NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 61 N 4.6635 8.4201 117.7829 52.4903 39.3759 176.9444 62 A 4.6419 8.3262 112.8090 51.3050 17.4013 173.8826 63 K 4.1982 9.4804 123.6746 55.6402 34.8987 175.4214 64 I 4.7432 8.1892 123.0694 59.7040 39.7292 174.6259 65 I 4.9726 8.6414 127.3061 59.4662 40.8205 174.7635 66 G 4.5224 8.8953 113.1573 44.8794 0.0000 171.8096 67 Y 5.4192 8.9121 123.2741 55.5020 41.5897 174.4478 68 A 4.8163 8.0048 127.5959 50.2843 22.7321 174.7231 69 R 5.1283 8.0696 114.8946 56.2260 32.9247 174.2143 70 V 4.5769 7.8773 111.7744 59.9922 36.1797 176.7712 71 S 4.1097 8.6379 116.6702 59.4346 63.2728 174.7450 72 F 5.2070 8.0004 117.9921 55.1172 42.3210 175.4720 73 N 4.2090 9.1173 122.2909 56.7127 38.8379 176.5888 74 A 4.1447 8.1833 119.5054 54.5199 18.7664 178.1367 75 Q 4.6444 8.2808 115.2383 55.8164 29.2572 177.7889 76 K 4.0633 7.9789 123.7674 60.1625 32.5163 178.7094 77 D 4.3664 8.0567 119.8187 57.0310 40.6881 178.0078 78 D 4.2899 8.0569 118.1939 57.2273 41.4125 177.3368 79 L 3.8221 7.8429 120.8732 58.7247 41.9820 178.7615 80 E 3.9497 8.3818 118.6542 58.9708 29.4465 178.8272 81 R 3.8356 8.0107 118.9287 59.5826 30.2182 178.2743 82 Q 4.0025 8.2607 117.9478 59.1927 28.6978 179.3192 83 I 3.6978 7.8085 120.4563 64.6044 37.0940 178.5829 84 Q 4.0846 8.0875 118.8766 58.6318 28.4844 178.6013 85 L 3.9774 8.1344 121.4715 58.2932 42.1274 179.1334 86 I 3.7804 7.8768 119.6984 64.2818 37.1520 178.3599 87 K 4.0036 8.5706 121.1581 59.5880 32.0270 178.9062 88 S 4.2815 8.5171 114.5157 60.8665 62.8752 175.7528 89 Y 3.9172 8.2448 123.3612 60.6828 38.6001 177.6942 90 A 4.1806 8.4596 121.8198 55.5727 18.3391 179.2837 91 E 4.0069 8.0153 117.0038 59.2442 29.4701 178.7419 92 E 3.8357 8.2584 118.4557 58.6736 29.5471 178.0258 93 N 4.1999 6.9064 113.4254 51.6268 38.9102 175.0600 94 G 3.7880 7.2030 108.3378 46.3963 0.0000 173.6041 95 W 5.0476 8.1684 119.6041 54.3667 30.7626 176.4616 96 D 4.6169 8.7364 123.3654 54.5283 40.9827 175.5038 97 I 4.9270 8.0699 122.3157 59.5379 41.6979 173.4432 98 Q 4.6477 8.6857 129.3389 54.5933 30.9086 173.9616 99 I 5.0284 8.4182 126.9738 59.7054 39.2833 174.8831 100 L 5.0579 9.1053 126.8024 52.9060 44.6812 175.6482 101 K 5.2798 8.3757 119.8133 54.9003 36.0974 174.9362 102 D 5.0117 8.3033 119.9298 52.6767 45.3780 174.9061 103 I 4.4751 8.3720 122.1293 60.8178 38.2133 175.3161 104 G 4.0402 8.3981 116.5217 45.7801 0.0000 171.4913 105 S 4.3709 7.2505 114.6137 57.3063 63.2357 175.0167 106 G 3.7113 8.3577 112.6553 46.4344 0.0000 175.0752 107 L 4.3136 7.7119 119.7999 55.7695 42.2937 176.5087 108 N 4.5784 7.8062 117.8931 52.3705 37.6912 175.1747 109 E 4.2802 8.6391 125.3913 58.1074 29.8240 178.0726 110 K 4.4368 8.6241 117.9293 55.9682 32.5653 177.3572 111 R 3.9142 7.7440 119.1907 56.7453 31.1658 177.0067 112 K 3.9496 8.7523 124.3314 59.9221 32.3822 178.6922 113 N 4.5021 8.8404 116.8083 56.0084 38.4273 176.7178 114 Y 3.8745 8.6193 121.2211 60.9089 38.8561 178.7094 115 K 3.7403 8.3729 119.2162 58.9223 31.8326 179.2881 116 K 3.8232 7.8196 119.4030 59.3400 32.2046 178.0784 117 L 3.9628 7.7416 119.2764 58.3099 42.0424 178.3264 118 L 3.8807 7.4959 117.7175 57.6558 41.6387 180.8418 119 K 3.9433 7.4856 116.3335 56.4241 32.3371 177.0252 *121 V 3.4596 7.6757 114.7796 62.2983 32.4561 175.9242 *123 N 4.4421 8.1982 112.4522 51.6279 39.9483 174.4001 124 R 3.7962 7.5444 115.5257 57.7414 27.9218 176.8529 125 K 4.5563 7.7886 115.3222 56.2238 34.1415 176.5835 126 V 4.6621 7.4192 120.1104 61.2312 33.6603 174.5633 127 E 4.2713 9.1403 129.1304 58.1954 31.0490 176.1236 128 K 5.0432 7.6838 117.1945 54.6010 37.0674 175.2838 129 