NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1792 8.1627 120.2923 54.5939 32.8401 174.0408 2 K 3.7610 8.5996 128.3332 56.7937 32.4650 174.9210 3 G 3.9768 8.6674 115.6772 44.6540 0.0000 171.9732 4 D 4.4836 8.4200 120.0017 53.9683 41.8927 176.3172 5 K 3.7956 9.2088 127.3147 60.1982 32.0857 178.6880 6 I 3.6131 7.8328 119.1150 64.0013 36.9520 178.5166 7 V 3.7043 9.3217 120.4075 66.1989 31.3576 178.1228 8 I 3.7637 7.9892 119.6950 64.5105 36.8807 178.4755 9 Q 3.9331 8.0490 118.8708 59.1630 28.5171 178.4933 10 H 4.0586 8.2883 117.2546 58.8542 28.7941 177.7388 11 L 4.0187 8.3510 121.1120 58.1026 41.4851 179.4735 12 N 4.3732 8.4530 116.4885 55.9287 38.2483 177.4957 13 K 3.8933 7.9596 121.1996 59.6875 32.3687 179.0710 14 I 3.7528 7.9091 120.1049 64.0976 36.9051 178.1783 15 L 4.0522 8.1432 121.5484 58.0767 41.9558 179.2186 16 G 3.6226 8.0674 105.6601 47.8383 0.0000 175.3837 17 N 4.3288 7.8627 118.7106 56.1145 38.5879 177.2629 18 E 3.9305 8.2484 119.8751 59.5878 29.5066 179.5147 19 L 4.0676 8.0608 118.8608 57.6419 41.5391 179.8105 20 I 3.5810 7.4969 119.1313 64.2484 37.0089 178.1589 21 A 3.3079 7.9033 121.6167 54.9670 18.1207 179.3479 22 I 3.5704 7.8945 118.5701 64.9108 37.2630 178.3647 23 N 4.3278 7.8204 116.5120 56.2536 38.3430 177.2935 24 Q 3.8654 7.9905 120.9367 59.6102 29.1604 178.1480 25 Y 4.4481 7.9263 117.8714 60.9781 37.8550 178.1786 26 F 3.9290 8.4138 121.9796 60.8953 39.4863 177.1032 27 L 3.9922 8.2259 120.1386 58.5038 41.9169 178.6194 28 H 3.9456 8.4261 116.0850 58.5774 28.5738 177.5108 29 A 4.1315 8.3931 122.9601 55.5670 18.2258 180.0637 30 R 3.8547 7.7536 116.1834 59.2210 30.0404 179.3273 31 M 3.4845 7.7972 118.8261 58.1653 31.7323 178.1665 32 Y 4.4706 7.5139 116.8143 61.5034 38.2739 178.8680 33 E 4.0051 8.2539 119.1985 59.2769 29.2451 178.9530 34 D 4.3572 7.8601 117.7425 56.5661 41.3348 177.3113 35 W 4.9497 7.8831 116.9194 56.3994 29.2598 176.9592 36 G 3.9534 8.0881 107.5402 46.0738 0.0000 174.4766 37 L 4.8375 8.0552 121.6488 52.6033 40.6044 176.6905 38 E 3.9468 8.4046 123.2983 59.5988 30.0211 179.1058 39 K 3.8933 8.0644 119.0861 59.7053 32.1141 178.7742 40 L 4.1071 7.8256 118.7854 57.4777 41.4647 179.4238 41 G 3.7370 8.2507 105.7913 47.7513 0.0000 175.8178 42 K 3.9656 8.4630 121.5370 59.3665 32.0505 178.8612 43 H 3.8632 7.9571 117.8075 59.3887 29.7401 177.0287 44 E 3.8369 8.3710 120.5111 59.5332 29.2647 178.8494 45 Y 3.8371 8.2223 119.6412 60.8552 38.8151 177.5701 46 H 3.9559 8.2813 119.1911 59.2654 29.9281 177.0107 47 E 3.6387 8.1763 120.7624 59.3531 29.1859 179.2524 48 S 4.2234 8.1728 113.2378 61.5226 62.3938 176.3721 49 I 3.6014 7.3433 122.4844 64.3118 36.7879 178.0916 50 D 4.1920 7.9377 119.8871 57.4139 40.5178 178.7729 51 E 3.9205 8.3011 119.0849 59.4730 29.4050 179.2279 52 M 4.0012 7.9086 118.8244 58.4220 32.0375 178.9533 53 K 3.9752 8.0644 118.5670 59.6499 32.1880 179.1467 54 H 4.2288 8.2386 116.2603 58.8259 28.6030 177.5424 55 A 3.9926 8.2352 122.7732 55.2799 18.1976 179.0057 56 D 4.2801 8.2010 116.3922 57.6317 41.2726 178.7778 57 K 4.0115 8.1176 118.8150 59.3729 31.9478 179.4255 58 L 4.0090 8.0313 119.2645 57.7930 41.5770 179.4327 59 I 3.7060 8.0950 120.1380 64.4199 37.0855 178.6081 60 K 3.9885 8.1672 119.0945 59.4167 31.8259 179.3519 61 R 4.0134 8.0403 118.8643 59.5369 29.9545 178.4151 62 I 3.7021 8.0947 119.8931 64.5408 37.1586 178.3293 63 L 3.9877 8.0569 119.5866 57.7912 41.2356 179.3828 64 F 4.3949 8.1586 119.3428 61.3191 39.6573 176.6236 65 L 4.3338 8.0096 116.9813 53.9802 40.9679 177.0346 66 E 3.8961 7.9600 117.4648 57.5115 27.2095 174.5335 67 G 3.9716 8.1186 107.3631 43.9528 0.0000 173.6507 68 L 4.5678 8.0000 118.8994 51.9781 42.5809 175.3219 69 P 4.2520 0.0000 0.0000 62.4292 31.8260 176.0340 70 N 4.7303 8.5508 