A0A087WQN5_MOUSE Loading...

Calcium-activated potassium channel subunit alpha-1

Potassium channel activated by both membrane depolarization or increase in cytosolic Ca(2+) that mediates export of K(+).

AlphaFold DB , UniProt , Accession A0A087WQN5, Species MOUSE (Mus musculus, Mouse), Gene Kcnma1, Length 1,239 aa.

						>A0A087WQN5_MOUSE|A0A087WQN5|Kcnma1
MANGGGGGGGSSGGGGGGGGGSGLRMSSNIHANHLSLDASSSSSSSSSSSSSSSSSSSSSVHEPKMDALIIPVTMEVPCDSRGQRMWWAFLASSMVTFFGGLFIILLWRTLKYLWTVCCHCGGKTKEAQKINNGSSQADGTLKPVDEKEEVVAAEVGWMTSVKDWAGVMISAQTLTGRVLVVLVFALSIGALVIYFIDSSNPIESCQNFYKDFTLQIDMAFNVFFLLYFGLRFIAANDKLWFWLEVNSVVDFFTVPPVFVSVYLNRSWLGLRFLRALRLIQFSEILQFLNILKTSNSIKLVNLLSIFISTWLTAAGFIHLVENSGDPWENFQNNQALTYWECVYLLMVTMSTVGYGDVYAKTTLGRLFMVFFILGGLAMFASYVPEIIELIGNRKKYGGSYSAVSGRKHIVVCGHITLESVSNFLKDFLHKDRDDVNVEIVFLHNISPNLELEALFKRHFTQVEFYQGSVLNPHDLARVKIESADACLILANKYCADPDAEDASNIMRVISIKNYHPKIRIITQMLQYHNKAHLLNIPSWNWKEGDDAICLAELKLGFIAQSCLAQGLSTMLANLFSMRSFIKIEEDTWQKYYLEGVSNEMYTEYLSSAFVGLSFPTVCELCFVKLKLLMIAIEYKSANRESRSRKRILINPGNHLKIQEGTLGFFIASDAKEVKRAFFYCKACHDDVTDPKRIKKCGCRRPKMSIYKRMRRACCFDCGRSERDCSCMSGRVRGNVDTLERTFPLSSVSVNDCSTSFRAFEDEQPPTLSPKKKQRNGGMRNSPNTSPKLMRHDPLLIPGNDQIDNMDSNVKKYDSTGMFHWCAPKEIEKVILTRSEAAMTVLSGHVVVCIFGDVSSALIGLRNLVMPLRASNFHYHELKHIVFVGSIEYLKREWETLHNFPKVSILPGTPLSRADLRAVNINLCDMCVILSANQNNIDDTSLQDKECILASLNIKSMQFDDSIGVLQANSQGFTPPGMDRSSPDNSPVHGMLRQPSITTGVNIPIITELVNDTNVQFLDQDDDDDPDTELYLTQPFACGTAFAVSVLDSLMSATYFNDNILTLIRTLVTGGATPELEALIAEENALRGGYSTPQTLANRDRCRVAQLALLDGPFADLGDGGCYGDLFCKALKTYNMLCFGIYRLRDAHLSTPSQCTKRYVITNPPYEFELVPTDLIFCLMQFDHNAGQSRASLSHSSHSSQSSSKKSSSVHSIPSTANRPNRPKSRESRDKQKKEMVYR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.2	Very low	31.5	Very low	250 Å²	250	109.2 Å²	109.2	100%	1.232	88%	0.876	S	S	*	*				0	161.4	0	-75.2	175.4	170.8	0	0	108.5
2	A	31.8	Very low	31.5	Very low	91 Å²	91	110.5 Å²	110.5	75%	0.752	88%	0.876	S	S	*	*			trans	-90.1	142.4	-168.8	0	0	0	0	0	113.4
3	N	33.9	Very low	31.4	Very low	169 Å²	169	107.9 Å²	107.9	90%	0.904	87%	0.87	S	S	*	*				-158.1	145.3	106.7	-110.7	-9.7	0	0	0	111
4	G	35.3	Very low	31.3	Very low	78 Å²	78	106.5 Å²	106.5	80%	0.804	87%	0.872	S	S	*	*			trans	-111.6	160.6	168.3	0	0	0	0	0	110.3
5	G	29.8	Very low	31.3	Very low	86 Å²	86	104.9 Å²	104.9	89%	0.887	87%	0.871	S	S	*	*			trans	-161.1	119	174.7	0	0	0	0	0	110
6	G	33.6	Very low	31.1	Very low	83 Å²	83	103.8 Å²	103.8	86%	0.856	87%	0.872	S	S	*	*			trans	-154.2	159.7	179	0	0	0	0	0	111.3
7	G	32	Very low	31.2	Very low	88 Å²	88	102.5 Å²	102.5	91%	0.907	87%	0.871	S	S	*	*			trans	108.8	131.5	-179.7	0	0	0	0	0	113.2
8	G	29	Very low	31	Very low	86 Å²	86	101.8 Å²	101.8	89%	0.887	87%	0.874	S	S	*	*			trans	147.8	90.9	179.9	0	0	0	0	0	111.2
9	G	31.6	Very low	31.2	Very low	80 Å²	80	101.1 Å²	101.1	83%	0.825	88%	0.876	S	S	*	*			trans	-139.1	158.6	-179.3	0	0	0	0	0	112.8
10	G	29.3	Very low	31.1	Very low	78 Å²	78	100.3 Å²	100.3	80%	0.804	88%	0.876	S	S	*	*			trans	99.7	156.3	-177.5	0	0	0	0	0	113.7
11	S	30.3	Very low	31.1	Very low	112 Å²	112	99.2 Å²	99.2	78%	0.783	87%	0.873	S	S	*	*			cis	-167	157.2	-9.8	-142.3	0	0	0	0	111.9
12	S	30.7	Very low	31.2	Very low	125 Å²	125	93.3 Å²	93.3	87%	0.874	86%	0.856	S	S	*	*			trans	62.4	151.2	167.1	67.8	0	0	0	0	118.9
13	G	31.3	Very low	31	Very low	77 Å²	77	92.8 Å²	92.8	79%	0.794	86%	0.859	S	S	*	*			cis	167.4	157.9	-10.4	0	0	0	0	0	114.5
14	G	28.9	Very low	30.8	Very low	88 Å²	88	93.3 Å²	93.3	91%	0.907	86%	0.861	S	S	*	*			trans	91.6	142.5	172.4	0	0	0	0	0	115.6
15	G	31.2	Very low	30.5	Very low	82 Å²	82	100.7 Å²	100.7	85%	0.845	87%	0.865	S	S	*	*			cis	173.4	142	-8.9	0	0	0	0	0	114
16	G	28.6	Very low	30.4	Very low	87 Å²	87	106.1 Å²	106.1	90%	0.897	87%	0.869	S	S	*	*			trans	94.5	147.3	176.3	0	0	0	0	0	114.8
17	G	32.1	Very low	30.1	Very low	82 Å²	82	107.7 Å²	107.7	85%	0.845	87%	0.867	S	S	*	*			cis	161.7	135.8	-8.2	0	0	0	0	0	113.1
18	G	29.3	Very low	30.1	Very low	90 Å²	90	109 Å²	109	93%	0.928	86%	0.862	S	S	*	*			trans	103.2	143.2	177.7	0	0	0	0	0	113.7
