.0476 7.4130 118.7179 54.8101 42.4902 177.1775 15 D 4.7420 8.3884 129.1747 53.5387 40.5005 177.3804 16 Q 3.9300 8.8049 116.3797 59.1731 28.0922 178.6020 17 S 4.3303 8.0213 110.8151 59.9305 63.6563 175.0733 18 Q 4.4325 7.5993 119.6277 56.7482 30.2890 177.5625 19 L 3.8580 7.5654 119.6675 57.6426 41.5439 178.5710 20 A 4.1320 8.1322 120.8956 54.4412 18.1181 179.4494 21 L 3.8937 7.3342 118.3478 58.5871 42.3582 179.1517 22 E 4.0011 8.0177 118.1026 59.1067 29.3857 179.4006 23 K 4.1244 7.7266 117.8867 58.8631 32.1208 178.9855 24 E 4.1018 7.9105 116.5834 58.9198 29.6162 179.1542 25 I 3.7279 7.5123 120.8484 64.0067 37.0651 178.2731 26 I 3.6578 7.4987 120.3265 64.5913 37.0025 178.4537 27 Q 3.8317 8.0159 118.6913 58.8316 28.5026 178.9597 28 R 3.8387 8.2380 119.1078 59.4840 30.2687 178.8973 29 A 4.2238 8.2437 120.4452 55.1420 18.2472 179.6783 30 L 3.9132 8.0247 117.4581 58.1999 41.9217 179.5937 31 E 4.0718 8.1501 118.3705 59.3806 29.1169 179.2146 32 N 4.3291 8.4627 116.3067 56.7207 38.7400 176.8019 33 Y 4.1101 7.6817 115.9516 59.0333 38.0665 176.4247 34 G 4.1834 7.8535 108.4305 45.4020 0.0000 173.1754 35 A 4.6066 8.1836 122.0203 50.9526 19.5697 178.1218 36 R 4.4442 8.4225 121.4353 54.9020 32.1360 176.0624 37 V 4.0238 8.3272 117.6102 61.2435 32.0515 175.0978 38 E 4.6095 8.8286 125.2452 57.4366 31.0119 176.8064 39 K 4.7736 7.7050 117.9640 55.3997 36.0984 174.5913 40 V 4.4365 8.6303 124.0599 61.0203 32.7894 173.6782 41 E 4.1329 9.3224 125.8169 53.1757 29.4478 172.9001 42 E 3.7885 8.7631 135.0000 56.6514 27.6586 173.9854 43 L 4.2684 8.2901 122.8331 53.9475 43.4175 179.4357 44 G 3.2175 7.5097 107.6870 46.3879 0.0000 173.4118 45 L 5.0393 7.9595 123.7782 53.2539 42.7967 176.2450 46 R 4.7280 8.4476 120.3559 54.3189 35.1478 174.5408 47 R 4.3723 8.6173 121.1128 56.1930 30.4074 176.7187 48 L 4.1313 8.7437 125.6162 54.2465 42.2626 177.8250 49 A 4.1979 8.7423 126.1209 54.3348 18.6963 177.4381 50 Y 4.7327 7.4279 113.0443 53.9230 40.3001 172.9228 51 P 4.2775 0.0000 0.0000 63.2964 31.2402 175.3643 52 I 4.0664 8.0346 125.0852 60.8720 38.2336 176.3528 53 A 3.8629 9.1832 127.5119 53.5450 15.8512 177.3042 54 K 3.9255 8.4070 114.3513 58.2323 30.1621 175.2262 55 D 4.9794 7.8322 118.9532 51.9129 43.3703 174.9922 56 P 4.5417 0.0000 0.0000 64.2346 32.7661 175.1158 57 Q 5.2147 6.9235 117.8456 53.2160 32.7772 174.5017 58 G 3.8572 7.9445 102.8895 45.7790 0.0000 172.0913 59 Y 4.2454 8.3197 124.9598 56.8521 40.0266 173.9960 60 F 5.1979 8.5148 125.7429 55.7839 41.1582 175.2523 61 L 4.9151 8.8745 122.4796 52.6986 45.6559 175.3883 62 W 5.1971 8.2190 131.4150 55.8855 34.4843 173.2632 63 Y 4.2291 7.3421 122.8899 55.9884 41.8726 174.1470 64 Q 4.0837 7.3260 126.5003 55.7283 29.8953 175.0163 65 V 5.0506 8.6721 119.7323 59.5095 36.7852 174.4158 66 E 5.2955 8.4940 120.4693 55.0789 32.4591 174.6572 67 M 4.9194 8.5021 117.8309 53.5682 34.8396 173.9432 68 P 4.5777 0.0000 0.0000 64.2119 29.2846 178.2921 69 E 3.9934 8.5675 118.9118 57.5508 29.9512 176.0051 70 D 4.5414 6.4747 121.2587 56.9188 40.4086 178.4944 71 R 4.6079 7.7772 118.5707 56.4367 30.6584 179.0772 72 V 3.4359 7.9503 119.8126 65.9456 31.5539 176.6387 73 N 4.2308 7.9023 115.6732 56.5429 38.6223 176.8594 74 D 4.4698 8.1247 119.7502 57.4730 40.4956 178.7341 75 L 2.8421 7.3231 119.1097 57.5657 42.0058 178.7582 76 A 3.9036 8.0266 121.1524 55.2751 18.2609 179.8812 77 R 3.9189 8.4367 116.9841 59.1445 29.8981 178.7426 78 E 4.0803 7.7310 117.7266 58.4989 29.6097 178.4169 79 L 4.2143 7.1774 118.0232 57.6298 42.0831 178.8825 80 R 4.0422 7.6237 116.3016 59.2679 29.9624 178.4566 81 