NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2056 8.3293 121.6991 55.8367 30.4420 175.3892 4 S 4.3139 8.1695 119.8953 57.5757 65.6132 174.6604 5 F 4.1212 9.9785 122.9302 60.4378 39.0709 179.7131 6 T 3.9185 8.0291 115.7982 66.6211 68.3425 176.5541 7 S 4.0782 8.1581 114.9865 61.4127 62.3646 176.1636 8 I 3.6341 7.8166 122.2594 64.4543 36.7941 178.3552 9 A 4.0196 8.5809 121.9640 54.8472 18.1290 179.6760 10 R 3.8294 8.0894 117.3394 59.7070 30.3406 178.7738 11 I 3.7951 7.7087 119.4495 64.5193 37.0927 178.8208 12 G 3.6661 8.3585 106.5939 47.8213 0.0000 175.5373 13 D 4.3755 8.4507 121.3984 57.1085 40.8185 178.0591 14 Y 4.0146 8.0929 120.1471 60.8878 38.6200 178.3586 15 I 3.6949 7.5771 118.9273 64.4616 37.2946 178.2276 16 L 4.1123 7.9071 118.8743 57.4931 41.4982 179.2081 17 K 4.2937 8.2823 117.5304 56.7900 32.4287 176.7765 18 S 4.3783 7.1917 114.5810 56.1019 62.2508 172.6461 19 P 4.3835 0.0000 0.0000 65.5924 30.9225 178.7982 20 V 3.6114 7.5831 116.6206 66.0991 31.5913 178.0154 21 L 4.0815 7.5975 118.1920 57.5224 41.4705 179.2017 22 S 4.1855 8.4425 113.6555 61.7082 62.1022 176.5979 23 K 4.1218 7.5949 118.4007 58.3626 31.8547 178.4056 24 L 4.2756 7.2246 118.5283 56.9665 42.6384 177.6532 25 C 4.3195 8.7517 117.3058 62.0296 28.5681 175.8958 26 V 3.5739 7.6712 119.8001 65.8794 30.9027 176.2845 27 P 4.2333 0.0000 0.0000 65.4253 31.1042 178.8272 28 V 3.5700 7.7300 116.4838 66.0382 31.6410 177.8829 29 A 4.1056 8.0247 120.4952 55.1207 18.1362 179.4204 30 N 4.3450 8.4788 115.5074 56.5186 38.5805 177.4469 31 Q 3.9927 7.9895 121.0802 58.9029 29.1213 177.9347 32 F 4.2380 8.3708 121.8062 61.5123 39.2667 177.2280 33 I 3.6055 7.7193 118.0023 64.4130 37.0002 177.9456 34 N 4.3052 8.1309 117.3876 56.2078 38.1424 177.5699 35 L 4.0153 7.8787 119.3571 57.3595 41.7156 178.7990 36 A 3.9216 7.4425 120.4931 53.2699 18.5633 178.8435 37 G 3.6364 7.5297 102.4695 46.1169 0.0000 174.9580 38 Y 4.1436 7.3946 119.3495 59.9259 37.8421 178.4109 39 K 4.1695 7.1612 119.7578 58.9152 32.1664 178.8267 40 K 2.5174 7.3420 117.9157 57.3384 31.6121 178.0143 41 L 4.6113 7.4357 117.7364 53.9596 42.1586 177.0090 42 G 3.9487 7.8653 107.3329 45.5550 0.0000 173.3518 43 L 4.8044 7.6686 117.9366 52.8829 43.7907 176.1319 44 K 4.8303 9.0514 121.1635 54.6302 34.2474 177.5595 45 F 3.3564 9.4983 124.4253 61.4250 39.4031 177.4410 46 D 4.0210 8.1354 119.2543 56.7841 40.6865 178.0959 47 D 4.5478 7.7716 118.3106 56.6090 40.9657 177.6011 48 L 3.9457 7.3430 118.3375 56.3192 41.8479 177.3933 49 I 3.5726 6.6966 118.7883 60.7515 37.1440 175.8006 50 A 3.9917 8.6740 129.1921 52.7119 18.4388 176.6522 51 E 4.4393 8.0965 119.9727 56.3489 31.0327 176.5716 52 E 4.3844 7.8896 121.2119 54.9393 28.7403 175.8191 53 N 4.9726 7.4426 116.5833 49.8659 41.9981 173.1610 54 P 4.2254 0.0000 0.0000 66.1297 31.3757 178.5938 55 I 3.6963 7.8372 117.5775 65.0787 37.1036 178.1481 56 M 4.0010 8.0483 118.5318 58.5691 31.7776 178.8463 57 Q 3.9893 7.9876 117.7944 59.1893 28.8944 178.6188 58 T 3.8699 8.1057 113.9667 64.8066 67.2124 176.2766 59 A 3.9665 8.3009 123.1846 55.2708 18.2630 179.7167 60 L 3.8678 8.1743 116.3836 57.6818 41.6576 179.4443 61 R 3.9858 7.7386 118.2990 59.1800 30.1398 178.2415 62 R 4.0783 7.6834 116.2008 56.5218 30.4220 176.7604 63 L 3.2947 6.6617 122.1156 53.5669 42.6829 175.3672 64 P 4.2266 0.0000 0.0000 63.0346 32.7726 176.6775 65 E 3.4427 8.7038 120.7690 59.9639 29.3210 179.6242 66 D 4.4572 7.9885 117.8353 57.6276 40.8551 178.6860 67 E 3.9336 7.9736 118.4213 59.0695 29.5474 179.1078 68 S 3.9812 7.8039 113.4928 61.4262 62.3822 175.8246 69 Y 4.3336 7.8508 119.4847 60.9999 37.5759 178.2990 70 A 