19	G	34.8	Very low	30	Very low	88 Å²	88	112.7 Å²	112.7	91%	0.907	86%	0.862	S	S	*	*			trans	-156.3	174	-178.9	0	0	0	0	0	112.2
20	G	28.1	Very low	29.9	Very low	86 Å²	86	115.8 Å²	115.8	89%	0.887	86%	0.858	S	S	*	*			trans	164	142.7	179.4	0	0	0	0	0	110.2
21	G	32.1	Very low	29.9	Very low	78 Å²	78	121.3 Å²	121.3	80%	0.804	86%	0.862	S	S	*	*			trans	-164.4	151.1	178.1	0	0	0	0	0	111.9
22	S	31.5	Very low	29.8	Very low	126 Å²	126	119.8 Å²	119.8	88%	0.881	86%	0.857	S	S	*	*			trans	-170.4	139.5	159.2	49.9	0	0	0	0	111.9
23	G	28.1	Very low	29.7	Very low	79 Å²	79	121.9 Å²	121.9	81%	0.814	86%	0.858	S	S	*	*			trans	59.2	116.1	140.4	0	0	0	0	0	120.9
24	L	29.7	Very low	29.5	Very low	180 Å²	180	126 Å²	126	94%	0.942	86%	0.856	S	S	*	*			trans	-121.7	138.1	144.3	-97.1	169.9	0	0	0	110
25	R	28.6	Very low	29.4	Very low	234 Å²	234	130.2 Å²	130.2	88%	0.883	86%	0.857	S	S	*	*			trans	-89.1	157.1	177	-65.4	171.5	171.6	163	-5.2	110
26	M	27.7	Very low	29.1	Very low	199 Å²	199	130.1 Å²	130.1	98%	0.98	84%	0.843	S	S	*	*			trans	-124.2	144.9	143.8	-79.3	-162.7	170.2	0	0	109.8
27	S	27.8	Very low	29	Very low	117 Å²	117	133 Å²	133	82%	0.818	84%	0.838	S	S	*	*			trans	-125.8	148.7	-178.2	48	0	0	0	0	109.7
28	S	31.6	Very low	28.6	Very low	114 Å²	114	136.1 Å²	136.1	80%	0.797	84%	0.835	S	S	*	*			trans	-67.4	154.2	-176	40.2	0	0	0	0	113.6
29	N	27.2	Very low	28.4	Very low	165 Å²	165	135.3 Å²	135.3	88%	0.882	82%	0.82	S	S	*	*			trans	-151.9	161.9	145.4	-123.8	-25.3	0	0	0	111.7
30	I	29.7	Very low	28	Very low	144 Å²	144	136.8 Å²	136.8	74%	0.738	82%	0.816	S	S	*	*			trans	-107.4	145.8	-164.7	-64.3	159.5	0	0	0	110.6
31	H	27.7	Very low	28	Very low	195 Å²	195	137.1 Å²	137.1	90%	0.903	81%	0.805	S	S	*	*			trans	-145	144.6	144.9	-116.5	-83.6	0	0	0	111
32	A	28.3	Very low	27.7	Very low	80 Å²	80	138.4 Å²	138.4	66%	0.661	80%	0.801	S	S	*	*			trans	-99.3	168.7	-172.8	0	0	0	0	0	112.6
33	N	28.6	Very low	27.5	Very low	169 Å²	169	137 Å²	137	90%	0.904	79%	0.791	S	S	*	*			trans	-145	146.6	150.4	-120.6	-25.8	0	0	0	111.6
34	H	28.3	Very low	27.5	Very low	163 Å²	163	138.3 Å²	138.3	76%	0.755	79%	0.788	S	S	*	*			trans	-81.8	153.6	-175.8	-103.7	-122.4	0	0	0	112.6
35	L	27.4	Very low	27.5	Very low	176 Å²	176	134.4 Å²	134.4	92%	0.921	78%	0.776	S	S	*	*			trans	-150	146.9	130.7	-111	166.8	0	0	0	109.4
36	S	25.1	Very low	27.5	Very low	80 Å²	80	128.4 Å²	128.4	56%	0.559	77%	0.77	S	S	*	*			trans	-150.2	-172.7	-164.7	52.9	0	0	0	0	110.8
37	L	25.8	Very low	27.6	Very low	149 Å²	149	123.6 Å²	123.6	78%	0.78	76%	0.756	S	S	*	*			trans	94.1	106.4	-168.8	-56.4	163.7	0	0	0	111
38	D	23.9	Very low	27.6	Very low	146 Å²	146	123.4 Å²	123.4	78%	0.781	75%	0.754	S	S	*	*				91.1	146.8	59.3	-76.5	4.7	0	0	0	111
39	A	25.7	Very low	27.6	Very low	74 Å²	74	123.1 Å²	123.1	61%	0.612	75%	0.753	S	S	*	*			cis	161	148.4	-24	0	0	0	0	0	106
40	S	26.1	Very low	27.6	Very low	118 Å²	118	120.1 Å²	120.1	83%	0.825	75%	0.745	S	S	*	*			trans	65.5	154	163.2	75.4	0	0	0	0	118.2
41	S	27.1	Very low	27.6	Very low	94 Å²	94	119.1 Å²	119.1	66%	0.657	75%	0.75	S	S	*	*			cis	-169.6	168.7	-25.2	52.3	0	0	0	0	110.1
42	S	26.1	Very low	27.5	Very low	104 Å²	104	114.7 Å²	114.7	73%	0.727	74%	0.741	S	S	*	*			trans	62.1	148.6	148.2	50	0	0	0	0	120.1
43	S	27.4	Very low	27.5	Very low	97 Å²	97	115.6 Å²	115.6	68%	0.678	74%	0.743	S	S	*	*			cis	-174.3	164.8	-17.8	52.3	0	0	0	0	109.6
44	S	28.2	Very low	27.4	Very low	106 Å²	106	113.1 Å²	113.1	74%	0.741	74%	0.738	S	S	*	*			trans	61.3	146.3	151.5	47.3	0	0	0	0	119.9
45	S	28.7	Very low	27.4	Very low	99 Å²	99	110.9 Å²	110.9	69%	0.692	74%	0.741	S	S	*	*			cis	-172.4	171.9	-10.1	49.7	0	0	0	0	111
46	S	29.1	Very low	27.3	Very low	107 Å²	107	107 Å²	107	75%	0.748	73%	0.729	S	S	*	*			trans	67.6	147.1	159.3	30.9	0	0	0	0	118.5
47	S	29.3	Very low	27.4	Very low	98 Å²	98	108.6 Å²	108.6	69%	0.685	74%	0.74	S	S	*	*			cis	-169.3	151	-5.7	42.7	0	0	0	0	112.3
48	S	29.4	Very low	27.4	Very low	113 Å²	113	107 Å²	107	79%	0.79	74%	0.742	S	S	*	*			trans	60.5	151.5	161.2	46.6	0	0	0	0	118.3
