NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4018 8.3044 120.3168 55.2398 32.0887 173.6310 2 R 4.3942 7.9762 125.3272 51.9229 33.0947 174.1133 3 P 4.4323 0.0000 0.0000 62.1541 30.1092 172.7863 4 S 3.9212 8.0120 117.6160 56.2621 63.8331 174.6108 5 G 4.0090 7.6318 111.1226 46.4397 0.0000 176.6230 6 R 4.2113 8.6935 122.0637 55.0333 29.4457 176.0376 7 K 4.1070 8.5463 122.0751 57.5420 32.7761 177.2838 8 S 3.9332 8.7430 117.0229 59.6470 60.3842 173.0664 9 S 4.3195 7.1357 118.0203 57.6924 61.9283 173.5857 10 K 3.8504 8.1759 114.3917 57.2076 28.5501 173.9863 11 M 4.2273 8.1770 123.9909 55.2209 32.6883 177.5575 12 Q 4.4912 8.5639 123.7500 55.2292 27.7296 176.4068 13 A 4.4788 7.7718 122.1394 51.8457 20.1429 177.7824 14 F 4.2514 9.2263 125.1940 56.5057 42.9110 174.0947 15 R 5.0541 7.9976 123.6360 54.6023 34.1364 173.6691 16 I 5.3949 8.2440 116.4451 59.4208 41.3776 174.3166 17 W 5.7585 9.2043 120.4867 56.4472 31.6801 172.8038 18 D 4.3903 8.5880 117.6033 51.8090 42.0275 176.4230 19 V 3.0050 7.7011 120.7414 65.6410 31.5626 176.8594 20 N 4.6678 8.0405 115.8418 53.5955 38.4265 174.9869 21 Q 3.6125 7.7537 113.9921 56.3217 26.0639 173.4066 22 K 4.4799 7.9179 117.0584 55.0298 37.8013 177.1325 23 T 5.3152 8.9086 112.7272 60.4500 72.8138 172.3252 24 F 5.3095 9.0241 122.0913 56.2936 40.7931 175.1601 25 Y 5.1345 8.2976 119.9895 55.8351 41.5181 173.9290 26 L 4.7688 8.5688 125.1314 54.5060 42.4239 175.1037 27 R 4.4680 8.2143 122.4654 56.7693 32.2841 175.3602 28 N 4.7932 7.4827 114.0642 53.7808 41.8595 174.3336 29 N 4.9616 7.9231 115.0040 53.1882 40.2071 174.0632 30 Q 4.6408 7.4770 114.3627 55.0059 34.0066 173.9420 31 L 4.6434 8.5415 122.3194 54.0325 42.5005 176.5408 32 V 3.9943 8.7731 124.9339 62.4544 32.7264 174.6199 33 A 3.8265 8.2447 127.0208 52.5271 21.1835 177.1677 34 G 3.6921 9.4172 110.5716 46.0982 0.0000 174.7320 35 Y 5.2556 7.9479 114.5987 56.7907 41.7191 173.9114 36 L 4.1063 8.2168 124.7384 56.2687 41.4556 177.8241 37 Q 4.6487 9.3019 110.9834 54.4157 33.3315 176.1440 38 G 3.9854 8.1811 110.4943 43.5677 0.0000 170.5378 39 P 4.3401 0.0000 0.0000 65.5198 32.2199 177.8451 40 N 4.8585 7.2447 111.8626 52.9029 39.7399 174.9034 41 V 3.1496 7.5618 113.8625 64.5374 30.3637 173.3201 42 N 4.9073 7.5465 118.1356 51.9145 38.2596 172.0217 43 L 4.6451 7.0656 119.8986 54.6407 46.8917 176.4852 44 E 3.6593 7.9156 121.7679 57.3575 25.9816 173.6911 45 E 4.4417 8.2979 118.4096 56.0252 30.2223 176.1856 46 K 4.3583 7.9641 118.3258 56.6187 33.0037 175.6029 47 I 4.6552 8.4136 125.6432 58.9434 41.6178 173.6748 48 D 5.2157 8.5015 128.8395 53.3381 42.3354 175.4365 49 V 4.3265 8.3896 127.3073 60.9347 32.6225 175.6695 50 V 4.5650 8.6112 126.5554 60.3484 33.6476 172.9908 51 P 5.0493 0.0000 0.0000 61.7943 32.9005 176.0489 52 I 3.8064 8.6476 122.1356 63.4089 37.4344 175.5111 53 E 4.8035 7.0362 118.1830 56.5546 37.4300 174.0709 54 P 4.4623 0.0000 0.0000 61.3340 30.5325 175.5284 55 H 4.4207 8.4326 128.3636 57.9408 30.4440 175.1712 56 A 4.3348 7.7326 122.0460 51.8563 20.3450 174.4573 57 L 4.6240 7.7252 129.5882 55.3171 46.5398 176.4008 58 F 5.5394 7.7563 114.7721 55.4060 42.1127 172.1865 59 L 5.2000 8.5063 117.5798 53.1753 45.5059 176.5118 60 G 3.7689 7.9830 106.0752 45.9883 0.0000 171.7318 61 I 4.4535 9.7183 130.1442 59.4362 37.6491 173.0599 62 H 4.1990 6.3471 114.2118 56.5213 26.5261 173.6443 63 G 4.1694 9.6824 114.8539 44.6627 0.0000 173.3477 64 G 3.9544 7.6398 113.7293 44.8167 0.0000 172.5119 65 K 3.6503 8.3040 130.2976 57.9351 29.4377 176.2269 66 M 4.6688 8.1335 119.5073 53.9660 34.5628 174.8363 67 C 4.6585 9.0415 128.8029 58.7128 33.1381 172.4030 68 L 4.9173 8.8098 127.8888 54.2599 42.3072 176.1233 69 S 4.8159 8.9212 118.1651 56.7841 67.2526 173.4106 70 C 4.9224 8.1785 118.8186 