4.0919 7.9384 121.6496 55.0280 18.4927 179.6455 71 R 3.7423 8.3074 117.4287 59.4100 30.1840 178.3598 72 A 4.0211 8.1111 120.6003 55.5629 18.3018 179.0202 73 Y 4.0927 8.0892 117.7595 60.9733 38.8296 178.3336 74 R 3.7241 8.2027 119.0134 59.1707 30.0612 179.2073 75 I 3.6269 7.7534 119.4728 64.4722 37.1669 178.5273 76 I 3.6941 7.6888 120.6110 64.3408 36.9207 178.4619 77 R 3.6769 7.9723 119.6547 59.1819 29.7229 178.4313 78 A 3.9189 8.0300 120.6309 55.5669 18.4163 179.2817 79 H 4.0701 8.2732 114.8586 59.0004 28.5135 177.8954 80 Q 3.9437 7.8805 120.3581 59.4543 29.3607 178.0771 81 T 4.0178 7.9723 116.7511 66.6153 68.5024 176.1619 82 E 3.9336 8.4643 121.8119 59.2738 29.4287 178.8937 83 L 4.0029 7.8033 118.6964 58.3411 40.6299 178.4112 84 T 4.1466 7.4900 108.1635 61.4379 69.3841 174.0383 85 H 4.0493 7.8521 117.8218 57.6684 26.5601 173.5194 86 H 5.0277 8.1139 114.4226 54.1741 32.5703 171.9793 87 L 4.9463 8.2263 119.1835 52.8776 44.7981 176.6161 88 L 4.5002 8.6836 120.1570 53.8065 42.7537 175.8163 89 P 4.2688 0.0000 0.0000 62.9923 32.2820 177.6540 90 R 2.5100 8.5469 123.2547 59.0615 29.9273 178.2753 91 N 4.4794 7.8442 111.3264 54.3017 37.3371 174.9518 92 E 4.5684 8.1475 118.0618 56.0569 30.5285 176.4243 93 W 4.6815 7.8487 119.6152 56.4219 29.6982 176.1636 94 I 4.1278 8.3106 122.8130 61.4451 37.3845 175.9647 95 K 4.5718 8.7684 123.6559 54.5650 34.0531 177.4372 96 A 4.0214 8.7323 124.1593 55.7807 18.2918 180.1496 97 Q 4.2032 8.0392 113.0156 58.3058 29.1411 177.0099 98 E 4.2509 8.2254 116.7825 58.0724 30.5090 176.7512 99 D 4.7965 7.4714 119.3595 53.2997 39.7972 175.9410 100 V 4.1857 7.3601 119.9562 61.5195 33.3202 174.5640 101 P 4.7786 0.0000 0.0000 61.9514 29.6833 176.4066 102 Y 4.0156 7.8679 120.9957 60.0384 38.9360 177.7748 103 L 4.3672 7.3011 121.6444 55.8955 43.0789 177.8116 104 L 3.6753 7.4651 120.6717 57.9053 41.8351 177.0975 105 P 4.0850 0.0000 0.0000 66.2508 30.9319 177.8729 106 Y 4.0428 7.6124 115.8117 60.7480 37.8248 178.1133 107 I 3.6799 7.7408 120.8710 64.3835 37.1688 178.5490 108 L 4.0133 8.1523 120.1363 57.5121 41.4027 179.2704 109 E 3.8806 8.1821 119.2991 59.1205 29.5330 178.6809 110 A 4.0065 8.0485 120.8527 55.2223 18.3856 179.4801 111 E 3.9070 8.4522 116.9877 59.5319 29.5932 179.4481 112 A 3.9956 8.0617 120.6087 55.0611 18.4143 179.6055 113 A 3.9209 8.0395 119.0245 55.2503 18.4963 179.7839 114 A 3.9612 8.3216 119.6763 55.1074 18.3589 179.8213 115 K 3.9171 8.4758 118.6769 59.4919 32.2597 178.6779 116 E 3.8978 8.1538 119.6361 59.2103 29.5986 178.7214 117 K 4.0017 8.1116 119.6946 59.5000 31.9853 178.3033 118 D 4.3388 7.8869 117.6275 57.2950 41.3214 177.7935 119 E 4.1188 8.4795 119.4352 59.4448 29.2849 179.3119 120 L 4.0698 8.2236 118.1738 57.3757 41.7919 178.6235 121 D 4.6531 8.0758 117.3599 55.6599 40.8442 176.4902 122 N 5.0732 7.4436 116.4141 52.3991 39.9424 174.4315 123 I 3.7818 7.9351 111.9834 61.1924 38.0586 175.0350 124 E 4.6073 8.5567 123.3947 54.6475 31.2614 175.5296 125 V 4.2606 8.1529 121.0005 59.8347 33.2748 174.9141 126 S 4.5574 8.5150 119.4661 56.3713 62.9591 173.7354 127 K 4.1771 8.5747 126.3594 56.7698 31.8849 176.9607 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 3 Q 8.33 4.21 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.00 0.00 0.00 0.00 0.00 0.00 2.11 2.28 0.00 4 S 8.17 4.31 0.00 4.39 3.98 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 5 F 9.98 4.12 0.00 3.35 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 6 T 8.03 3.92 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 1.23 0.00 0.00 7 S 8.16 4.08 0.00 3.88 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 8 I 7.82 