NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 S 4.3188 8.3349 115.2887 57.6086 64.4293 174.4975 22 L 3.5748 7.8918 118.4980 54.2553 39.5932 174.8633 23 A 3.9872 9.0433 123.8635 55.9023 19.2985 178.8651 24 D 4.4277 8.3696 116.6873 56.9366 41.0731 179.2466 25 S 4.1813 8.6085 116.1970 61.6802 62.9279 176.8450 26 K 3.9924 8.3759 121.0607 59.3680 31.7397 179.3006 27 A 4.0240 8.0204 121.3414 55.1624 18.2490 180.1264 28 V 3.7633 8.2808 118.1394 64.7936 31.5691 178.5011 29 L 4.1964 8.2034 119.7485 57.8792 41.4842 179.0714 30 N 4.3528 8.2438 116.7874 56.3879 38.7781 176.5416 31 Q 4.2386 8.7791 121.4228 59.4803 29.1105 178.5718 32 A 4.2082 8.5457 121.9049 55.0937 18.4535 179.6038 33 V 3.5679 8.1441 116.6049 66.1957 31.6157 178.0830 34 A 4.1587 8.3706 120.2847 55.6058 18.2414 179.4543 35 D 4.4081 8.5231 117.4652 57.3733 40.8451 179.0677 36 L 3.9962 8.6438 120.1291 57.7674 41.7127 179.6523 37 S 3.9239 7.8914 115.3003 61.4264 62.5538 176.9491 38 V 3.6065 7.7972 120.7410 65.7544 31.2718 177.6930 39 A 3.9917 8.6430 121.2603 55.6317 18.1953 179.0040 40 H 3.9972 8.6179 116.8775 59.5380 29.8859 177.4063 41 S 4.1435 7.9218 114.3693 61.4116 62.1353 176.2256 42 I 3.6747 7.9680 122.6221 64.4046 36.8185 178.4187 43 L 3.9336 8.0281 119.9069 57.8626 41.3476 179.1559 44 H 3.6219 7.9963 118.1891 58.9495 29.7503 176.8642 45 Q 4.2608 7.9750 121.4630 59.5404 28.3765 178.6850 46 V 3.6642 8.0796 119.3581 66.2998 31.2830 177.3371 47 H 4.1514 8.1197 117.0176 59.1976 29.7385 176.9250 48 W 4.7511 8.2654 119.5355 59.2672 29.2905 177.3772 49 Y 4.4517 8.4127 114.4980 57.0027 37.8207 175.2377 50 M 4.4577 7.5653 120.6740 55.8005 32.9280 175.6023 51 R 4.6596 8.8925 123.6399 55.5069 34.5921 173.5206 52 G 4.0280 8.8846 106.2732 43.3818 0.0000 173.2673 53 R 4.2435 8.2977 119.0856 57.4826 30.5243 177.6251 54 G 4.2349 9.3472 110.3492 45.3288 0.0000 174.9589 55 F 4.0874 8.5457 122.2052 61.9900 39.0743 176.7794 56 M 4.0651 8.4222 115.5581 58.1038 32.1456 177.4135 57 I 3.8051 7.4961 112.5395 63.1361 38.5231 177.8972 58 W 4.1064 8.0758 120.7688 58.8783 28.6714 178.1027 59 H 3.9359 7.8995 118.4009 58.7023 29.6175 175.4031 60 P 4.2364 0.0000 0.0000 65.3451 31.1259 177.9906 61 K 3.4785 7.5445 119.4696 59.6774 31.8666 178.3832 62 M 4.0163 8.0363 118.7610 58.6038 31.8331 178.5086 63 D 4.1532 7.7319 118.8190 57.1686 40.9132 178.6715 64 E 3.8953 7.8173 118.5892 59.5696 29.4671 178.7508 65 Y 4.4684 7.8003 116.7536 61.4380 37.9023 178.5415 66 M 4.0213 8.3773 119.8876 58.5585 32.0381 178.3900 67 E 3.8297 8.1880 119.2129 59.2273 29.7543 178.5462 68 E 3.6307 8.1778 119.2793 59.1254 29.6838 178.6613 69 I 3.8085 7.9437 120.1054 64.7398 37.2631 178.1091 70 D 4.4327 8.8681 120.0827 57.1498 40.5863 178.9970 71 G 3.5500 8.0935 106.3493 48.1543 0.0000 175.3024 72 Y 4.3114 7.5023 119.5505 60.4634 37.8541 178.2858 73 L 4.0410 8.1942 121.4108 58.4331 42.1359 178.6986 74 D 4.3113 8.1607 117.8087 57.2645 41.1802 177.7836 75 E 3.9010 8.2299 119.9726 59.4656 29.5964 178.7539 76 M 3.9317 8.5453 119.2835 58.1126 31.9697 178.5990 77 S 4.0814 8.1854 113.3394 61.6172 62.6852 176.0715 78 E 4.1400 8.3978 120.5069 58.4650 29.2015 179.2184 79 R 3.8724 7.9716 119.6256 58.9976 30.0763 177.9973 80 L 3.9056 8.0180 120.2434 58.1876 42.0130 178.8913 81 I 3.8075 8.0570 120.0315 64.9924 36.8846 178.3244 82 T 3.8639 7.6334 114.8560 66.6529 68.3730 175.6212 83 L 4.3700 7.6562 117.8255 54.8105 41.8868 177.6099 84 G 3.8198 8.3000 108.0168 45.4370 0.0000 173.9494 85 G 3.7961 7.8908 109.1143 43.9107 0.0000 173.9227 86 A 4.4767 7.9491 121.1786 49.0200 19.7678 174.0305 87 P 4.4440 0.0000 0.0000 62.9650 32.1411 176.9003 88 F 4.7676 8.4323 120.1366 