V 4.8903 9.1036 124.3630 61.2942 34.0592 174.0969 130 I 5.0598 9.0247 129.7561 59.6519 39.2665 174.8614 131 I 4.8888 8.7654 120.1170 58.9028 40.9285 176.4907 132 A 4.1465 8.6001 125.4211 54.9679 19.4024 177.0956 133 Y 4.9388 7.1509 110.7061 55.3542 40.7939 173.6205 134 P 3.8076 0.0000 0.0000 65.6552 31.3071 178.2955 135 D 5.1950 7.7655 113.5957 54.0883 39.7881 177.3693 136 R 3.8223 7.3737 119.4968 59.2540 30.3153 177.9959 137 L 4.2539 8.0509 119.0981 57.8366 42.5884 176.5848 138 T 4.4608 7.2709 110.2893 60.8926 70.1901 173.9919 139 R 3.5940 8.8756 127.9190 58.7028 30.2015 176.6693 140 F 5.0686 7.5948 113.4156 56.7076 42.2425 175.1571 141 G 4.0175 9.0511 108.6534 46.8533 0.0000 175.4438 142 F 4.0295 8.4379 123.5122 61.2248 39.2733 176.9917 143 E 3.9723 8.3064 117.5852 59.6225 29.3773 179.1508 144 T 3.8999 7.9297 115.3139 66.5596 68.5210 176.0664 145 L 3.9074 7.9229 122.0740 57.9920 42.0315 178.8438 146 K 3.4801 7.8962 119.7188 59.3880 32.1673 178.5131 147 E 3.8523 8.0777 118.6190 59.5318 28.8755 179.3536 148 F 3.9697 8.2455 117.6922 60.4275 38.9248 177.5692 149 F 4.4639 8.9973 117.8741 60.8892 38.8069 177.6751 150 K 4.0238 8.3307 118.1547 59.7515 31.6652 179.4745 151 S 4.2928 7.6658 112.4730 60.8428 62.9155 175.1168 152 Y 4.6076 7.2526 117.3632 57.6872 37.9519 175.9618 153 G 3.8996 8.5315 108.6810 45.7032 0.0000 173.0178 154 T 4.8174 7.9046 115.8366 61.4590 70.6451 173.8783 155 E 4.5540 8.8018 125.8965 55.5247 31.7068 175.4192 156 I 4.9001 8.3513 123.9557 59.9759 38.8102 175.2316 157 V 4.1816 9.2305 128.9203 61.7326 32.8755 174.7554 158 I 4.6410 8.3146 129.6277 60.1416 37.3950 175.8460 159 I 3.6153 8.5610 129.4989 63.7413 37.4637 176.9146 160 N 4.8762 8.7979 124.0902 50.9923 38.8670 175.5036 161 K 3.9877 8.6066 123.3696 57.3180 31.9855 178.1711 162 K 4.2703 7.9112 115.7673 56.6789 32.7277 176.3061 163 H 3.5289 7.3153 116.8303 55.3690 30.1949 174.0152 164 K 3.9123 7.9247 127.6409 56.0805 32.2114 176.3240 165 T 4.0646 8.1562 121.8277 60.6547 67.7501 172.1273 166 P 4.3687 0.0000 0.0000 62.7316 32.0909 177.0437 167 Q 4.0289 8.8882 123.8673 59.0947 28.9216 178.0963 168 E 4.0813 8.2011 118.3256 59.4676 29.5833 178.9037 169 E 4.0575 8.0905 118.6596 59.0991 29.5606 179.1734 170 L 3.9815 7.9193 118.6736 57.7086 41.7551 179.6065 171 V 3.5821 7.8863 118.0472 66.2516 31.6029 177.9804 172 E 4.2044 8.6669 118.4157 59.0426 29.3320 179.0282 173 D 4.3869 8.5451 119.7590 57.0833 40.8450 178.3114 174 L 4.0006 7.8823 120.6994 58.3659 42.1315 179.0777 175 I 3.7613 7.8796 119.6095 64.7517 37.1125 178.5240 176 T 3.9800 8.1195 116.4911 66.8333 68.3177 176.8160 177 I 4.0139 8.1653 121.8456 64.2763 37.1964 178.6441 178 V 3.6893 8.3590 119.6918 65.9696 31.2716 177.8978 179 S 4.1754 8.2563 112.9346 61.7129 62.2489 175.7070 180 H 4.1965 8.2745 120.2284 59.4557 29.7046 177.3091 181 F 3.8550 8.5885 119.3575 60.3601 38.7546 177.4320 182 A 4.2299 8.8354 121.0258 55.1487 18.0912 179.7998 183 G 3.6893 8.6498 104.3628 48.1746 0.0000 176.1098 184 K 3.9206 7.6453 119.9338 58.9159 32.0759 179.2780 185 L 3.8961 8.1581 118.8245 57.1364 41.4819 177.6224 186 Y 4.9688 8.0783 112.6989 56.7534 41.4686 176.2006 187 G 3.9259 7.9307 106.3133 45.1724 0.0000 174.8208 *189 H 4.6543 8.5937 122.2731 54.9569 30.2221 173.6536 190 S 4.5035 7.8418 116.2582 57.9409 64.9517 174.6380 191 H 4.0950 8.6762 120.7408 59.5777 29.6274 177.3446 192 K 3.8157 7.9950 119.6804 59.0877 31.7603 178.6799 193 Y 4.1250 7.9832 120.0778 60.6351 38.7293 178.0410 194 K 3.8887 8.3771 119.3536 59.4651 32.2535 178.7022 195 K 3.6997 7.9662 119.6282 59.8038 32.0002 178.2683 196 L 3.9157 7.8427 120.1628 