49	S	30	Very low	27.5	Very low	109 Å²	109	105.3 Å²	105.3	76%	0.762	74%	0.741	S	S	*	*			cis	-177.5	156.1	-7.6	45.7	0	0	0	0	108.1
50	S	28.8	Very low	28	Very low	102 Å²	102	107.3 Å²	107.3	71%	0.713	75%	0.751	S	S	*	*			cis	-175.9	169.9	-10.1	50	0	0	0	0	110
51	S	27.9	Very low	28.1	Very low	122 Å²	122	107.5 Å²	107.5	85%	0.853	75%	0.746	S	S	*	*			trans	71.5	146.9	-179.1	78.1	0	0	0	0	115.6
52	S	26.5	Very low	28	Very low	103 Å²	103	111.4 Å²	111.4	72%	0.72	75%	0.754	S	S	*	*			cis	-143.1	169.2	8.9	60.4	0	0	0	0	114.5
53	S	27.7	Very low	28	Very low	99 Å²	99	114.9 Å²	114.9	69%	0.692	76%	0.759	S	S	*	*			trans	62	95.5	159.7	44.7	0	0	0	0	120.8
54	S	26.8	Very low	28.7	Very low	116 Å²	116	115.6 Å²	115.6	81%	0.811	76%	0.761	S	S	*	*				24.8	140.9	127.9	57.8	0	0	0	0	120.9
55	S	28.4	Very low	28.6	Very low	116 Å²	116	119.9 Å²	119.9	81%	0.811	77%	0.766	S	S	*	*			cis	-150.1	168.9	38.1	47.7	0	0	0	0	116.5
56	S	26.5	Very low	28.5	Very low	96 Å²	96	124.3 Å²	124.3	67%	0.671	78%	0.778	S	S	*	*			trans	-65.8	150.6	178.2	50	0	0	0	0	113.5
57	S	26.2	Very low	28.4	Very low	112 Å²	112	126.3 Å²	126.3	78%	0.783	78%	0.781	S	S	*	*			cis	62.3	146.5	49.6	87.5	0	0	0	0	113.4
58	S	24.9	Very low	28.7	Very low	117 Å²	117	126 Å²	126	82%	0.818	78%	0.784	S	S	*	*			cis	-149.7	-176.9	26.8	56	0	0	0	0	113.8
59	S	26.2	Very low	28.6	Very low	110 Å²	110	127.9 Å²	127.9	77%	0.769	78%	0.784	S	S	*	*			trans	-104	164.6	-171.6	53.2	0	0	0	0	115
60	S	36.7	Very low	29	Very low	116 Å²	116	130.1 Å²	130.1	81%	0.811	79%	0.786	S	S	*	*			trans	-65	150.8	-179.4	47.9	0	0	0	0	116.4
61	V	28.6	Very low	29	Very low	122 Å²	122	131.8 Å²	131.8	74%	0.739	79%	0.786	S	S	*	*			trans	-150.8	124	164.1	-178.4	0	0	0	0	111.1
62	H	25.2	Very low	29	Very low	176 Å²	176	130.6 Å²	130.6	82%	0.815	78%	0.775	S	S	*	*			trans	54.3	163.1	161.9	-69.2	-47.1	0	0	0	120
63	E	25	Very low	29.7	Very low	176 Å²	176	132.8 Å²	132.8	82%	0.822	78%	0.783	S	S	*	*			cis	-145.4	169.2	2.4	-132	175.1	172.1	0	0	109.4
64	P	43	Very low	30	Very low	112 Å²	112	133.4 Å²	133.4	73%	0.727	78%	0.783	S	S	*	*			trans	-108.6	174.8	-168.9	40.3	-31.5	0	0	0	116.4
65	K	25.8	Very low	30.3	Very low	196 Å²	196	136 Å²	136	85%	0.852	79%	0.785	S	S	*	*			trans	82.5	111.6	173.1	-64.4	-172.4	173.7	-174.6	0	118.7
66	M	26.9	Very low	30.7	Very low	193 Å²	193	138 Å²	138	95%	0.951	78%	0.781	S	S	*	*				-151.9	151.5	114.5	-96.4	-87.9	177.5	0	0	108
67	D	25.9	Very low	31.3	Very low	148 Å²	148	139.4 Å²	139.4	79%	0.791	79%	0.785	S	S	*	*			trans	-87.5	157.9	-172.2	-76.7	-70.9	0	0	0	114.1
68	A	36.6	Very low	32.1	Very low	91 Å²	91	138.1 Å²	138.1	75%	0.752	77%	0.774	S	S	*	*			trans	46	89.8	153.1	0	0	0	0	0	118.7
69	L	27.7	Very low	33.5	Very low	154 Å²	154	135.3 Å²	135.3	81%	0.806	75%	0.754	S	S	*	*			trans	-111.4	107.7	139.6	-158	80.2	0	0	0	109.5	I71	L69-I71 HydrophobicContact CD2-CG1 4.2Å; L69-I71 PolarHBondContact O-N 3.27Å; L69-I71 VanDerWaalsContact O-N 3.14Å
70	I	38.5	Very low	34.6	Very low	155 Å²	155	134.2 Å²	134.2	80%	0.795	74%	0.74	S	S	*	*			trans	-73.2	102.8	172	-61.1	171.3	0	0	0	107.5
71	I	28.8	Very low	35.1	Very low	138 Å²	138	133.9 Å²	133.9	71%	0.708	74%	0.737	S	S	*	*			trans	-89	117.5	164.3	-59	-179.9	0	0	0	106.8	L69	L69-I71 HydrophobicContact CD2-CG1 4.2Å; L69-I71 PolarHBondContact O-N 3.27Å; L69-I71 VanDerWaalsContact O-N 3.14Å
72	P	27.7	Very low	36.3	Very low	96 Å²	96	137.4 Å²	137.4	62%	0.623	74%	0.737	S	S	*	*			trans	-70.4	143.4	-175.5	28.4	-34.8	0	0	0	111.9	T74	P72-T74 VanDerWaalsContact C-N 3.34Å; P72-T74 PolarHBondContact O-N 2.99Å
73	V	41	Very low	37.8	Very low	149 Å²	149	131.9 Å²	131.9	90%	0.903	73%	0.728	S	S	*	*			trans	-75.5	84.2	173.2	-178.8	0	0	0	0	109.9
74	T	34.6	Very low	39.6	Very low	112 Å²	112	129.7 Å²	129.7	69%	0.687	72%	0.718	S	S	*	*			trans	-160.1	123.9	156.6	46.7	0	0	0	0	110.1	P72	P72-T74 VanDerWaalsContact C-N 3.34Å; P72-T74 PolarHBondContact O-N 2.99Å
75	M	31.7	Very low	40.8	Very low	171 Å²	171	130.8 Å²	130.8	84%	0.842	71%	0.707	S	S	*	*				-167.3	149	91.4	-92.9	-160.3	75.3	0	0	110.7