I 3.8921 7.3396 118.3283 63.7429 37.4682 176.3385 82 R 3.9669 7.6670 120.2647 56.2648 30.2476 177.0913 83 D 4.4548 8.9871 123.8158 56.6516 39.2460 178.1943 84 N 4.3522 8.1596 116.3735 55.6497 39.7483 174.9005 85 V 4.0663 8.0527 118.5451 63.0735 30.4886 176.3783 86 R 4.1426 9.2390 127.6861 58.7078 30.5864 177.4966 87 R 4.7701 7.9096 116.5635 54.1799 34.4260 174.5241 88 V 4.6610 8.3843 121.2535 61.3668 34.3284 174.3810 89 M 4.8767 8.9038 127.3000 53.8791 35.4657 173.7640 90 V 4.7117 8.5710 125.7322 59.8341 33.8512 175.0833 91 V 4.5192 8.1650 123.2391 60.4786 34.2828 174.7323 92 K 4.3888 9.1585 127.0315 57.4980 32.5790 177.3292 93 S 4.4521 8.8212 121.5773 58.7030 61.8092 173.7304 94 Q 4.6539 8.4136 123.3463 54.0156 31.2038 176.8561 95 E 4.4745 8.3790 122.6975 55.9757 30.2666 174.0607 96 P 4.8213 0.0000 0.0000 61.5321 33.3935 174.6121 97 F 4.8495 8.3688 119.9681 56.1693 42.1184 173.7015 98 L 4.0590 7.5041 128.5105 53.2319 42.5545 175.2018 99 A 4.4354 7.9583 128.8044 51.2890 21.2285 174.8349 100 N 3.9714 8.6761 119.6882 54.0715 36.5918 173.8591 101 A 4.1057 7.9400 123.1157 51.8282 18.5022 177.7651 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 M 8.30 4.45 0.00 2.04 2.24 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.60 0.00 2 R 8.08 4.42 0.00 1.62 1.39 0.00 3.12 0.00 0.00 3.27 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 3 R 8.74 4.78 0.00 1.77 1.62 0.00 3.12 0.00 0.00 3.32 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 4 Y 9.23 5.38 0.00 2.81 2.92 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 5 E 9.94 5.19 0.00 2.01 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 0.00 2.60 2.41 0.00 6 V 8.20 3.95 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 0.88 0.00 0.00 0.96 0.00 0.00 7 N 9.80 5.39 0.00 2.83 2.92 0.00 0.00 6.60 6.81 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 8 I 8.38 4.88 1.97 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.86 1.00 0.00 0.00 9 V 8.29 4.61 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 0.53 0.00 0.00 0.84 0.00 0.00 10 L 8.81 5.10 0.00 1.63 1.48 0.95 0.35 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 11 N 8.28 4.77 0.00 2.70 2.74 0.00 0.00 7.31 7.55 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 12 P 0.00 4.48 0.00 2.24 2.19 0.00 3.79 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 1.98 2.11 0.00 13 N 7.48 4.44 0.00 3.15 2.92 0.00 0.00 7.01 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 14 L 7.41 4.05 0.00 1.65 1.55 0.85 0.94 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 15 D 8.39 4.74 0.00 2.89 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 16 Q 8.80 3.93 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.99 0.00 0.00 0.00 0.00 0.00 2.41 2.39 0.00 17 S 8.02 4.33 0.00 4.03 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 18 Q 7.60 4.43 0.00 1.90 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 19 L 7.57 3.86 0.00 1.77 1.77 0.65 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.13 4.13 1.36 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 0.00 0.00 0.00 21 L 7.33 3.89 0.00 1.82 1.72 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.02 4.00 0.00 2.13 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 2.30 2.45 0.00 23 K 7.73 4.12 0.00 2.09 1.87 0.00 1.50 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.50 1.38 7.81 24 E 7.91 4.10 0.00 2.27 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 2.36 2.58 0.00 25 I 7.51 3.73 2.01 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 1.51 0.71 0.91 0.00 0.00 26 I 