58.5845 27.2403 174.1220 71 V 3.6890 8.3610 123.8303 60.9387 33.2145 175.4378 72 K 4.4281 8.3349 123.1837 53.8999 32.5905 177.2859 73 S 4.5710 8.3118 127.7941 56.7825 62.7221 174.9597 74 G 3.8147 8.5068 116.1951 46.7127 0.0000 173.1400 75 D 4.4848 9.4318 118.1565 55.8622 40.9302 177.5366 76 E 4.3479 7.8828 120.2131 55.7433 30.5722 174.9860 77 T 5.2731 7.8637 118.6790 61.5726 73.0273 173.2444 78 R 4.5945 8.1735 125.1747 53.7393 34.7447 173.3809 79 L 4.7433 8.4018 123.7651 55.0862 42.6608 175.6909 80 Q 4.5946 9.0130 126.9550 54.4386 33.0898 173.8787 81 L 5.1322 8.5203 126.4298 54.5355 39.6183 174.6537 82 E 4.3044 8.9550 125.7815 56.4793 31.6322 176.3773 83 A 4.6829 8.6444 125.2328 51.6781 18.9011 177.6026 84 V 4.1123 8.3467 123.8442 60.6583 32.0489 176.3358 85 N 4.7716 8.4628 127.0436 52.0055 37.8534 175.6438 86 I 4.3417 7.3724 117.7102 61.5782 40.9619 173.7103 87 T 4.2038 8.5284 122.4409 64.0978 67.9146 175.4667 88 D 4.3721 8.1656 120.5269 56.9116 41.0697 176.4337 89 L 4.2752 7.7006 120.4545 53.7277 40.9174 176.2090 90 S 4.5917 8.2196 118.0502 56.3117 64.8171 173.2211 91 E 4.1446 9.0167 128.1227 56.0758 29.8962 176.3755 92 N 4.5350 8.7909 122.6807 55.5668 39.2776 174.4492 93 R 4.2536 7.2516 112.4809 55.9393 32.9462 173.0619 94 K 3.8055 7.6676 123.3362 55.7690 32.9660 175.5282 95 Q 4.2234 8.0791 122.8811 54.3957 30.0907 175.0651 96 D 4.4086 8.3002 118.5650 54.3498 40.6129 174.9961 97 K 4.6428 7.9997 124.8662 55.1459 36.4444 176.8249 98 R 4.5518 8.2996 119.5927 55.3305 27.5590 175.4188 99 F 4.3245 7.7813 117.9070 57.1306 45.9309 173.5649 100 A 4.6239 7.3996 122.1024 50.0737 22.2490 175.2314 101 F 5.6530 8.7624 115.7334 55.5863 44.0034 174.6912 102 I 4.3141 8.3551 123.3509 60.2180 38.4235 175.3111 103 R 4.6830 8.4706 127.8456 55.1767 29.1210 176.5826 104 S 4.3693 8.4797 122.0261 57.1352 61.0501 171.3676 105 D 4.2137 7.8401 119.7620 53.2774 40.9604 177.7160 106 S 4.4327 8.3157 125.1598 56.8422 62.9968 176.0758 107 G 3.8382 8.0412 117.7670 45.9487 0.0000 172.4246 108 P 4.0664 0.0000 0.0000 63.9874 32.3692 175.9049 109 T 4.8080 7.5021 108.9779 60.0679 72.3101 173.0022 110 T 4.9235 8.1595 117.8784 59.7439 71.4419 172.1789 111 S 4.5064 7.8093 115.4554 57.2295 67.8347 173.8617 112 F 5.1111 8.9518 122.7641 55.8032 40.2194 174.8635 113 E 4.5486 9.1835 125.7939 56.1098 31.1170 175.3826 114 S 4.5252 8.6446 118.4020 58.8105 65.8661 172.6543 115 A 3.7215 10.5458 130.9109 52.3845 16.7059 178.1924 116 A 4.3888 5.8000 124.1602 52.1322 26.3000 178.7139 117 C 4.2204 8.5323 116.7883 60.8158 29.5336 174.7553 118 P 4.4543 0.0000 0.0000 61.5443 34.1967 175.4784 119 G 4.0274 8.3847 109.1775 44.6498 0.0000 175.3849 120 W 4.9298 5.6394 120.8715 54.9352 34.4027 173.9335 121 F 5.2512 9.4220 117.8055 56.7219 40.3291 176.3811 122 L 4.2210 8.4911 124.5347 55.7424 41.0219 174.9623 123 C 5.4623 7.8064 120.8418 59.9741 31.4320 172.3042 124 T 4.8853 7.8510 112.7571 62.6259 72.8977 173.6425 125 A 4.1860 8.1672 127.0218 52.7159 18.6246 177.8230 126 M 3.9123 8.7613 121.1515 58.1822 32.5948 176.1614 127 E 4.4883 7.5797 114.8704 54.0723 32.6659 176.3367 128 A 4.4822 8.4118 121.4709 51.0804 16.5455 175.7664 129 D 4.7499 7.4902 122.8498 54.2411 47.2052 176.9628 130 Q 4.3111 7.7430 118.9730 54.0366 30.3591 173.2305 131 P 5.2086 0.0000 0.0000 61.3271 34.8073 174.4811 132 V 3.9917 7.7695 119.6707 62.5435 32.1068 176.0872 133 S 4.4971 8.9112 118.1078 56.8177 65.8993 173.1692 134 L 4.9457 8.7930 126.2930 53.8393 41.3689 176.6112 135 T 4.8505 9.0404 116.1351 60.5305 70.9145 175.3885 136 N 4.6425 9.1645 117.8300 54.2746 38.0814 174.8083 137 M 4.5037 7.6485 117.1430 52.3731 35.9909 173.9310 138 P 4.3933 0.0000 0.0000 62.3485 33.6059 175.8597 139 D 4.6007 8.3529 115.7211 53.7371 39.8332 177.3540 