76	E	37.5	Very low	43.3	Very low	157 Å²	157	123.8 Å²	123.8	73%	0.734	68%	0.679	S	S	*	*			trans	-67.7	147.4	175.4	-56.1	168.2	140.2	0	0	110.3	P78	E76-P78 WeakPolarHBondContact O-CD 3.34Å
77	V	39.2	Very low	45.8	Very low	126 Å²	126	119.4 Å²	119.4	76%	0.764	65%	0.651	S	S	*	*			trans	-88.9	107.5	153.7	176.5	0	0	0	0	106	C79	V77-C79 PolarHBondContact O-N 3.14Å; V77-C79 VanDerWaalsContact O-N 3.1Å; V77-C79 PolarHBondContact O-SG 2.93Å; V77-C79 VanDerWaalsContact O-SG 3.42Å
78	P	42.7	Very low	48.6	Very low	85 Å²	85	119 Å²	119	55%	0.552	64%	0.639	S	S	*	*			trans	-71.5	111.8	-174.7	-16.7	32.3	0	0	0	109.8	E76 D80	E76-P78 WeakPolarHBondContact O-CD 3.34Å; P78-D80 PolarHBondContact O-N 3.22Å
79	C	54.9	Low	51	Low	59 Å²	59	115.7 Å²	115.7	40%	0.399	61%	0.611	S	S	.	*	S	Bend	trans	-76.8	-4.3	179.8	-43.1	0	0	0	0	113.5	V77 C206 R266	V77-C79 PolarHBondContact O-N 3.14Å; V77-C79 VanDerWaalsContact O-N 3.1Å; V77-C79 PolarHBondContact O-SG 2.93Å; V77-C79 VanDerWaalsContact O-SG 3.42Å; C79-C206 HydrophobicContact CB-CB 4.14Å; C79-C206 WeakPolarHBondContact CB-SG 3.46Å; C79-C206 WeakPolarHBondContact SG-CB 3.17Å; C79-C206 CovalentContact SG-SG 2.01Å; C79-C206 PolarHBondContact SG-SG 3.2Å; C79-R266 VanDerWaalsContact CB-NH2 3.34Å; C79-R266 PolarHBondContact O-NH2 3.39Å
80	D	48.2	Very low	53.8	Low	87 Å²	87	108.5 Å²	108.5	47%	0.465	57%	0.573	S	S	.	*	S	Bend	trans	-155.8	157	152.5	-172.5	2.8	0	0	0	106.9	P78 R82 G83	P78-D80 PolarHBondContact O-N 3.22Å; D80-R82 PolarHBondContact O-N 2.72Å; D80-G83 PolarHBondContact O-N 3Å
81	S	47.5	Very low	56.2	Low	108 Å²	108	103.5 Å²	103.5	76%	0.755	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	0.5	173.8	60.1	0	0	0	0	116.8
82	R	53.6	Low	59.2	Low	196 Å²	196	98.9 Å²	98.9	74%	0.74	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.1	2	-175.9	-63.2	-177	177.2	-172.3	-1.1	114.7	D80 Q84	D80-R82 PolarHBondContact O-N 2.72Å; R82-Q84 HydrophobicContact CB-CG 4.48Å; R82-Q84 PolarHBondContact O-N 3.1Å; R82-Q84 VanDerWaalsContact O-N 3.12Å
83	G	57.2	Low	62.3	Low	60 Å²	60	95.5 Å²	95.5	62%	0.619	51%	0.509	S	S	*	.			trans	63.9	15.7	173.7	0	0	0	0	0	116.6	D80	D80-G83 PolarHBondContact O-N 3Å
84	Q	63.7	Low	64.8	Low	130 Å²	130	88.5 Å²	88.5	61%	0.607	47%	0.467	S	S	*	.			trans	-78.7	130.1	-174.6	-68.7	-172.9	-31.3	0	0	112.9	R82 R266	R82-Q84 HydrophobicContact CB-CG 4.48Å; R82-Q84 PolarHBondContact O-N 3.1Å; R82-Q84 VanDerWaalsContact O-N 3.12Å; Q84-R266 PolarHBondContact O-NH1 3.36Å; Q84-R266 VanDerWaalsContact O-NH1 3.12Å
85	R	67.8	Low	67.5	Low	135 Å²	135	86.4 Å²	86.4	51%	0.509	45%	0.45	S	S	.	.			trans	-69.3	135.2	171.2	-65.1	-174.2	-177.3	174.8	0.5	110.5	E204	R85-E204 WeakPolarHBondContact CA-OE2 3.41Å; R85-E204 VanDerWaalsContact CB-OE2 3.31Å; R85-E204 WeakPolarHBondContact CB-OE2 3.37Å
86	M	77.9	Confident	70.5	Confident	50 Å²	50	83.3 Å²	83.3	25%	0.246	44%	0.441	C	S	.	.			trans	-115.3	12.5	-172.9	-68	-67.7	-74.2	0	0	113.7	W88 A89 F90 E204	M86-W88 HydrophobicContact CE-CH2 4.26Å; M86-W88 HydrophobicContact CE-CZ2 3.54Å; M86-W88 PolarHBondContact O-N 2.85Å; M86-W88 HydrophobicContact SD-CZ2 3.82Å; M86-A89 WeakPolarHBondContact O-CB 3.49Å; M86-A89 PolarHBondContact O-N 3.35Å; M86-F90 WeakPolarHBondContact O-CD2 3.37Å; M86-E204 PolarHBondContact N-OE1 3.12Å; M86-E204 PolarHBondContact N-OE2 2.93Å
87	W	79.1	Confident	73.1	Confident	100 Å²	100	78.5 Å²	78.5	38%	0.379	42%	0.422	S	S	.	.	H	α-helix	trans	-42.6	-35	175.4	67.9	-92.2	0	0	0	114.8	A89 F90 L91 W268	W87-A89 VanDerWaalsContact C-N 3.29Å; W87-A89 PolarHBondContact O-N 3.35Å; W87-F90 PolarHBondContact O-N 2.95Å; W87-L91 HydrophobicContact CZ3-CD2 4.06Å; W87-L91 PolarHBondContact O-N 3.24Å; W87-W268 HydrophobicContact CB-CD2 4.42Å; W87-W268 HydrophobicContact CB-CZ2 4.17Å