58.2295 42.0171 179.0850 197 T 3.7202 7.5111 109.8652 64.7938 68.7481 176.6969 198 K 3.9608 8.1644 122.3956 59.2269 32.5087 179.3322 199 T 3.7686 7.9041 117.1945 66.5479 68.4332 176.6203 200 V 3.5459 7.7043 120.0544 65.8983 31.5424 177.6345 201 K 3.8397 8.2389 119.5393 59.9062 31.6987 178.4928 202 E 3.9955 7.8343 117.4690 59.3806 29.4223 179.1401 203 I 3.8751 7.4037 118.8495 64.2790 37.3147 178.3652 204 V 3.9994 7.6855 111.3457 62.7516 31.7327 177.1519 205 R 4.4384 7.6810 116.4521 55.7850 30.1274 176.2699 206 E 4.2517 7.8358 122.0535 56.4449 29.7718 175.4492 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 61 N 8.42 4.66 0.00 2.76 2.07 0.00 0.00 6.44 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.33 4.64 1.23 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 63 K 9.48 4.20 0.00 1.70 1.70 0.00 1.59 0.00 0.00 1.62 0.00 0.00 2.82 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.51 7.81 64 I 8.19 4.74 1.95 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 0.96 0.99 0.81 0.00 0.00 65 I 8.64 4.97 1.88 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 1.16 0.63 0.98 0.00 0.00 66 G 8.90 4.52 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 0.00 67 Y 8.91 5.42 0.00 3.01 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.00 4.82 1.03 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 69 R 8.07 5.13 0.00 1.90 1.54 0.00 3.18 0.00 0.00 3.05 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.31 0.00 70 V 7.88 4.58 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 0.73 0.00 0.00 1.01 0.00 0.00 71 S 8.64 4.11 0.00 3.10 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 72 F 8.00 5.21 0.00 3.25 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 N 9.12 4.21 0.00 2.77 2.88 0.00 0.00 7.04 8.74 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 74 A 8.18 4.14 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 75 Q 8.28 4.64 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.74 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 76 K 7.98 4.06 0.00 2.03 2.33 0.00 1.32 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.49 7.81 77 D 8.06 4.37 0.00 2.72 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 78 D 8.06 4.29 0.00 2.74 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 79 L 7.84 3.82 0.00 1.77 1.88 0.80 0.68 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 80 E 8.38 3.95 0.00 2.21 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 2.31 2.37 0.00 81 R 8.01 3.84 0.00 2.15 2.17 0.00 3.24 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 82 Q 8.26 4.00 0.00 2.29 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.41 0.00 83 I 7.81 3.70 2.01 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 1.48 0.62 0.91 0.00 0.00 84 Q 8.09 4.08 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.62 2.52 0.00 85 L 8.13 3.98 0.00 1.92 1.89 0.97 0.96 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 86 I 7.88 3.78 2.03 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.58 1.00 0.00 0.00 87 K 8.57 4.00 0.00 2.10 1.97 0.00 1.65 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.49 7.81 88 S 8.52 4.28 0.00 4.09 4.13 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 89 Y 8.24 3.92 0.00 3.29 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 90 A 8.46 4.18 1.64 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 91 E 8.02 4.01 0.00 2.20 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 2.26 2.34 0.00 92 E 8.26 3.84 0.00 1.79 1.70 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 2.24 2.43 0.00 93 N 6.91 4.20 0.00 1.44 1.42 0.00 0.00 7.02 