140 E 4.3680 7.6452 121.6966 55.3927 30.2370 177.0474 141 G 3.6370 7.8986 103.9425 47.4969 0.0000 171.5314 142 V 4.2785 6.7439 113.1168 62.0589 34.9474 178.6481 143 M 4.6038 7.3641 121.8587 53.5738 35.9424 175.3255 144 V 4.0129 8.4331 119.5553 62.6746 30.3957 176.7942 145 T 5.2702 7.9806 127.1219 60.3318 67.4385 176.5038 146 K 4.8805 7.7323 118.9797 55.5704 33.3636 175.1066 147 F 5.1179 8.3295 122.0387 55.6621 41.5971 174.8013 148 Y 4.8427 8.8958 123.3929 57.0595 40.0056 173.8084 149 F 5.4996 8.8055 128.9405 57.2121 40.5949 174.6105 150 Q 4.7988 9.1441 125.2297 54.0251 32.2310 174.2981 151 E 4.0507 8.3496 122.6621 54.6947 31.9417 177.1182 152 D 4.0757 8.8257 123.6535 55.8003 39.6783 174.0691 153 E 4.1947 8.6697 124.3228 57.5089 29.9122 175.6133 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 4.40 0.00 1.01 1.32 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.29 0.00 2 R 7.98 4.39 0.00 1.89 1.75 0.00 3.34 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.66 0.00 3 P 0.00 4.43 0.00 2.23 2.16 0.00 3.96 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 2.00 2.07 0.00 4 S 8.01 3.92 0.00 4.03 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 5 G 7.63 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 6 R 8.69 4.21 0.00 1.83 1.88 0.00 3.22 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 7 K 8.55 4.11 0.00 1.87 1.72 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.52 7.81 8 S 8.74 3.93 0.00 4.01 3.94 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 9 S 7.14 4.32 0.00 4.11 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 10 K 8.18 3.85 0.00 1.84 2.06 0.00 1.79 0.00 0.00 1.79 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.38 7.81 11 M 8.18 4.23 0.00 2.13 2.08 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 2.56 2.50 0.00 12 Q 8.56 4.49 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 7.08 0.00 0.00 0.00 0.00 0.00 2.43 2.36 0.00 13 A 7.77 4.48 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 14 F 9.23 4.25 0.00 3.11 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 15 R 8.00 5.05 0.00 1.66 1.59 0.00 2.99 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 16 I 8.24 5.39 1.11 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.01 1.30 0.00 0.00 17 W 9.20 5.76 0.00 3.71 3.31 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 18 D 8.59 4.39 0.00 2.71 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 19 V 7.70 3.00 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 0.88 0.00 0.00 0.71 0.00 0.00 20 N 8.04 4.67 0.00 2.74 2.73 0.00 0.00 7.34 6.91 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 21 Q 7.75 3.61 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.25 6.84 0.00 0.00 0.00 0.00 0.00 2.34 2.57 0.00 22 K 7.92 4.48 0.00 1.55 1.43 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.11 1.13 7.81 23 T 8.91 5.32 4.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 24 F 9.02 5.31 0.00 2.93 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 25 Y 8.30 5.13 0.00 2.95 2.99 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 26 L 8.57 4.77 0.00 1.61 1.57 1.01 0.91 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 27 R 8.21 4.47 0.00 1.86 1.89 0.00 3.37 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 28 N 7.48 4.79 0.00 2.61 2.68 0.00 0.00 6.69 7.79 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 29 N 7.92 4.96 0.00 2.66 2.75 0.00 0.00 6.74 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.48 4.64 0.00 1.96 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 7.20 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 31 L 8.54 4.64 0.00 1.74 1.78 1.03 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 32 V 8.77 3.99 1.77 