58.9545 39.2362 176.4784 89 S 4.8558 9.1801 120.6680 56.6537 63.5102 174.4603 90 T 4.4908 6.8321 109.5682 59.9489 72.9007 173.4571 91 L 4.0378 8.2593 122.3506 57.6979 41.6862 179.5319 92 K 3.7850 7.8836 119.0896 59.7262 32.2515 178.1779 93 E 3.6751 7.7015 118.1072 59.4481 29.3652 179.5681 94 F 4.4368 7.6039 117.3497 60.7542 38.8108 177.7782 95 S 4.1438 8.1563 113.5013 61.9679 62.8104 176.6345 96 E 4.0637 8.0819 119.3707 58.7671 29.2352 178.3336 97 N 4.5255 7.5833 114.7763 53.4932 39.5145 175.8064 98 S 4.4527 7.4775 114.5715 58.4259 62.9362 173.8544 99 Q 4.2652 8.7325 124.2001 56.1939 29.1104 176.3060 100 L 4.0148 7.3951 119.0125 53.9509 42.4000 176.3337 101 K 4.5803 8.2415 121.4855 54.6313 34.4094 175.5046 102 E 4.7434 8.4367 120.8807 54.6763 32.3141 175.5146 103 V 4.5343 7.7150 112.7274 58.9610 35.6157 175.7440 104 L 4.0245 8.2725 121.1556 54.4481 42.0125 177.8547 105 G 2.3852 8.0327 110.9814 45.3870 0.0000 172.8117 106 D 4.3900 7.4111 121.5964 52.6144 43.3623 175.5337 107 Y 4.9294 8.6396 124.2050 60.0528 38.1889 176.3719 108 N 4.7687 8.8979 116.5059 53.1800 38.7882 175.3002 109 V 3.7776 7.3172 119.0304 62.4820 32.1958 176.6814 110 T 4.2135 8.5638 117.8665 61.3088 70.6682 175.7322 111 I 3.6728 8.2292 122.4118 64.8571 37.3435 178.5564 112 E 3.8996 8.0470 118.2163 58.7558 29.3979 179.0159 113 E 3.9631 8.1450 119.3092 59.2411 29.4935 179.1306 114 Q 3.9442 8.2995 118.4395 59.0405 28.7448 178.9523 115 L 3.7079 7.9762 119.8668 57.4312 41.5354 179.3864 116 A 3.8820 7.7737 120.5883 55.0778 18.2049 179.8723 117 R 3.7842 7.9709 116.6082 59.3375 30.0600 179.4485 118 V 3.2106 7.5139 118.0023 65.7474 31.4396 178.1882 119 V 3.4760 7.6671 118.0486 66.1562 31.3538 177.9408 120 E 4.1274 8.1842 118.2404 59.0110 29.1501 179.4538 121 V 3.6064 8.0556 118.9418 66.1973 31.5635 178.1920 122 F 4.5027 8.5125 117.8939 60.6601 38.6926 177.9388 123 R 3.9491 8.6483 118.3432 59.1989 29.7726 178.4133 124 Y 3.8880 8.0771 119.3092 60.6614 38.8948 178.0184 125 L 3.3470 8.2017 119.8118 57.5956 41.7069 179.2975 126 A 3.8969 8.0505 120.6401 55.2044 18.2445 179.6016 127 A 3.7922 7.7553 119.0942 54.9926 18.3793 179.5827 128 L 3.5870 7.4992 119.2236 58.2956 42.0594 179.3292 129 F 4.4924 8.2052 118.0528 60.4442 38.7374 177.4571 130 Q 3.9363 8.1605 119.4107 59.0048 28.7763 178.2668 131 K 3.9408 8.0420 120.8276 59.2973 32.1423 178.9231 132 G 2.1920 7.8583 106.3820 47.1671 0.0000 175.2513 133 F 4.0512 8.2370 123.6731 61.1431 39.4401 176.9226 134 D 4.4480 8.3916 118.4303 57.3990 40.6437 179.0456 135 V 3.5615 7.9309 119.0809 66.0650 31.6580 178.2971 136 S 4.4891 8.2047 115.4700 60.6558 62.9460 175.9299 137 D 4.0586 8.2200 122.2568 57.2199 40.7446 177.9200 138 E 3.9744 8.0458 118.5431 58.9021 29.7561 177.7369 139 E 4.3029 8.0599 116.2524 56.0679 29.7880 177.2040 140 G 3.8188 7.5174 106.6418 46.8097 0.0000 175.1966 141 D 4.6073 7.6938 121.6884 52.4950 38.7200 176.4937 142 S 4.0913 7.9442 119.3037 60.6643 63.4669 176.8196 143 V 3.5106 7.6224 121.5395 66.2973 31.4449 177.9681 144 T 3.7498 7.9256 115.0311 66.4874 68.2515 176.0892 145 N 4.7105 8.1011 120.3536 56.2857 38.8455 176.4657 146 D 4.3886 8.1638 119.3769 57.1738 41.3216 178.0943 147 I 3.5244 7.5429 120.2496 64.5025 37.0233 178.4189 148 F 3.9459 7.8350 118.3812 60.3271 38.6984 177.2444 149 N 4.3557 8.4217 116.7730 56.7436 38.8318 177.0850 150 V 3.5406 8.0206 119.5586 65.9052 31.6330 177.8479 151 A 3.3647 7.4149 121.7104 54.1384 17.8731 179.4960 152 K 4.0576 8.2350 118.3140 59.5048 32.3303 178.5927 153 A 3.9607 8.0234 121.1015 55.4614 18.3129 179.6658 154 S 4.0121 7.8905 110.8434 61.5484 62.5175 176.2682 155 I 3.4611 7.8508 122.5185 64.4730 36.8472 