120.7757 52.2865 38.8813 173.8801 71 L 4.5235 8.1582 123.9196 54.4841 42.7161 177.9606 72 Q 4.0131 8.0940 120.6163 58.8823 29.2814 176.0400 73 E 4.0617 8.3947 118.2046 55.6661 30.1446 175.6760 74 L 4.4691 8.2133 126.6995 53.0333 44.0661 176.1236 75 G 3.8535 8.4581 115.5200 44.2500 0.0000 171.9435 76 K 3.8585 8.3953 120.0255 56.6108 32.4673 175.3156 77 L 4.5944 8.2758 126.6983 53.5562 43.5699 176.6579 78 L 4.5381 8.3973 126.6272 53.2865 40.5913 174.4854 79 I 4.1453 7.8680 122.1015 60.2339 38.2020 176.4640 80 G 4.0630 8.7443 114.2363 44.7393 0.0000 172.8677 81 E 4.7651 9.5878 117.9575 56.4207 31.4291 176.5822 82 H 4.9958 7.6416 113.5966 52.9641 32.9135 173.8138 83 T 4.2756 8.7293 118.2780 67.2789 68.3275 176.1920 84 K 3.8557 8.2667 120.4097 59.6900 32.1894 178.1811 85 E 4.0409 8.1494 118.8251 59.6515 29.6602 178.4584 86 M 4.1101 8.5228 119.1496 58.3444 31.9325 178.8147 87 L 4.1575 8.3239 119.2988 57.8930 41.8270 179.4249 88 E 4.0017 8.2864 118.5403 59.6019 29.4114 179.1919 89 C 4.2431 8.6259 117.2019 63.0645 28.2221 175.9982 90 D 4.6859 8.4446 120.5024 57.2161 40.3201 178.6107 91 L 3.9964 8.1635 121.1219 57.8761 42.0227 178.8367 92 K 3.9266 8.5921 120.0928 59.4045 32.1936 178.4438 93 L 4.0432 8.0436 120.4842 58.3968 41.9028 178.8627 94 E 4.1908 8.2363 116.5369 58.6585 29.0493 178.5775 95 Q 4.3351 7.7985 117.5437 57.9620 29.3647 177.7782 96 A 4.2107 8.8247 121.6005 54.5069 18.5174 179.1430 97 G 3.7852 8.0170 103.6295 46.6062 0.0000 175.7649 98 L 4.0826 7.4009 121.8844 57.9812 42.1213 177.6317 99 P 4.3692 0.0000 0.0000 65.2463 31.1315 178.4411 100 D 4.3700 8.9213 119.3840 57.2485 40.7320 178.6348 101 L 4.0036 7.8385 118.9941 57.7840 41.7148 179.5566 102 K 3.9618 8.1360 118.2643 59.4301 31.9793 179.3312 103 A 4.0535 8.1825 120.9310 54.9292 18.1933 179.6098 104 A 3.6922 8.2378 119.5623 55.2005 18.4702 179.9174 105 I 3.6406 8.0949 118.4182 64.4646 37.1621 178.5379 106 A 4.0151 8.0545 121.6793 55.2754 18.2910 179.1196 107 Y 3.7883 8.0863 118.0797 60.8851 38.8182 177.8095 108 C 4.0330 8.4123 118.0550 62.7080 28.3343 175.7072 109 E 3.8756 8.1895 121.0751 59.3255 29.0556 179.0988 110 S 4.1247 7.7400 112.8733 60.4884 63.0157 175.7921 111 V 4.0844 6.8738 113.0112 60.1377 31.6828 176.1761 112 G 3.0252 7.1342 105.9012 46.5669 0.0000 175.5940 113 D 4.4528 7.3674 120.9407 52.6933 37.8406 176.1572 114 Y 4.2763 7.1059 120.9577 60.6643 38.4916 178.0976 115 A 4.0257 8.0124 121.3540 55.4021 18.7042 179.6517 116 S 4.1285 8.3403 113.7526 61.6061 62.7564 176.8558 117 R 3.9167 7.9975 121.3967 59.6491 29.8484 178.3992 118 E 3.9753 8.2227 118.2610 59.2525 29.4600 179.1375 119 L 3.9568 7.9078 120.1758 58.3008 42.1388 179.1533 120 L 4.0446 8.0693 118.8199 57.3876 41.4697 179.0928 121 E 3.9174 8.3775 119.8322 59.4240 29.5727 178.4796 122 D 4.3945 8.0660 118.7697 57.6102 40.8536 179.0537 123 I 3.5378 7.5473 119.6101 64.1321 37.0828 178.1452 124 L 3.9611 8.2175 121.5239 58.3672 41.6788 178.9320 125 E 4.0263 8.0645 117.1910 59.5710 29.6838 179.2873 126 S 4.3360 8.0052 114.8812 61.5452 62.9028 176.5202 127 E 4.2179 8.6481 121.7680 59.5262 29.1852 179.0342 128 E 4.2129 8.4548 117.6239 58.2994 29.4147 178.8369 129 D 4.4509 8.0474 119.7169 57.2387 41.3032 177.9058 130 H 4.3597 8.3442 118.1792 59.5291 29.7366 177.0923 131 I 3.7320 7.9195 121.4870 64.2989 36.9481 177.6935 132 D 4.5092 7.8879 118.6747 57.3028 41.0761 178.1524 133 W 4.0914 8.7908 129.0610 60.5290 30.8070 177.9023 134 L 3.9100 8.5385 119.1270 57.8599 41.0866 179.3578 135 E 3.9339 8.6659 118.9380 59.6286 29.3135 179.5617 136 T 3.7576 7.9037 115.8048 66.6252 68.3863 176.7256 137 Q 3.6183 7.4677 119.8531 58.7500 28.7483 178.9097 138 L 3.7250 7.4710 119.6557 57.8745 41.6529 179.3874 139 D 4.3113 8.0750 118.8034 56.9196 