88	W	84.1	Confident	75.7	Confident	141 Å²	141	73.7 Å²	73.7	53%	0.534	39%	0.391	S	S	.	.	H	α-helix	trans	-62.1	-32.2	-179.3	61.5	-93.3	0	0	0	113.2	M86 F90 L91 A92	M86-W88 HydrophobicContact CE-CH2 4.26Å; M86-W88 HydrophobicContact CE-CZ2 3.54Å; M86-W88 PolarHBondContact O-N 2.85Å; M86-W88 HydrophobicContact SD-CZ2 3.82Å; W88-F90 VanDerWaalsContact C-N 3.35Å; W88-F90 PolarHBondContact O-N 3.17Å; W88-L91 PolarHBondContact O-N 3.44Å; W88-A92 WeakPolarHBondContact O-CB 3.25Å; W88-A92 PolarHBondContact O-N 2.07Å
89	A	86.8	Confident	78.1	Confident	21 Å²	21	74.2 Å²	74.2	17%	0.174	39%	0.385	C	S	.	.	H	α-helix	trans	-67.7	-36.4	179.9	0	0	0	0	0	112	M86 W87 S93 L264	M86-A89 WeakPolarHBondContact O-CB 3.49Å; M86-A89 PolarHBondContact O-N 3.35Å; W87-A89 VanDerWaalsContact C-N 3.29Å; W87-A89 PolarHBondContact O-N 3.35Å; A89-S93 PolarHBondContact O-N 3.04Å; A89-S93 VanDerWaalsContact O-N 3.15Å; A89-L264 HydrophobicContact CB-CD1 4.36Å
90	F	88	Confident	79.9	Confident	2 Å²	2	72.7 Å²	72.7	1%	0.009	38%	0.379	C	S	.	.	H	α-helix	trans	-68.5	-47.4	176	-60	-97	0	0	0	111.4	M86 W87 W88 A92 S93 S94 P257 V260 L264 R266 W268	M86-F90 WeakPolarHBondContact O-CD2 3.37Å; W87-F90 PolarHBondContact O-N 2.95Å; W88-F90 VanDerWaalsContact C-N 3.35Å; W88-F90 PolarHBondContact O-N 3.17Å; F90-A92 VanDerWaalsContact C-N 3.35Å; F90-S93 PolarHBondContact O-N 3.47Å; F90-S93 PolarHBondContact O-OG 2.99Å; F90-S94 PolarHBondContact O-N 3.33Å; F90-P257 HydrophobicContact CB-CB 4.29Å; F90-P257 HydrophobicContact CD1-CB 4.24Å; F90-P257 WeakPolarHBondContact CD1-O 3.28Å; F90-V260 HydrophobicContact CD1-CB 4.1Å; F90-V260 HydrophobicContact CD1-CG1 3.84Å; F90-V260 HydrophobicContact CE1-CB 4.4Å; F90-V260 HydrophobicContact CE1-CG1 3.99Å; F90-V260 HydrophobicContact CG-CG1 4.15Å; F90-V260 HydrophobicContact CZ-CG1 4.41Å; F90-L264 HydrophobicContact CE2-CD1 4.33Å; F90-L264 HydrophobicContact CZ-CD1 4.33Å; F90-R266 HydrophobicContact CZ-CB 4.45Å; F90-R266 WeakPolarHBondContact CZ-O 3.36Å; F90-W268 HydrophobicContact CB-CD2 4.15Å; F90-W268 HydrophobicContact CB-CE3 3.3Å; F90-W268 HydrophobicContact CB-CZ3 3.6Å; F90-W268 HydrophobicContact CD1-CB 4.12Å; F90-W268 HydrophobicContact CD1-CE3 4.32Å; F90-W268 HydrophobicContact CD2-CB 4Å; F90-W268 HydrophobicContact CD2-CD2 4.4Å; F90-W268 HydrophobicContact CD2-CE3 4.33Å; F90-W268 HydrophobicContact CD2-CG 4.32Å; F90-W268 HydrophobicContact CE1-CB 4.04Å; F90-W268 HydrophobicContact CE2-CB 3.94Å; F90-W268 HydrophobicContact CG-CB 4.1Å; F90-W268 HydrophobicContact CG-CD2 4.27Å; F90-W268 AromaticContact CG-CE3 3.77Å; F90-W268 HydrophobicContact CG-CE3 3.77Å; F90-W268 HydrophobicContact CG-CG 4.46Å; F90-W268 HydrophobicContact CZ-CB 3.96Å
91	L	89.1	Confident	81.9	Confident	51 Å²	51	69.1 Å²	69.1	27%	0.267	36%	0.363	S	S	.	.	H	α-helix	trans	-66.2	-38.9	178.2	-176.4	61.6	0	0	0	111.6	W87 W88 S93 S94 M95 W268 L271	W87-L91 HydrophobicContact CZ3-CD2 4.06Å; W87-L91 PolarHBondContact O-N 3.24Å; W88-L91 PolarHBondContact O-N 3.44Å; L91-S93 VanDerWaalsContact C-N 3.33Å; L91-S93 PolarHBondContact O-N 2.88Å; L91-S94 PolarHBondContact O-N 3.19Å; L91-M95 HydrophobicContact CD1-CG 4.44Å; L91-M95 HydrophobicContact CG-CG 4.3Å; L91-M95 WeakPolarHBondContact O-CB 3.39Å; L91-M95 VanDerWaalsContact O-CG 3.24Å; L91-M95 WeakPolarHBondContact O-CG 3.37Å; L91-M95 PolarHBondContact O-N 3.18Å; L91-W268 HydrophobicContact CB-CH2 4.23Å; L91-L271 HydrophobicContact CD1-CD1 3.86Å
92	A	90.1	Very high	84	Confident	41 Å²	41	65.2 Å²	65.2	34%	0.339	33%	0.334	S	S	.	.	H	α-helix	trans	-60.8	-38.7	175.9	0	0	0	0	0	112.3	W88 F90 S94 M95 V96	W88-A92 WeakPolarHBondContact O-CB 3.25Å; W88-A92 PolarHBondContact O-N 2.07Å; F90-A92 VanDerWaalsContact C-N 3.35Å; A92-S94 PolarHBondContact O-N 3.06Å; A92-M95 PolarHBondContact O-N 3.38Å; A92-V96 WeakPolarHBondContact O-CB 3.35Å; A92-V96 VanDerWaalsContact O-CG2 3.26Å; A92-V96 WeakPolarHBondContact O-CG2 3.47Å; A92-V96 PolarHBondContact O-N 2.94Å