178.3120 156 E 4.0274 8.4253 119.5060 59.0753 29.2353 179.2169 157 K 4.2241 8.0700 119.6467 60.1372 32.3330 178.5222 158 H 4.4208 8.2495 116.3250 58.9473 28.4912 177.7980 159 I 3.8245 8.1375 121.6956 64.0901 36.9464 177.9378 160 W 4.4310 8.3678 129.0998 61.1489 30.5408 177.9394 161 M 3.3753 7.8243 118.2517 58.0477 31.3100 178.8300 162 L 4.0069 8.5153 119.5138 57.9335 41.8045 179.6477 163 Q 3.9695 8.4335 117.9946 58.7131 28.5690 178.4463 164 A 4.1179 8.4007 122.3027 55.3608 18.2112 179.0753 165 E 3.9910 8.0371 116.2938 59.4560 29.6632 178.1625 166 L 4.4530 7.5659 116.1714 54.0853 41.6815 176.9972 167 G 3.9626 8.2391 106.6428 46.5943 0.0000 173.8739 168 Q 4.6635 8.3397 116.8449 53.0811 32.1736 175.4644 169 A 4.3835 8.2887 122.2586 51.4662 19.1862 176.3631 170 P 4.3996 0.0000 0.0000 63.8734 31.8747 177.3783 171 K 3.8486 8.0779 115.1568 57.3024 29.3735 175.1630 172 L 4.1828 7.9116 122.0185 55.2021 41.5072 177.6767 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 21 S 8.33 4.32 0.00 3.84 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 22 L 7.89 3.57 0.00 1.92 1.66 0.91 0.53 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 23 A 9.04 3.99 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 24 D 8.37 4.43 0.00 2.86 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 8.61 4.18 0.00 4.03 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 26 K 8.38 3.99 0.00 1.96 1.84 0.00 1.66 0.00 0.00 1.63 0.00 0.00 3.13 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.58 7.81 27 A 8.02 4.02 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 8.28 3.76 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 1.03 0.00 0.00 0.83 0.00 0.00 29 L 8.20 4.20 0.00 1.97 1.80 0.91 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.24 4.35 0.00 2.84 2.57 0.00 0.00 6.85 6.85 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 31 Q 8.78 4.24 0.00 2.41 2.43 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 2.48 2.78 0.00 32 A 8.55 4.21 1.74 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 33 V 8.14 3.57 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 1.27 0.00 0.00 1.09 0.00 0.00 34 A 8.37 4.16 1.62 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 0.00 0.00 0.00 35 D 8.52 4.41 0.00 2.90 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 36 L 8.64 4.00 0.00 1.79 1.81 1.20 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.89 3.92 0.00 3.35 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 38 V 7.80 3.61 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 1.06 0.00 0.00 1.00 0.00 0.00 39 A 8.64 3.99 1.49 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 0.00 0.00 0.00 40 H 8.62 4.00 0.00 3.31 3.49 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 7.92 4.14 0.00 4.03 4.08 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 42 I 7.97 3.67 1.96 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 1.48 0.70 0.85 0.00 0.00 43 L 8.03 3.93 0.00 1.74 1.66 1.10 0.83 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 44 H 8.00 3.62 0.00 3.00 2.56 0.00 5.60 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 45 Q 7.98 4.26 0.00 2.23 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.56 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 46 V 8.08 3.66 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 0.95 0.00 0.00 1.01 0.00 0.00 47 H 8.12 4.15 0.00 3.07 3.22 0.00 6.00 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 8.27 4.75 0.00 3.56 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 8.41 4.45 0.00 3.27 2.90 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 50 M 7.57 4.46 0.00 2.33 2.41 