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 0.94 0.00 0.00 1.03 0.00 0.00 33 A 8.24 3.83 1.01 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 0.00 0.00 0.00 0.00 0.00 34 G 9.42 3.69 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 0.00 0.00 0.00 35 Y 7.95 5.26 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 36 L 8.22 4.11 0.00 1.68 1.46 0.99 0.69 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 37 Q 9.30 4.65 0.00 2.08 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.93 0.00 0.00 0.00 0.00 0.00 2.27 2.38 0.00 38 G 8.18 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 39 P 0.00 4.34 0.00 2.01 2.09 0.00 3.57 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.08 0.00 40 N 7.24 4.86 0.00 2.58 2.68 0.00 0.00 6.85 7.65 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 41 V 7.56 3.15 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 0.75 0.00 0.00 0.87 0.00 0.00 42 N 7.55 4.91 0.00 2.65 2.65 0.00 0.00 7.03 7.76 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 43 L 7.07 4.65 0.00 1.51 1.53 0.14 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 44 E 7.92 3.66 0.00 2.10 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 2.20 2.21 0.00 45 E 8.30 4.44 0.00 2.03 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 2.53 2.49 0.00 46 K 7.96 4.36 0.00 1.76 1.73 0.00 1.62 0.00 0.00 1.70 0.00 0.00 2.75 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.47 1.41 7.81 47 I 8.41 4.66 1.77 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.83 0.93 0.00 0.00 48 D 8.50 5.22 0.00 2.84 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 49 V 8.39 4.33 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 0.71 0.00 0.00 0.84 0.00 0.00 50 V 8.61 4.57 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 1.20 0.00 0.00 1.15 0.00 0.00 51 P 0.00 5.05 0.00 2.15 2.17 0.00 3.88 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 52 I 8.65 3.81 1.90 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.86 0.92 0.00 0.00 53 E 7.04 4.80 0.00 2.07 1.84 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 2.16 2.26 0.00 54 P 0.00 4.46 0.00 2.20 2.13 0.00 3.88 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 55 H 8.43 4.42 0.00 3.18 3.46 0.00 5.93 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 7.73 4.33 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 57 L 7.73 4.62 0.00 1.71 0.92 0.58 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 58 F 7.76 5.54 0.00 3.08 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 59 L 8.51 5.20 0.00 1.75 1.54 0.56 1.31 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 60 G 7.98 3.77 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 0.00 0.00 0.00 61 I 9.72 4.45 1.85 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 1.31 1.36 0.94 0.00 0.00 62 H 6.35 4.20 0.00 3.36 3.23 0.00 5.76 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 G 9.68 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 G 7.64 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 65 K 8.30 3.65 0.00 1.97 2.01 0.00 1.64 0.00 0.00 1.75 0.00 0.00 2.88 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.43 1.36 7.81 66 M 8.13 4.67 0.00 2.18 2.07 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 2.73 2.52 0.00 67 C 9.04 4.66 0.00 3.07 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 68 L 8.81 4.92 0.00 1.75 1.75 1.02 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 69 S 8.92 4.82 0.00 3.06 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 70 C 8.18 4.92 0.00 2.74 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 71 V 8.36 3.69 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 0.72 0.00 0.00 0.84 0.00 0.00 72 K 8.33 4.43 0.00 1.76 1.77 0.00 1.50 0.00 0.00 0.61 