93	S	93.1	Very high	85.9	Confident	25 Å²	25	61.8 Å²	61.8	18%	0.175	32%	0.324	C	S	.	.	H	α-helix	trans	-64.1	-42.7	178.8	77.9	0	0	0	0	112.1	A89 F90 L91 T97	A89-S93 PolarHBondContact O-N 3.04Å; A89-S93 VanDerWaalsContact O-N 3.15Å; F90-S93 PolarHBondContact O-N 3.47Å; F90-S93 PolarHBondContact O-OG 2.99Å; L91-S93 VanDerWaalsContact C-N 3.33Å; L91-S93 PolarHBondContact O-N 2.88Å; S93-T97 VanDerWaalsContact O-CB 3.3Å; S93-T97 WeakPolarHBondContact O-CB 2.75Å; S93-T97 PolarHBondContact O-N 2.95Å; S93-T97 PolarHBondContact O-OG1 2.66Å
94	S	93.4	Very high	87.6	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.014	32%	0.324	C	S	.	.	H	α-helix	trans	-65.2	-45.9	173.3	-72.3	0	0	0	0	112.6	F90 L91 A92 V96 T97 F98 F252 P257	F90-S94 PolarHBondContact O-N 3.33Å; L91-S94 PolarHBondContact O-N 3.19Å; A92-S94 PolarHBondContact O-N 3.06Å; S94-V96 PolarHBondContact O-N 3.35Å; S94-T97 PolarHBondContact O-N 3.13Å; S94-F98 WeakPolarHBondContact O-CB 3.39Å; S94-F98 PolarHBondContact O-N 3.25Å; S94-F252 VanDerWaalsContact CB-O 3.23Å; S94-F252 WeakPolarHBondContact CB-O 3.27Å; S94-F252 PolarHBondContact OG-O 2.86Å; S94-P257 WeakPolarHBondContact OG-CD 3.24Å; S94-P257 VanDerWaalsContact OG-CG 3.32Å; S94-P257 WeakPolarHBondContact OG-CG 3.4Å
95	M	92	Very high	88.9	Confident	68 Å²	68	59.3 Å²	59.3	34%	0.335	30%	0.3	S	S	.	.	H	α-helix	trans	-58.6	-48.4	177.7	-73.7	-81.1	108.3	0	0	111.9	L91 A92 F98 F99 F253	L91-M95 HydrophobicContact CD1-CG 4.44Å; L91-M95 HydrophobicContact CG-CG 4.3Å; L91-M95 WeakPolarHBondContact O-CB 3.39Å; L91-M95 VanDerWaalsContact O-CG 3.24Å; L91-M95 WeakPolarHBondContact O-CG 3.37Å; L91-M95 PolarHBondContact O-N 3.18Å; A92-M95 PolarHBondContact O-N 3.38Å; M95-F98 PolarHBondContact O-N 3.24Å; M95-F99 HydrophobicContact CE-CE2 4.24Å; M95-F99 WeakPolarHBondContact O-CB 3.3Å; M95-F99 WeakPolarHBondContact O-CD2 3.33Å; M95-F99 PolarHBondContact O-N 3.1Å; M95-F99 HydrophobicContact SD-CD2 4.28Å; M95-F99 HydrophobicContact SD-CE2 3.81Å; M95-F253 HydrophobicContact CE-CE1 3.5Å; M95-F253 VanDerWaalsContact CE-CE1 3.5Å; M95-F253 HydrophobicContact CE-CZ 3.45Å; M95-F253 VanDerWaalsContact CE-CZ 3.45Å
96	V	93.9	Very high	90	Very high	106 Å²	106	56.2 Å²	56.2	64%	0.642	29%	0.293	S	S	*	.	H	α-helix	trans	-67.3	-38.8	179.3	171.2	0	0	0	0	111.1	A92 S94 G100	A92-V96 WeakPolarHBondContact O-CB 3.35Å; A92-V96 VanDerWaalsContact O-CG2 3.26Å; A92-V96 WeakPolarHBondContact O-CG2 3.47Å; A92-V96 PolarHBondContact O-N 2.94Å; S94-V96 PolarHBondContact O-N 3.35Å; V96-G100 VanDerWaalsContact O-CA 3.26Å; V96-G100 WeakPolarHBondContact O-CA 3.31Å; V96-G100 PolarHBondContact O-N 3.3Å
97	T	92.7	Very high	90.6	Very high	55 Å²	55	58.5 Å²	58.5	34%	0.337	31%	0.305	S	S	.	.	H	α-helix	trans	-62.6	-50.4	175.1	-57.6	0	0	0	0	110.9	S93 S94 G101 F252 P256	S93-T97 VanDerWaalsContact O-CB 3.3Å; S93-T97 WeakPolarHBondContact O-CB 2.75Å; S93-T97 PolarHBondContact O-N 2.95Å; S93-T97 PolarHBondContact O-OG1 2.66Å; S94-T97 PolarHBondContact O-N 3.13Å; T97-G101 PolarHBondContact O-N 2.67Å; T97-G101 VanDerWaalsContact O-N 3.13Å; T97-F252 HydrophobicContact CG2-CD1 3.87Å; T97-F252 HydrophobicContact CG2-CE1 4.33Å; T97-P256 HydrophobicContact CG2-CG 4.27Å
98	F	93.3	Very high	91.1	Very high	26 Å²	26	62 Å²	62	11%	0.114	32%	0.319	C	S	.	.	H	α-helix	trans	-65	-56.9	-177.5	176.9	-110.1	0	0	0	112.5	S94 M95 L102 W243 L244 V249 F252	S94-F98 WeakPolarHBondContact O-CB 3.39Å; S94-F98 PolarHBondContact O-N 3.25Å; M95-F98 PolarHBondContact O-N 3.24Å; F98-L102 VanDerWaalsContact O-CB 3.27Å; F98-L102 WeakPolarHBondContact O-CB 3.24Å; F98-L102 PolarHBondContact O-N 3.33Å; F98-W243 AromaticContact CD2-NE1 3.89Å; F98-W243 PolarHBondContact O-NE1 2.95Å; F98-L244 HydrophobicContact CE2-CD2 4.24Å; F98-L244 HydrophobicContact CZ-CD2 3.95Å; F98-V249 HydrophobicContact CE2-CG2 4.28Å; F98-F252 AromaticContact CD2-CD2 3.62Å; F98-F252 HydrophobicContact CD2-CD2 3.62Å; F98-F252 AromaticContact CD2-CE2 3.98Å; F98-F252 HydrophobicContact CD2-CE2 3.98Å; F98-F252 HydrophobicContact CD2-CG 4.43Å; F98-F252 HydrophobicContact CE2-CD2 4.38Å