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 2.78 2.89 0.00 51 R 8.89 4.66 0.00 1.89 1.79 0.00 3.28 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.98 0.00 52 G 8.88 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 53 R 8.30 4.24 0.00 1.87 1.95 0.00 3.38 0.00 0.00 3.25 7.34 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 9.35 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 8.55 4.09 0.00 3.40 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 56 M 8.42 4.07 0.00 2.08 2.22 0.00 0.00 0.00 0.00 0.00 2.22 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 1.45 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.14 0.79 0.00 0.00 58 W 8.08 4.11 0.00 3.46 3.32 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 59 H 7.90 3.94 0.00 1.79 2.58 0.00 5.95 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 60 P 0.00 4.24 0.00 2.17 2.22 0.00 3.62 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.93 0.00 61 K 7.54 3.48 0.00 1.51 1.87 0.00 1.07 0.00 0.00 1.07 0.00 0.00 2.61 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.09 0.53 7.81 62 M 8.04 4.02 0.00 2.01 2.24 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 3.03 0.00 63 D 7.73 4.15 0.00 2.75 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 E 7.82 3.90 0.00 1.89 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 2.30 2.25 0.00 65 Y 7.80 4.47 0.00 3.22 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 66 M 8.38 4.02 0.00 1.89 2.19 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.26 0.00 67 E 8.19 3.83 0.00 2.00 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 2.25 2.28 0.00 68 E 8.18 3.63 0.00 2.07 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 1.76 2.02 0.00 69 I 7.94 3.81 2.17 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.47 1.02 0.00 0.00 70 D 8.87 4.43 0.00 2.80 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 8.09 3.55 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 72 Y 7.50 4.31 0.00 3.23 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 73 L 8.19 4.04 0.00 1.80 1.98 0.88 0.90 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 74 D 8.16 4.31 0.00 2.76 2.63 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 0.00 75 E 8.23 3.90 0.00 2.07 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 2.21 2.28 0.00 76 M 8.55 3.93 0.00 2.01 2.19 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 1.99 0.00 77 S 8.19 4.08 0.00 3.98 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 78 E 8.40 4.14 0.00 2.09 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 2.33 2.48 0.00 79 R 7.97 3.87 0.00 1.95 1.98 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 1.51 1.61 0.00 80 L 8.02 3.91 0.00 1.77 1.82 0.92 0.75 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 8.06 3.81 1.86 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 0.67 0.91 0.00 0.00 82 T 7.63 3.86 4.40 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 1.19 0.00 0.00 83 L 7.66 4.37 0.00 1.76 1.69 0.99 0.99 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 84 G 8.30 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 7.89 3.80 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 0.00 0.00 0.00 86 A 7.95 4.48 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 87 P 0.00 4.44 0.00 2.26 2.07 0.00 3.79 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 88 F 8.43 4.77 0.00 3.38 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 9.18 4.86 0.00 3.98 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 6.83 4.49 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 1.13 0.00 0.00 91 L 8.26 4.04 0.00 1.71 1.83 1.00 1.01 