7.50 3.66 2.01 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 1.54 0.80 0.86 0.00 0.00 27 Q 8.02 3.83 0.00 2.15 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.77 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 28 R 8.24 3.84 0.00 2.06 1.98 0.00 3.31 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 29 A 8.24 4.22 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 30 L 8.02 3.91 0.00 1.78 1.62 0.79 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.15 4.07 0.00 2.23 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 2.31 2.31 0.00 32 N 8.46 4.33 0.00 2.73 2.84 0.00 0.00 7.07 7.45 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 33 Y 7.68 4.11 0.00 3.00 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 34 G 7.85 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 0.00 0.00 0.00 35 A 8.18 4.61 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.42 4.44 0.00 1.79 1.84 0.00 3.12 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 37 V 8.33 4.02 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 0.51 0.00 0.00 0.89 0.00 0.00 38 E 8.83 4.61 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 2.26 2.22 0.00 39 K 7.71 4.77 0.00 1.96 1.96 0.00 1.61 0.00 0.00 2.23 0.00 0.00 3.40 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.49 1.69 7.81 40 V 8.63 4.44 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.16 0.00 0.00 41 E 9.32 4.13 0.00 2.25 1.91 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 2.37 2.47 0.00 42 E 8.76 3.79 0.00 2.21 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 0.00 2.27 2.52 0.00 43 L 8.29 4.27 0.00 1.57 1.58 0.74 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.51 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 0.00 0.00 0.00 45 L 7.96 5.04 0.00 1.49 1.59 0.98 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 46 R 8.45 4.73 0.00 1.75 1.74 0.00 3.00 0.00 0.00 3.12 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 47 R 8.62 4.37 0.00 1.70 1.91 0.00 3.38 0.00 0.00 3.23 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 48 L 8.74 4.13 0.00 1.57 1.43 0.89 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 49 A 8.74 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 50 Y 7.43 4.73 0.00 3.09 2.89 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 51 P 0.00 4.28 0.00 2.20 2.16 0.00 3.87 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 52 I 8.03 4.07 1.70 0.00 0.00 0.51 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 0.55 0.85 0.00 0.00 53 A 9.18 3.86 1.36 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 0.00 0.00 0.00 54 K 8.41 3.93 0.00 1.89 1.90 0.00 1.59 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.51 7.81 55 D 7.83 4.98 0.00 2.82 2.50 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 56 P 0.00 4.54 0.00 2.11 2.28 0.00 3.62 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 2.06 1.99 0.00 57 Q 6.92 5.21 0.00 1.89 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.87 0.00 0.00 0.00 0.00 0.00 2.25 2.22 0.00 58 G 7.94 3.86 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 0.00 0.00 0.00 59 Y 8.32 4.25 0.00 3.09 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 F 8.51 5.20 0.00 3.01 2.92 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 61 L 8.87 4.92 0.00 1.62 1.25 1.08 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 62 W 8.22 5.20 0.00 3.42 2.89 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 63 Y 7.34 4.23 0.00 2.60 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 64 Q 7.33 4.08 0.00 2.03 