40.5855 178.6348 140 L 3.8857 8.0093 121.5442 58.1031 42.0506 178.8708 141 I 3.4998 7.5039 119.9871 64.6241 36.7628 178.1499 142 D 4.2939 7.6077 118.0373 57.2358 40.6766 178.6702 143 K 4.1701 7.8976 118.5159 58.2438 32.2764 178.4043 144 I 4.3211 8.1264 110.3922 59.3610 39.0862 176.3212 145 G 4.0357 8.0092 108.6781 46.0788 0.0000 174.1961 146 L 3.9588 8.6086 123.2822 58.2359 42.0683 179.3712 147 E 3.9909 8.1689 117.7660 59.5981 29.4657 179.0566 148 N 4.3527 8.0943 115.9484 56.2978 38.4875 176.6140 149 Y 3.9711 7.9905 119.9793 60.7958 39.2279 177.9510 150 L 4.0427 8.4592 120.2485 57.6943 41.7773 179.1450 151 Q 3.9453 8.1149 119.4903 59.4355 28.8169 178.5187 152 S 4.2730 7.8660 113.5663 60.1793 63.1391 175.3365 153 Q 4.3364 7.5741 120.2268 55.8557 28.5135 177.2644 154 M 4.3174 7.7246 122.5326 57.5438 31.9075 176.0731 155 D 4.5531 7.8818 121.2756 54.3420 41.5324 176.0171 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 8.16 4.18 0.00 1.32 1.89 0.00 0.00 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.39 0.00 2 K 8.60 3.76 0.00 1.83 1.68 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.38 1.46 7.81 3 G 8.67 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 0.00 0.00 0.00 4 D 8.42 4.48 0.00 2.76 2.61 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 0.00 5 K 9.21 3.80 0.00 1.85 1.81 0.00 1.76 0.00 0.00 1.80 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.48 1.54 7.81 6 I 7.83 3.61 1.85 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 1.41 0.41 0.01 0.00 0.00 7 V 9.32 3.70 2.31 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 1.15 0.00 0.00 1.14 0.00 0.00 8 I 7.99 3.76 1.99 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.58 0.90 0.00 0.00 9 Q 8.05 3.93 0.00 2.07 2.04 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 2.57 2.46 0.00 10 H 8.29 4.06 0.00 3.41 3.32 0.00 5.63 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 11 L 8.35 4.02 0.00 1.99 1.74 0.95 0.65 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 12 N 8.45 4.37 0.00 2.97 2.84 0.00 0.00 6.69 7.80 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 13 K 7.96 3.89 0.00 1.89 2.02 0.00 1.58 0.00 0.00 1.64 0.00 0.00 3.24 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.46 7.81 14 I 7.91 3.75 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 1.65 0.82 0.92 0.00 0.00 15 L 8.14 4.05 0.00 1.85 1.87 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.07 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 0.00 0.00 0.00 17 N 7.86 4.33 0.00 2.96 2.88 0.00 0.00 7.02 8.35 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 18 E 8.25 3.93 0.00 2.13 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 0.00 2.61 2.53 0.00 19 L 8.06 4.07 0.00 1.78 1.67 0.89 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 20 I 7.50 3.58 2.01 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.73 0.84 0.00 0.00 21 A 7.90 3.31 1.05 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 0.00 0.00 0.00 0.00 0.00 22 I 7.89 3.57 1.97 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 1.54 0.79 0.86 0.00 0.00 23 N 7.82 4.33 0.00 2.71 2.82 0.00 0.00 6.76 9.07 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 24 Q 7.99 3.87 0.00 2.04 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.47 2.26 0.00 25 Y 7.93 4.45 0.00 2.99 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 26 F 8.41 3.93 0.00 3.40 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 27 L 8.23 3.99 0.00 1.84 1.77 0.89 0.85 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 28 H 8.43 3.95 0.00 3.45 3.13 0.00 5.70 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.39 4.13 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 30 R 7.75 3.85 0.00 1.79 1.92 0.00 3.20 0.00 