99	F	92.9	Very high	91.4	Very high	95 Å²	95	59.7 Å²	59.7	42%	0.417	31%	0.31	S	S	.	.	H	α-helix	trans	-72.1	-37.7	-177.2	-73.5	-66.8	0	0	0	112.3	M95 L102 F103	M95-F99 HydrophobicContact CE-CE2 4.24Å; M95-F99 WeakPolarHBondContact O-CB 3.3Å; M95-F99 WeakPolarHBondContact O-CD2 3.33Å; M95-F99 PolarHBondContact O-N 3.1Å; M95-F99 HydrophobicContact SD-CD2 4.28Å; M95-F99 HydrophobicContact SD-CE2 3.81Å; F99-L102 HydrophobicContact CD1-CD2 4.36Å; F99-L102 PolarHBondContact O-N 3.46Å; F99-F103 HydrophobicContact CB-CD2 4.41Å; F99-F103 HydrophobicContact CB-CE2 4.3Å; F99-F103 WeakPolarHBondContact O-CB 3.32Å; F99-F103 WeakPolarHBondContact O-CD2 3.48Å; F99-F103 PolarHBondContact O-N 3.18Å
100	G	92.8	Very high	91.4	Very high	27 Å²	27	62.6 Å²	62.6	28%	0.278	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-48.6	176.9	0	0	0	0	0	112	V96 F103 I104	V96-G100 VanDerWaalsContact O-CA 3.26Å; V96-G100 WeakPolarHBondContact O-CA 3.31Å; V96-G100 PolarHBondContact O-N 3.3Å; G100-F103 PolarHBondContact O-N 3.26Å; G100-I104 VanDerWaalsContact O-CG1 3.28Å; G100-I104 WeakPolarHBondContact O-CG1 3.49Å; G100-I104 PolarHBondContact O-N 3.37Å
101	G	91.3	Very high	91.4	Very high	13 Å²	13	67.3 Å²	67.3	13%	0.134	35%	0.35	C	S	.	.	H	α-helix	trans	-66.1	-37.3	175.3	0	0	0	0	0	113.4	T97 I104 I105	T97-G101 PolarHBondContact O-N 2.67Å; T97-G101 VanDerWaalsContact O-N 3.13Å; G101-I104 PolarHBondContact O-N 3.07Å; G101-I105 WeakPolarHBondContact O-CG1 3.49Å; G101-I105 PolarHBondContact O-N 3.16Å
102	L	92.3	Very high	91.1	Very high	26 Å²	26	71.3 Å²	71.3	14%	0.136	37%	0.366	C	S	.	.	H	α-helix	trans	-60.7	-47	173.8	-179.1	62.4	0	0	0	111.5	F98 F99 I104 I105 L106 L240 L244	F98-L102 VanDerWaalsContact O-CB 3.27Å; F98-L102 WeakPolarHBondContact O-CB 3.24Å; F98-L102 PolarHBondContact O-N 3.33Å; F99-L102 HydrophobicContact CD1-CD2 4.36Å; F99-L102 PolarHBondContact O-N 3.46Å; L102-I104 PolarHBondContact O-N 3.33Å; L102-I105 PolarHBondContact O-N 2.86Å; L102-L106 HydrophobicContact CD1-CD1 4.34Å; L102-L106 HydrophobicContact CD1-CG 4.49Å; L102-L106 HydrophobicContact CG-CD1 4.17Å; L102-L106 WeakPolarHBondContact O-CG 3.28Å; L102-L106 PolarHBondContact O-N 2.8Å; L102-L240 HydrophobicContact CD1-CD1 3.44Å; L102-L240 VanDerWaalsContact CD1-CD1 3.44Å; L102-L244 HydrophobicContact CD1-CD2 4.25Å
103	F	92.3	Very high	90.7	Very high	124 Å²	124	77.6 Å²	77.6	54%	0.544	38%	0.382	S	S	.	.	H	α-helix	trans	-63.5	-38.9	174.9	-75.9	-57.4	0	0	0	112.2	F99 G100 I105 L106 L107	F99-F103 HydrophobicContact CB-CD2 4.41Å; F99-F103 HydrophobicContact CB-CE2 4.3Å; F99-F103 WeakPolarHBondContact O-CB 3.32Å; F99-F103 WeakPolarHBondContact O-CD2 3.48Å; F99-F103 PolarHBondContact O-N 3.18Å; G100-F103 PolarHBondContact O-N 3.26Å; F103-I105 PolarHBondContact O-N 3.18Å; F103-L106 PolarHBondContact O-N 3.07Å; F103-L107 VanDerWaalsContact O-CB 3.22Å; F103-L107 WeakPolarHBondContact O-CB 3.31Å; F103-L107 WeakPolarHBondContact O-CG 2.93Å; F103-L107 PolarHBondContact O-N 3.26Å
104	I	93	Very high	90.1	Very high	118 Å²	118	81 Å²	81	61%	0.605	40%	0.398	S	S	*	.	H	α-helix	trans	-61.3	-43.9	174.5	-71.3	163.5	0	0	0	111.2	G100 G101 L102 W108	G100-I104 VanDerWaalsContact O-CG1 3.28Å; G100-I104 WeakPolarHBondContact O-CG1 3.49Å; G100-I104 PolarHBondContact O-N 3.37Å; G101-I104 PolarHBondContact O-N 3.07Å; L102-I104 PolarHBondContact O-N 3.33Å; I104-W108 VanDerWaalsContact O-CB 3.23Å; I104-W108 WeakPolarHBondContact O-CB 3.12Å; I104-W108 PolarHBondContact O-N 3.06Å
105	I	90.7	Very high	89.2	Confident	20 Å²	20	89.8 Å²	89.8	10%	0.103	43%	0.43	C	S	.	.	H	α-helix	trans	-65.5	-43.1	178.1	-69.1	166	0	0	0	111.2	G101 L102 F103 R109 L240 W243	G101-I105 WeakPolarHBondContact O-CG1 3.49Å; G101-I105 PolarHBondContact O-N 3.16Å; L102-I105 PolarHBondContact O-N 2.86Å; F103-I105 PolarHBondContact O-N 3.18Å; I105-R109 WeakPolarHBondContact O-CG 3.36Å; I105-R109 PolarHBondContact O-N 3.02Å; I105-L240 HydrophobicContact CG2-CB 3.85Å; I105-L240 HydrophobicContact CG2-CD1 4.04Å; I105-W243 HydrophobicContact CD1-CB 3.92Å; I105-W243 HydrophobicContact CD1-CD2 3.58Å; I105-W243 HydrophobicContact CD1-CE3 3.48Å; I105-W243 VanDerWaalsContact CD1-CE3 3.48Å; I105-W243 HydrophobicContact CD1-CG 3.78Å; I105-W243 HydrophobicContact CD1-CZ3 4.24Å