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 65 V 8.67 5.05 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 0.59 0.00 0.00 0.96 0.00 0.00 66 E 8.49 5.30 0.00 2.15 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 2.16 2.22 0.00 67 M 8.50 4.92 0.00 2.00 2.09 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 2.70 2.59 0.00 68 P 0.00 4.58 0.00 2.25 2.09 0.00 3.82 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.15 0.00 69 E 8.57 3.99 0.00 2.12 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 2.29 2.33 0.00 70 D 6.47 4.54 0.00 2.86 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 71 R 7.78 4.61 0.00 2.02 2.17 0.00 3.22 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.68 0.00 72 V 7.95 3.44 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 0.73 0.00 0.00 0.51 0.00 0.00 73 N 7.90 4.23 0.00 2.75 2.81 0.00 0.00 7.11 8.08 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 74 D 8.12 4.47 0.00 2.90 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 75 L 7.32 2.84 0.00 0.73 1.45 0.69 0.53 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 76 A 8.03 3.90 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 77 R 8.44 3.92 0.00 2.06 2.00 0.00 3.14 0.00 0.00 3.10 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 78 E 7.73 4.08 0.00 2.18 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.46 0.00 79 L 7.18 4.21 0.00 1.73 1.69 0.87 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 80 R 7.62 4.04 0.00 1.92 1.99 0.00 3.18 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 81 I 7.34 3.89 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.72 0.91 0.00 0.00 82 R 7.67 3.97 0.00 1.83 1.97 0.00 3.51 0.00 0.00 3.38 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 83 D 8.99 4.45 0.00 2.77 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.16 4.35 0.00 2.81 2.88 0.00 0.00 6.77 7.68 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 85 V 8.05 4.07 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 0.74 0.00 0.00 0.97 0.00 0.00 86 R 9.24 4.14 0.00 1.61 1.92 0.00 3.27 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.76 0.00 87 R 7.91 4.77 0.00 1.69 1.80 0.00 3.29 0.00 0.00 3.30 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 88 V 8.38 4.66 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 0.83 0.00 0.00 0.95 0.00 0.00 89 M 8.90 4.88 0.00 2.20 1.89 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 2.56 2.58 0.00 90 V 8.57 4.71 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 0.67 0.00 0.00 0.73 0.00 0.00 91 V 8.17 4.52 2.34 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 1.07 0.00 0.00 1.03 0.00 0.00 92 K 9.16 4.39 0.00 1.85 1.79 0.00 1.87 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.66 1.70 7.81 93 S 8.82 4.45 0.00 3.79 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 94 Q 8.41 4.65 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.90 0.00 0.00 0.00 0.00 0.00 2.30 2.40 0.00 95 E 8.38 4.47 0.00 2.08 1.91 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 2.27 2.38 0.00 96 P 0.00 4.82 0.00 2.20 2.09 0.00 3.73 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.94 0.00 97 F 8.37 4.85 0.00 2.92 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 98 L 7.50 4.06 0.00 1.35 1.19 0.82 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 99 A 7.96 4.44 1.32 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 0.00 100 N 8.68 3.97 0.00 2.82 2.78 0.00 0.00 7.06 7.96 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 0.00 101 A 7.94 4.11 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