0.00 3.06 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 31 M 7.80 3.48 0.00 0.86 1.59 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.19 0.00 32 Y 7.51 4.47 0.00 3.24 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 33 E 8.25 4.01 0.00 1.98 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 2.33 2.45 0.00 34 D 7.86 4.36 0.00 2.59 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 35 W 7.88 4.95 0.00 3.72 3.05 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 0.00 0.00 0.00 36 G 8.09 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 37 L 8.06 4.84 0.00 1.98 1.64 1.30 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.40 3.95 0.00 2.15 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 2.34 2.37 0.00 39 K 8.06 3.89 0.00 1.79 1.96 0.00 1.81 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.50 7.81 40 L 7.83 4.11 0.00 1.44 0.52 0.56 0.97 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 41 G 8.25 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 0.00 0.00 0.00 42 K 8.46 3.97 0.00 1.90 1.88 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.66 7.81 43 H 7.96 3.86 0.00 3.10 3.19 0.00 5.79 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 44 E 8.37 3.84 0.00 2.27 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 0.00 2.67 3.12 0.00 45 Y 8.22 3.84 0.00 3.01 3.15 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 0.00 46 H 8.28 3.96 0.00 3.22 3.27 0.00 5.84 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 47 E 8.18 3.64 0.00 1.81 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 1.83 1.71 0.00 48 S 8.17 4.22 0.00 4.06 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 49 I 7.34 3.60 1.78 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.28 0.81 0.00 0.00 50 D 7.94 4.19 0.00 2.64 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 8.30 3.92 0.00 2.11 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 2.71 2.52 0.00 52 M 7.91 4.00 0.00 2.03 2.25 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 2.53 0.00 53 K 8.06 3.98 0.00 1.94 1.84 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.59 7.81 54 H 8.24 4.23 0.00 3.42 3.32 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.24 3.99 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 56 D 8.20 4.28 0.00 2.90 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 57 K 8.12 4.01 0.00 2.04 1.86 0.00 1.95 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.49 7.81 58 L 8.03 4.01 0.00 1.88 1.72 0.93 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.09 3.71 2.04 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 1.52 1.00 0.92 0.00 0.00 60 K 8.17 3.99 0.00 1.97 1.87 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.47 1.58 7.81 61 R 8.04 4.01 0.00 2.07 2.13 0.00 3.36 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.80 0.00 62 I 8.09 3.70 2.04 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 1.53 0.73 0.91 0.00 0.00 63 L 8.06 3.99 0.00 1.91 1.77 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.16 4.39 0.00 2.95 3.30 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 65 L 8.01 4.33 0.00 1.98 1.59 0.75 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.96 3.90 0.00 2.04 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 0.00 2.18 2.30 0.00 67 G 8.12 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 0.00 0.00 0.00 68 L 8.00 4.57 0.00 1.61 1.60 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 69 P 0.00 4.25 0.00 2.03 1.98 0.00 3.63 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 70 N 8.55 4.73 0.00 2.63 2.71 0.00 0.00 6.98 7.78 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 71 L 8.16 4.52 0.00 1.62 1.65 0.91 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.09 