7.42 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 94 G 7.20 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 95 W 8.17 5.05 0.00 3.39 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 96 D 8.74 4.62 0.00 2.72 2.65 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 0.00 0.00 0.00 0.00 97 I 8.07 4.93 2.04 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 1.31 1.00 1.01 0.00 0.00 98 Q 8.69 4.65 0.00 2.17 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.56 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 99 I 8.42 5.03 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.79 0.90 0.00 0.00 100 L 9.11 5.06 0.00 1.79 1.73 0.98 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.38 5.28 0.00 1.58 1.55 0.00 1.06 0.00 0.00 2.32 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.26 1.24 7.81 102 D 8.30 5.01 0.00 2.66 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 0.00 103 I 8.37 4.48 1.86 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 1.24 0.54 0.92 0.00 0.00 104 G 8.40 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 0.00 105 S 7.25 4.37 0.00 3.70 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 0.00 106 G 8.36 3.71 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 0.00 0.00 0.00 107 L 7.71 4.31 0.00 1.64 1.76 0.98 0.95 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 0.00 108 N 7.81 4.58 0.00 2.80 2.82 0.00 0.00 7.03 7.62 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 0.00 109 E 8.64 4.28 0.00 2.05 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 2.39 2.37 0.00 110 K 8.62 4.44 0.00 1.86 1.86 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.55 7.81 111 R 7.74 3.91 0.00 1.91 2.24 0.00 3.10 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 112 K 8.75 3.95 0.00 1.85 1.85 0.00 1.73 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.55 7.81 113 N 8.84 4.50 0.00 3.36 3.02 0.00 0.00 6.71 7.25 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 0.00 114 Y 8.62 3.87 0.00 3.04 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 0.00 115 K 8.37 3.74 0.00 2.06 1.79 0.00 1.89 0.00 0.00 1.60 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.64 7.81 116 K 7.82 3.82 0.00 1.76 2.06 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.42 7.81 117 L 7.74 3.96 0.00 1.70 1.73 0.87 1.32 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 0.00 118 L 7.50 3.88 0.00 1.49 1.50 0.41 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 119 K 7.49 3.94 0.00 1.63 1.83 0.00 1.75 0.00 0.00 1.56 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.42 7.81 *121 V 7.68 3.46 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.40 0.00 0.00 *123 N 8.20 4.44 0.00 2.68 2.78 0.00 0.00 7.15 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 0.00 124 R 7.54 3.80 0.00 1.95 2.02 0.00 3.19 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.65 0.00 125 K 7.79 4.56 0.00 1.55 1.74 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.77 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.49 1.27 7.81 126 V 7.42 4.66 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.82 0.00 0.00 127 E 9.14 4.27 0.00 1.99 1.88 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 2.13 2.21 0.00 128 K 7.68 5.04 0.00 1.46 1.51 0.00 0.82 0.00 0.00 1.49 0.00 0.00 2.52 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.21 7.81 129 V 9.10 4.89 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 1.17 0.00 0.00 1.02 0.00 0.00 130 I 9.02 5.06 1.98 0.00 0.00 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 1.46 0.65 0.89 0.00 0.00 131 I 8.77 4.89 1.88 0.00 0.00 