3.63 1.96 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.49 0.88 0.00 0.00 9 A 8.58 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 10 R 8.09 3.83 0.00 2.04 2.10 0.00 3.10 0.00 0.00 3.15 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 11 I 7.71 3.80 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.09 0.90 0.00 0.00 12 G 8.36 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.45 4.38 0.00 2.95 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 14 Y 8.09 4.01 0.00 3.17 3.17 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 15 I 7.58 3.69 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.91 0.91 0.00 0.00 16 L 7.91 4.11 0.00 1.90 1.72 0.92 1.14 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 17 K 8.28 4.29 0.00 1.71 1.78 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.57 7.81 18 S 7.19 4.38 0.00 3.41 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 19 P 0.00 4.38 0.00 2.16 2.07 0.00 3.58 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.11 0.00 20 V 7.58 3.61 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 1.06 0.00 0.00 0.91 0.00 0.00 21 L 7.60 4.08 0.00 1.67 1.70 0.95 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.44 4.19 0.00 4.06 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 23 K 7.59 4.12 0.00 1.75 1.85 0.00 1.73 0.00 0.00 1.62 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.66 7.81 24 L 7.22 4.28 0.00 1.66 1.91 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 25 C 8.75 4.32 0.00 3.03 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 26 V 7.67 3.57 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 1.11 0.00 0.00 0.96 0.00 0.00 27 P 0.00 4.23 0.00 2.20 2.09 0.00 3.60 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.15 0.00 28 V 7.73 3.57 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.99 0.00 0.00 29 A 8.02 4.11 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.48 4.35 0.00 2.91 2.89 0.00 0.00 6.57 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 31 Q 7.99 3.99 0.00 2.28 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 32 F 8.37 4.24 0.00 3.12 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 I 7.72 3.61 2.00 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 1.65 0.96 0.80 0.00 0.00 34 N 8.13 4.31 0.00 2.70 2.79 0.00 0.00 7.04 6.82 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 35 L 7.88 4.02 0.00 1.72 1.66 0.95 0.64 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 36 A 7.44 3.92 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 37 G 7.53 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 38 Y 7.39 4.14 0.00 3.16 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 39 K 7.16 4.17 0.00 1.40 1.83 0.00 1.78 0.00 0.00 1.79 0.00 0.00 2.51 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.51 1.05 7.81 40 K 7.34 2.52 0.00 1.45 1.13 0.00 1.19 0.00 0.00 1.13 0.00 0.00 2.26 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.30 0.36 7.81 41 L 7.44 4.61 0.00 1.76 1.65 0.89 0.93 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 42 G 7.87 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 43 L 7.67 4.80 0.00 1.94 1.63 0.88 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 44 K 9.05 4.83 0.00 2.10 1.94 0.00 1.81 0.00 0.00 1.84 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.54 1.46 7.81 45 F 9.50 3.36 0.00 2.95 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 46 D 8.14 4.02 0.00 2.38 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 7.77 4.55 0.00 2.74 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 48 L 7.34 3.95 0.00 1.16 1.30 0.73 