4.01 0.00 1.97 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.94 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 73 E 8.39 4.06 0.00 1.94 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 2.30 2.22 0.00 74 L 8.21 4.47 0.00 1.55 1.47 0.89 1.01 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 75 G 8.46 3.85 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 0.00 0.00 0.00 76 K 8.40 3.86 0.00 1.72 1.73 0.00 1.76 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.44 7.81 77 L 8.28 4.59 0.00 1.59 1.51 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 78 L 8.40 4.54 0.00 1.83 1.64 1.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 79 I 7.87 4.15 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 1.35 0.76 0.95 0.00 0.00 80 G 8.74 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 0.00 0.00 0.00 81 E 9.59 4.77 0.00 2.08 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 0.00 2.33 2.26 0.00 82 H 7.64 5.00 0.00 3.21 3.28 0.00 5.49 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 T 8.73 4.28 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 1.47 0.00 0.00 84 K 8.27 3.86 0.00 1.84 1.93 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.80 1.48 7.81 85 E 8.15 4.04 0.00 1.63 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 2.35 2.38 0.00 86 M 8.52 4.11 0.00 1.77 2.33 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.31 0.00 87 L 8.32 4.16 0.00 2.06 1.72 1.21 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.29 4.00 0.00 2.19 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 2.33 2.66 0.00 89 C 8.63 4.24 0.00 3.21 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 90 D 8.44 4.69 0.00 2.97 2.77 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 91 L 8.16 4.00 0.00 1.86 1.87 0.94 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.59 3.93 0.00 2.01 2.01 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.48 7.81 93 L 8.04 4.04 0.00 1.97 1.99 0.86 1.00 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 94 E 8.24 4.19 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.47 0.00 95 Q 7.80 4.34 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.57 0.00 96 A 8.82 4.21 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 97 G 8.02 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 L 7.40 4.08 0.00 2.05 1.79 0.96 0.98 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 99 P 0.00 4.37 0.00 2.21 2.11 0.00 3.74 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 2.13 2.20 0.00 100 D 8.92 4.37 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 0.00 101 L 7.84 4.00 0.00 1.85 1.73 0.95 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 102 K 8.14 3.96 0.00 1.84 1.88 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.63 7.81 103 A 8.18 4.05 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 A 8.24 3.69 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 0.00 105 I 8.09 3.64 2.04 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 1.47 1.07 0.93 0.00 0.00 106 A 8.05 4.02 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 0.00 107 Y 8.09 3.79 0.00 3.17 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 C 8.41 4.03 0.00 3.13 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.19 3.88 0.00 2.19 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 2.35 2.40 0.00 110 S 7.74 4.12 0.00 3.93 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 V 6.87 4.08 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.71 0.00 0.00 112 G 7.13 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 0.00 0.00 0.00 113 D 7.37 4.45 0.00 2.61 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.11 4.28 0.00 3.09 2.97 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 