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 92 K 7.88 3.79 0.00 1.76 1.72 0.00 1.70 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.62 7.81 93 E 7.70 3.68 0.00 1.91 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 2.30 2.28 0.00 94 F 7.60 4.44 0.00 3.25 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 95 S 8.16 4.14 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 96 E 8.08 4.06 0.00 1.88 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 2.48 0.00 97 N 7.58 4.53 0.00 2.31 2.68 0.00 0.00 6.95 6.99 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 98 S 7.48 4.45 0.00 4.08 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 99 Q 8.73 4.27 0.00 1.78 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.62 0.00 0.00 0.00 0.00 0.00 2.43 2.63 0.00 100 L 7.40 4.01 0.00 1.51 1.44 0.94 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.24 4.58 0.00 1.65 1.65 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.34 7.81 102 E 8.44 4.74 0.00 1.90 1.81 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 2.18 2.27 0.00 103 V 7.72 4.53 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 0.70 0.00 0.00 0.85 0.00 0.00 104 L 8.27 4.02 0.00 1.53 1.48 0.90 0.86 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 0.00 105 G 8.03 2.39 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 0.00 106 D 7.41 4.39 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 8.64 4.93 0.00 3.11 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 0.00 108 N 8.90 4.77 0.00 2.81 2.89 0.00 0.00 6.92 7.59 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 0.00 109 V 7.32 3.78 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 0.80 0.00 0.00 0.91 0.00 0.00 110 T 8.56 4.21 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 0.00 111 I 8.23 3.67 1.88 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 1.90 1.14 0.82 0.00 0.00 112 E 8.05 3.90 0.00 1.97 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 2.33 2.36 0.00 113 E 8.14 3.96 0.00 2.14 1.95 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 2.30 2.32 0.00 114 Q 8.30 3.94 0.00 2.15 2.10 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 2.63 2.60 0.00 115 L 7.98 3.71 0.00 1.35 1.25 -0.36 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.77 3.88 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 0.00 117 R 7.97 3.78 0.00 1.88 1.90 0.00 3.07 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 1.61 1.66 0.00 118 V 7.51 3.21 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 0.17 0.00 0.00 0.79 0.00 0.00 119 V 7.67 3.48 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 0.99 0.00 0.00 0.94 0.00 0.00 120 E 8.18 4.13 0.00 1.99 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 2.48 2.42 0.00 121 V 8.06 3.61 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 1.23 0.00 0.00 0.89 0.00 0.00 122 F 8.51 4.50 0.00 3.20 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 0.00 123 R 8.65 3.95 0.00 1.99 2.00 0.00 3.24 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 1.90 0.00 124 Y 8.08 3.89 0.00 3.14 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 8.20 3.35 0.00 1.60 0.87 1.06 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.05 3.90 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 A 7.76 3.79 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 7.50 3.59 0.00 1.13 1.31 1.05 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.21 4.49 0.00 3.13 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 0.00 130 Q 8.16 3.94 0.00 2.21 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 131 K 8.04 3.94 0.00 1.76 1.78 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.38 