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 49 I 6.70 3.57 1.73 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.10 1.02 0.00 0.00 50 A 8.67 3.99 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.10 4.44 0.00 2.15 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 52 E 7.89 4.38 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 53 N 7.44 4.97 0.00 2.88 2.87 0.00 0.00 6.08 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 54 P 0.00 4.23 0.00 2.18 2.17 0.00 3.63 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 2.13 2.21 0.00 55 I 7.84 3.70 1.91 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 1.67 1.04 0.93 0.00 0.00 56 M 8.05 4.00 0.00 2.00 2.20 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.59 0.00 57 Q 7.99 3.99 0.00 2.23 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.67 2.50 0.00 58 T 8.11 3.87 4.24 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 1.33 0.00 0.00 59 A 8.30 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.17 3.87 0.00 1.58 1.70 0.89 0.89 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 61 R 7.74 3.99 0.00 1.86 2.12 0.00 3.23 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 62 R 7.68 4.08 0.00 1.93 1.90 0.00 3.28 0.00 0.00 3.37 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.67 0.00 63 L 6.66 3.29 0.00 1.36 1.52 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.23 0.00 2.26 2.17 0.00 3.52 0.00 0.00 3.75 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 65 E 8.70 3.44 0.00 1.92 1.76 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 2.23 2.34 0.00 66 D 7.99 4.46 0.00 2.68 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 67 E 7.97 3.93 0.00 2.03 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 68 S 7.80 3.98 0.00 3.70 3.62 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 69 Y 7.85 4.33 0.00 3.19 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 70 A 7.94 4.09 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.31 3.74 0.00 1.84 2.04 0.00 3.23 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.91 0.00 72 A 8.11 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 73 Y 8.09 4.09 0.00 3.12 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 74 R 8.20 3.72 0.00 2.02 2.06 0.00 3.43 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.99 0.00 75 I 7.75 3.63 2.02 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.75 0.95 0.00 0.00 76 I 7.69 3.69 1.84 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.68 0.92 0.00 0.00 77 R 7.97 3.68 0.00 1.06 1.71 0.00 2.94 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.41 0.00 78 A 8.03 3.92 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 79 H 8.27 4.07 0.00 3.36 3.34 0.00 5.82 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 80 Q 7.88 3.94 0.00 2.04 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 81 T 7.97 4.02 4.34 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 0.00 0.00 0.00 1.29 0.00 0.00 82 E 8.46 3.93 0.00 2.09 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 2.30 2.36 0.00 83 L 7.80 4.00 0.00 1.79 1.76 0.91 0.98 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 84 T 7.49 4.15 4.33 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 1.29 0.00 0.00 85 H 7.85 4.05 0.00 3.29 3.39 0.00 5.60 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 H 8.11 5.03 0.00 3.10 3.24 0.00 5.84 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.23 4.95 0.00 1.70 1.88 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.68 4.50 0.00 2.00 1.79 1.03 0.97 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 89 P 0.00 4.27 0.00 2.04 1.93 0.00 