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.33 7.81 73 S 8.31 4.57 0.00 3.81 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 G 8.51 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 75 D 9.43 4.48 0.00 2.87 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 76 E 7.88 4.35 0.00 2.08 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.14 0.00 77 T 7.86 5.27 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 78 R 8.17 4.59 0.00 1.62 1.59 0.00 3.17 0.00 0.00 3.12 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.58 0.00 79 L 8.40 4.74 0.00 1.80 1.63 1.17 0.70 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 80 Q 9.01 4.59 0.00 2.15 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.07 0.00 0.00 0.00 0.00 0.00 2.22 2.33 0.00 81 L 8.52 5.13 0.00 1.75 1.78 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 82 E 8.96 4.30 0.00 2.13 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 0.00 2.53 2.37 0.00 83 A 8.64 4.68 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 84 V 8.35 4.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 1.03 0.00 0.00 85 N 8.46 4.77 0.00 2.87 2.96 0.00 0.00 6.02 7.83 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 86 I 7.37 4.34 1.88 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 1.31 0.52 0.93 0.00 0.00 87 T 8.53 4.20 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 1.22 0.00 0.00 88 D 8.17 4.37 0.00 2.70 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 89 L 7.70 4.28 0.00 1.62 1.65 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 90 S 8.22 4.59 0.00 3.81 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 91 E 9.02 4.14 0.00 1.42 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 2.02 2.21 0.00 92 N 8.79 4.54 0.00 2.69 2.81 0.00 0.00 7.00 7.66 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 93 R 7.25 4.25 0.00 1.73 1.80 0.00 3.35 0.00 0.00 3.12 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 94 K 7.67 3.81 0.00 1.58 1.55 0.00 1.42 0.00 0.00 1.32 0.00 0.00 2.71 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.12 1.20 7.81 95 Q 8.08 4.22 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.83 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 96 D 8.30 4.41 0.00 2.60 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 8.00 4.64 0.00 1.79 1.70 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.38 7.81 98 R 8.30 4.55 0.00 1.84 2.06 0.00 3.32 0.00 0.00 3.31 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 99 F 7.78 4.32 0.00 2.88 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 0.00 100 A 7.40 4.62 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 F 8.76 5.65 0.00 2.64 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 0.00 102 I 8.36 4.31 1.91 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 1.50 1.15 0.92 0.00 0.00 103 R 8.47 4.68 0.00 1.43 1.77 0.00 3.03 0.00 0.00 3.02 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.39 0.00 104 S 8.48 4.37 0.00 3.94 3.72 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 0.00 105 D 7.84 4.21 0.00 2.42 2.43 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 0.00 106 S 8.32 4.43 0.00 3.76 3.76 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 0.00 107 G 8.04 3.84 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 0.00 0.00 0.00 108 P 0.00 4.07 0.00 1.98 2.20 0.00 3.76 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.94 0.00 109 T 7.50 4.81 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 1.22 0.00 0.00 110 T 8.16 4.92 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 111 S 7.81 4.51 0.00 3.69 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 0.00 112 F 8.95 5.11 0.00 3.11 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 0.00 113 E 