7.81 132 G 7.86 2.19 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 0.00 133 F 8.24 4.05 0.00 3.24 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 0.00 134 D 8.39 4.45 0.00 2.75 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 0.00 135 V 7.93 3.56 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 1.06 0.00 0.00 0.90 0.00 0.00 136 S 8.20 4.49 0.00 4.27 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 8.22 4.06 0.00 2.40 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 0.00 138 E 8.05 3.97 0.00 2.14 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 2.31 2.33 0.00 139 E 8.06 4.30 0.00 1.98 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 2.31 2.46 0.00 140 G 7.52 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 0.00 141 D 7.69 4.61 0.00 2.72 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 0.00 142 S 7.94 4.09 0.00 4.04 4.06 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 0.00 0.00 0.00 143 V 7.62 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 7.93 3.75 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 1.28 0.00 0.00 145 N 8.10 4.71 0.00 2.65 2.74 0.00 0.00 6.48 8.06 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 0.00 146 D 8.16 4.39 0.00 2.76 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 7.54 3.52 1.66 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.76 0.48 0.00 0.00 148 F 7.83 3.95 0.00 3.32 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 0.00 149 N 8.42 4.36 0.00 3.32 3.02 0.00 0.00 6.85 7.10 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 0.00 150 V 8.02 3.54 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 0.98 0.00 0.00 0.94 0.00 0.00 151 A 7.41 3.36 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 K 8.24 4.06 0.00 2.04 2.02 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.43 1.49 7.81 153 A 8.02 3.96 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 S 7.89 4.01 0.00 3.98 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 I 7.85 3.46 1.88 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.94 0.69 0.00 0.00 156 E 8.43 4.03 0.00 2.19 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 2.34 2.50 0.00 157 K 8.07 4.22 0.00 2.07 1.99 0.00 1.74 0.00 0.00 1.86 0.00 0.00 3.05 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.87 1.86 7.81 158 H 8.25 4.42 0.00 3.37 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 8.14 3.82 2.18 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 1.59 1.02 1.00 0.00 0.00 160 W 8.37 4.43 0.00 3.43 3.53 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 0.00 161 M 7.82 3.38 0.00 1.92 2.02 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.06 0.00 162 L 8.52 4.01 0.00 1.72 1.61 0.82 0.59 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 0.00 163 Q 8.43 3.97 0.00 2.39 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.51 2.73 0.00 164 A 8.40 4.12 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 0.00 165 E 8.04 3.99 0.00 2.19 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 0.00 2.30 2.44 0.00 166 L 7.57 4.45 0.00 1.77 1.63 0.80 0.84 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 0.00 167 G 8.24 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 8.34 4.66 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.50 0.00 169 A 8.29 4.38 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 0.00 170 P 0.00 4.40 0.00 2.14 2.31 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 2.36 0.00 171 K 8.08 3.85 0.00 1.91 1.88 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.62 7.81 172 L 7.91 4.18 0.00 1.63 1.58 0.93 0.95 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