3.80 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.13 0.00 90 R 8.55 2.51 0.00 1.45 1.34 0.00 2.31 0.00 0.00 3.07 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.31 0.00 91 N 7.84 4.48 0.00 2.76 2.86 0.00 0.00 5.92 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 92 E 8.15 4.57 0.00 2.16 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 0.00 2.32 2.28 0.00 93 W 7.85 4.68 0.00 3.42 3.02 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 94 I 8.31 4.13 1.95 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.93 1.03 0.00 0.00 95 K 8.77 4.57 0.00 1.90 1.76 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.45 7.81 96 A 8.73 4.02 1.34 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 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 8.04 4.20 0.00 2.08 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.99 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 98 E 8.23 4.25 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 99 D 7.47 4.80 0.00 2.88 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 0.00 100 V 7.36 4.19 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 1.01 0.00 0.00 1.05 0.00 0.00 101 P 0.00 4.78 0.00 2.27 2.26 0.00 3.83 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 102 Y 7.87 4.02 0.00 3.36 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 0.00 103 L 7.30 4.37 0.00 0.82 1.28 0.89 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.47 3.68 0.00 1.53 1.61 0.91 0.86 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 0.00 105 P 0.00 4.08 0.00 1.87 2.13 0.00 3.66 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.92 0.00 106 Y 7.61 4.04 0.00 3.22 3.01 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 0.00 107 I 7.74 3.68 1.66 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.55 0.54 0.00 0.00 108 L 8.15 4.01 0.00 1.77 1.71 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.18 3.88 0.00 2.12 2.10 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 2.31 2.31 0.00 110 A 8.05 4.01 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 0.00 111 E 8.45 3.91 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 112 A 8.06 4.00 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 0.00 113 A 8.04 3.92 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 0.00 114 A 8.32 3.96 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 0.00 115 K 8.48 3.92 0.00 1.89 1.82 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.59 1.45 7.81 116 E 8.15 3.90 0.00 2.20 2.10 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 2.31 2.32 0.00 117 K 8.11 4.00 0.00 1.97 1.94 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.60 1.45 7.81 118 D 7.89 4.34 0.00 2.78 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 0.00 119 E 8.48 4.12 0.00 2.22 1.98 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 2.33 2.46 0.00 120 L 8.22 4.07 0.00 1.57 1.73 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.08 4.65 0.00 2.84 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 0.00 122 N 7.44 5.07 0.00 2.61 2.75 0.00 0.00 6.97 7.31 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 0.00 123 I 7.94 3.78 1.87 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 1.49 0.52 0.91 0.00 0.00 124 E 8.56 4.61 0.00 1.97 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 2.24 2.43 0.00 125 V 8.15 4.26 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 0.72 0.00 0.00 0.93 0.00 0.00 126 S 8.52 4.56 0.00 3.84 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 0.00 127 K 8.57 4.18 0.00 1.77 1.70 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.44 1.49 7.81