9.18 4.55 0.00 2.19 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 2.37 2.27 0.00 114 S 8.64 4.53 0.00 4.18 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 0.00 115 A 10.55 3.72 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 0.00 116 A 5.80 4.39 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 0.00 117 C 8.53 4.22 0.00 3.05 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 0.00 118 P 0.00 4.45 0.00 2.13 2.14 0.00 3.93 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 2.02 1.91 0.00 119 G 8.38 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 0.00 0.00 0.00 120 W 5.64 4.93 0.00 3.35 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 0.00 121 F 9.42 5.25 0.00 3.25 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 0.00 122 L 8.49 4.22 0.00 2.16 2.45 1.25 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 123 C 7.81 5.46 0.00 3.15 2.99 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 0.00 124 T 7.85 4.89 4.15 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 0.32 0.00 0.00 125 A 8.17 4.19 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 0.00 126 M 8.76 3.91 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 127 E 7.58 4.49 0.00 1.94 1.85 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 2.19 2.20 0.00 128 A 8.41 4.48 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 0.00 129 D 7.49 4.75 0.00 2.73 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 0.00 130 Q 7.74 4.31 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.63 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 131 P 0.00 5.21 0.00 2.07 2.15 0.00 3.64 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 1.95 1.90 0.00 132 V 7.77 3.99 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.01 0.00 0.00 133 S 8.91 4.50 0.00 3.90 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 0.00 134 L 8.79 4.95 0.00 1.64 1.94 1.18 1.29 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 0.00 135 T 9.04 4.85 4.42 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 1.39 0.00 0.00 136 N 9.16 4.64 0.00 2.85 3.17 0.00 0.00 5.81 7.72 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 0.00 137 M 7.65 4.50 0.00 1.86 1.91 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 2.46 2.40 0.00 138 P 0.00 4.39 0.00 2.07 1.85 0.00 3.66 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.74 0.00 139 D 8.35 4.60 0.00 2.65 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 0.00 140 E 7.65 4.37 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 2.30 2.25 0.00 141 G 7.90 3.64 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 0.00 0.00 0.00 142 V 6.74 4.28 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 0.91 0.00 0.00 0.94 0.00 0.00 143 M 7.36 4.60 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 144 V 8.43 4.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.89 0.00 0.00 145 T 7.98 5.27 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 146 K 7.73 4.88 0.00 1.72 1.72 0.00 1.63 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.33 1.38 7.81 147 F 8.33 5.12 0.00 3.32 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 Y 8.90 4.84 0.00 2.84 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 0.00 0.00 0.00 0.00 149 F 8.81 5.50 0.00 2.97 3.09 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 0.00 150 Q 9.14 4.80 0.00 1.92 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.51 0.00 0.00 0.00 0.00 0.00 2.76 2.34 0.00 151 E 8.35 4.05 0.00 1.74 1.68 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 2.09 2.29 0.00 152 D 8.83 4.08 0.00 2.74 2.44 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 0.00 153 E 8.67 4.19 0.00 1.87 1.75 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 2.15 2.20 0.00