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 1.40 0.90 1.13 0.00 0.00 132 A 8.60 4.15 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 Y 7.15 4.94 0.00 3.10 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 0.00 134 P 0.00 3.81 0.00 1.74 0.60 0.00 3.60 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 1.81 1.62 0.00 135 D 7.77 5.20 0.00 2.67 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 0.00 136 R 7.37 3.82 0.00 1.72 1.82 0.00 2.83 0.00 0.00 2.95 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.01 0.00 137 L 8.05 4.25 0.00 1.77 2.05 0.96 0.77 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 0.00 138 T 7.27 4.46 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 1.43 0.00 0.00 139 R 8.88 3.59 0.00 1.46 1.64 0.00 2.89 0.00 0.00 2.88 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.00 140 F 7.59 5.07 0.00 3.12 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 0.00 141 G 9.05 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 0.00 0.00 0.00 142 F 8.44 4.03 0.00 3.14 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 0.00 143 E 8.31 3.97 0.00 2.08 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 2.56 2.43 0.00 144 T 7.93 3.90 4.47 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 1.44 0.00 0.00 145 L 7.92 3.91 0.00 1.81 1.37 0.93 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 146 K 7.90 3.48 0.00 1.27 1.72 0.00 1.75 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.34 7.81 147 E 8.08 3.85 0.00 2.04 1.70 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 2.25 2.38 0.00 148 F 8.25 3.97 0.00 3.22 3.28 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 0.00 149 F 9.00 4.46 0.00 3.19 3.34 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 0.00 150 K 8.33 4.02 0.00 1.93 1.84 0.00 1.64 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.49 7.81 151 S 7.67 4.29 0.00 3.79 3.71 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 0.00 152 Y 7.25 4.61 0.00 3.06 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 0.00 153 G 8.53 3.90 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 0.00 0.00 0.00 154 T 7.90 4.82 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 1.17 0.00 0.00 155 E 8.80 4.55 0.00 1.96 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 2.46 0.00 156 I 8.35 4.90 1.94 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.63 1.09 0.00 0.00 157 V 9.23 4.18 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 1.16 0.00 0.00 1.07 0.00 0.00 158 I 8.31 4.64 1.91 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.84 1.00 0.00 0.00 159 I 8.56 3.62 1.77 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.29 0.86 0.00 0.00 160 N 8.80 4.88 0.00 2.90 2.74 0.00 0.00 7.16 7.19 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 0.00 161 K 8.61 3.99 0.00 1.77 1.74 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.05 7.81 162 K 7.91 4.27 0.00 1.70 1.83 0.00 1.74 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.34 7.81 163 H 7.32 3.53 0.00 3.06 2.57 0.00 5.75 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 K 7.92 3.91 0.00 1.56 1.55 0.00 1.63 0.00 0.00 1.54 0.00 0.00 3.05 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.34 1.40 7.81 165 T 8.16 4.06 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 1.20 0.00 0.00 166 P 0.00 4.37 0.00 2.32 2.25 0.00 3.94 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.06 0.00 167 Q 8.89 4.03 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.94 0.00 0.00 0.00 0.00 0.00 2.43 2.49 0.00 168 E 8.20 4.08 0.00 2.27 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.57 0.00 