8.01 4.03 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 0.00 116 S 8.34 4.13 0.00 4.17 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 0.00 117 R 8.00 3.92 0.00 1.93 2.22 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 1.68 1.72 0.00 118 E 8.22 3.98 0.00 2.25 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 2.58 2.50 0.00 119 L 7.91 3.96 0.00 1.77 1.87 0.97 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 120 L 8.07 4.04 0.00 1.91 1.71 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.38 3.92 0.00 2.26 2.18 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 2.32 2.42 0.00 122 D 8.07 4.39 0.00 2.92 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 0.00 123 I 7.55 3.54 1.94 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.76 0.80 0.00 0.00 124 L 8.22 3.96 0.00 1.82 1.88 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 125 E 8.06 4.03 0.00 2.13 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 2.37 2.69 0.00 126 S 8.01 4.34 0.00 4.10 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 0.00 127 E 8.65 4.22 0.00 2.12 2.17 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 2.71 2.53 0.00 128 E 8.45 4.21 0.00 2.06 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 0.00 2.37 2.49 0.00 129 D 8.05 4.45 0.00 2.97 2.77 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 0.00 130 H 8.34 4.36 0.00 3.22 3.53 0.00 5.69 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 0.00 131 I 7.92 3.73 2.08 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 1.46 0.58 0.95 0.00 0.00 132 D 7.89 4.51 0.00 2.92 2.91 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 0.00 133 W 8.79 4.09 0.00 3.46 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 8.54 3.91 0.00 1.94 1.73 0.82 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.67 3.93 0.00 2.06 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 2.32 2.63 0.00 136 T 7.90 3.76 4.16 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 1.06 0.00 0.00 137 Q 7.47 3.62 0.00 1.68 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.16 0.00 138 L 7.47 3.73 0.00 1.75 1.60 0.87 0.87 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 0.00 139 D 8.08 4.31 0.00 2.72 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 L 8.01 3.89 0.00 1.88 1.58 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 141 I 7.50 3.50 1.77 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 0.89 -0.36 0.79 0.00 0.00 142 D 7.61 4.29 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 0.00 143 K 7.90 4.17 0.00 1.72 1.85 0.00 1.63 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.62 7.81 144 I 8.13 4.32 1.89 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.71 0.92 0.00 0.00 145 G 8.01 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 0.00 0.00 0.00 146 L 8.61 3.96 0.00 1.75 1.68 0.98 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 147 E 8.17 3.99 0.00 2.05 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 2.39 2.40 0.00 148 N 8.09 4.35 0.00 3.07 2.88 0.00 0.00 6.74 7.48 0.00 0.00 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 Y 7.99 3.97 0.00 2.98 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 0.00 150 L 8.46 4.04 0.00 1.69 1.70 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.11 3.95 0.00 2.17 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 152 S 7.87 4.27 0.00 3.80 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 0.00 153 Q 7.57 4.34 0.00 2.01 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.82 0.00 0.00 0.00 0.00 0.00 1.82 2.05 0.00 154 M 7.72 4.32 0.00 2.07 2.20 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.45 0.00 155 D 7.88 4.55 0.00 2.61 2.52 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