169 E 8.09 4.06 0.00 2.19 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 2.25 2.39 0.00 170 L 7.92 3.98 0.00 1.88 1.73 0.92 0.84 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 0.00 171 V 7.89 3.58 2.27 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 1.05 0.00 0.00 1.00 0.00 0.00 172 E 8.67 4.20 0.00 2.30 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.66 0.00 173 D 8.55 4.39 0.00 2.75 2.70 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 0.00 174 L 7.88 4.00 0.00 1.91 1.91 0.95 1.03 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 0.00 175 I 7.88 3.76 1.93 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 1.54 0.90 0.96 0.00 0.00 176 T 8.12 3.98 4.48 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 1.28 0.00 0.00 177 I 8.17 4.01 2.13 0.00 0.00 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 1.67 1.16 1.16 0.00 0.00 178 V 8.36 3.69 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 0.90 0.00 0.00 1.02 0.00 0.00 179 S 8.26 4.18 0.00 4.16 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 0.00 180 H 8.27 4.20 0.00 3.29 3.56 0.00 5.64 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 0.00 181 F 8.59 3.85 0.00 3.10 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 0.00 182 A 8.84 4.23 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 0.00 183 G 8.65 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 0.00 184 K 7.65 3.92 0.00 1.68 1.73 0.00 1.18 0.00 0.00 1.46 0.00 0.00 2.83 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.30 1.34 7.81 185 L 8.16 3.90 0.00 0.76 0.13 0.75 0.60 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 0.00 186 Y 8.08 4.97 0.00 3.17 2.93 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 0.00 187 G 7.93 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 0.00 0.00 0.00 *189 H 8.59 4.65 0.00 3.14 3.33 0.00 5.71 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 7.84 4.50 0.00 4.18 4.14 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 0.00 191 H 8.68 4.09 0.00 3.23 3.30 0.00 5.67 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 0.00 192 K 8.00 3.82 0.00 1.16 0.74 0.00 1.47 0.00 0.00 1.58 0.00 0.00 2.68 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.14 7.81 193 Y 7.98 4.12 0.00 3.40 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 K 8.38 3.89 0.00 1.99 1.86 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.64 1.82 7.81 195 K 7.97 3.70 0.00 1.76 1.85 0.00 1.63 0.00 0.00 1.52 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.43 7.81 196 L 7.84 3.92 0.00 1.82 1.73 0.94 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 197 T 7.51 3.72 4.05 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 0.58 0.00 0.00 198 K 8.16 3.96 0.00 1.98 2.08 0.00 1.31 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.45 7.81 199 T 7.90 3.77 4.38 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 1.19 0.00 0.00 200 V 7.70 3.55 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.94 0.00 0.00 201 K 8.24 3.84 0.00 2.03 2.00 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.50 7.81 202 E 7.83 4.00 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.56 0.00 203 I 7.40 3.88 1.99 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.65 0.91 0.00 0.00 204 V 7.69 4.00 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 0.75 0.00 0.00 0.99 0.00 0.00 205 R 7.68 4.44 0.00 2.01 1.93 0.00 3.10 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 206 E 7.84 4.25 0.00 1.99 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 2.15 2.48 0.00 * Residues marked with a * may have inaccurate shift predictions.