106	L	90.8	Very high	88.3	Confident	70 Å²	70	90.7 Å²	90.7	37%	0.366	44%	0.44	S	S	.	.	H	α-helix	trans	-65.6	-47.2	177	-69.4	173	0	0	0	111.5	L102 F103 W108 R109 T110 L240	L102-L106 HydrophobicContact CD1-CD1 4.34Å; L102-L106 HydrophobicContact CD1-CG 4.49Å; L102-L106 HydrophobicContact CG-CD1 4.17Å; L102-L106 WeakPolarHBondContact O-CG 3.28Å; L102-L106 PolarHBondContact O-N 2.8Å; F103-L106 PolarHBondContact O-N 3.07Å; L106-W108 PolarHBondContact O-N 2.99Å; L106-R109 WeakPolarHBondContact O-CB 3.31Å; L106-R109 PolarHBondContact O-N 2.91Å; L106-T110 PolarHBondContact O-N 3.37Å; L106-T110 PolarHBondContact O-OG1 3.45Å; L106-L240 HydrophobicContact CD2-CD1 4.15Å; L106-L240 HydrophobicContact CD2-CD2 4.06Å; L106-L240 HydrophobicContact CG-CD1 4.49Å
107	L	90.3	Very high	87.2	Confident	98 Å²	98	90.5 Å²	90.5	51%	0.513	44%	0.439	S	S	.	.	H	α-helix	trans	-60.9	-42.7	176.5	-74.4	169.5	0	0	0	111.7	F103 R109 T110 L111	F103-L107 VanDerWaalsContact O-CB 3.22Å; F103-L107 WeakPolarHBondContact O-CB 3.31Å; F103-L107 WeakPolarHBondContact O-CG 2.93Å; F103-L107 PolarHBondContact O-N 3.26Å; L107-R109 VanDerWaalsContact C-N 3.34Å; L107-R109 PolarHBondContact O-N 3.2Å; L107-T110 WeakPolarHBondContact CA-OG1 3.25Å; L107-T110 PolarHBondContact O-N 3.34Å; L107-T110 PolarHBondContact O-OG1 2.58Å; L107-L111 VanDerWaalsContact O-CB 3.26Å; L107-L111 WeakPolarHBondContact O-CB 3.38Å; L107-L111 WeakPolarHBondContact O-CG 3.31Å; L107-L111 PolarHBondContact O-N 2.66Å
108	W	90.6	Very high	85.9	Confident	173 Å²	173	91.6 Å²	91.6	66%	0.655	45%	0.448	S	S	*	.	H	α-helix	trans	-62.1	-41	175.8	-175.7	-97.5	0	0	0	112	I104 L106 K112	I104-W108 VanDerWaalsContact O-CB 3.23Å; I104-W108 WeakPolarHBondContact O-CB 3.12Å; I104-W108 PolarHBondContact O-N 3.06Å; L106-W108 PolarHBondContact O-N 2.99Å; W108-K112 WeakPolarHBondContact O-CB 3.02Å; W108-K112 PolarHBondContact O-N 3.48Å
109	R	90.3	Very high	84.3	Confident	93 Å²	93	93.8 Å²	93.8	35%	0.351	47%	0.466	S	S	.	.	H	α-helix	trans	-62.3	-51.8	172.3	-77.7	-177.6	169.7	-156.2	-11.4	111.5	I105 L106 L107 L111 K112 Y113 D238	I105-R109 WeakPolarHBondContact O-CG 3.36Å; I105-R109 PolarHBondContact O-N 3.02Å; L106-R109 WeakPolarHBondContact O-CB 3.31Å; L106-R109 PolarHBondContact O-N 2.91Å; L107-R109 VanDerWaalsContact C-N 3.34Å; L107-R109 PolarHBondContact O-N 3.2Å; R109-L111 VanDerWaalsContact C-N 3.32Å; R109-L111 PolarHBondContact O-N 3.33Å; R109-K112 PolarHBondContact O-N 3.33Å; R109-Y113 VanDerWaalsContact O-CD2 3.3Å; R109-Y113 WeakPolarHBondContact O-CD2 3.19Å; R109-Y113 PolarHBondContact O-N 2.96Å; R109-Y113 VanDerWaalsContact O-N 3.08Å; R109-D238 IonicContact CZ-OD1 3.43Å; R109-D238 IonicContact CZ-OD2 3.67Å; R109-D238 IonicContact NH1-OD1 3.17Å; R109-D238 IonicContact NH1-OD2 3.84Å; R109-D238 PolarHBondContact NH1-OD2 3.14Å; R109-D238 IonicContact NH2-OD1 3.82Å; R109-D238 PolarHBondContact NH2-OD1 3.07Å; R109-D238 IonicContact NH2-OD2 2.96Å; R109-D238 PolarHBondContact NH2-OD2 3.12Å
110	T	86.8	Confident	82.4	Confident	82 Å²	82	97.2 Å²	97.2	50%	0.503	48%	0.482	S	S	.	.	H	α-helix	trans	-62.4	-39.4	-179.7	53.1	0	0	0	0	111.9	L106 L107 Y113 L114	L106-T110 PolarHBondContact O-N 3.37Å; L106-T110 PolarHBondContact O-OG1 3.45Å; L107-T110 WeakPolarHBondContact CA-OG1 3.25Å; L107-T110 PolarHBondContact O-N 3.34Å; L107-T110 PolarHBondContact O-OG1 2.58Å; T110-Y113 PolarHBondContact O-N 3.5Å; T110-L114 WeakPolarHBondContact O-CB 3.34Å; T110-L114 PolarHBondContact O-N 3.38Å
111	L	87.6	Confident	80.1	Confident	101 Å²	101	101.6 Å²	101.6	53%	0.529	51%	0.508	S	S	.	.	H	α-helix	trans	-68.1	-38.6	177.1	-71.9	169.2	0	0	0	112.1	L107 R109 W115	L107-L111 VanDerWaalsContact O-CB 3.26Å; L107-L111 WeakPolarHBondContact O-CB 3.38Å; L107-L111 WeakPolarHBondContact O-CG 3.31Å; L107-L111 PolarHBondContact O-N 2.66Å; R109-L111 VanDerWaalsContact C-N 3.32Å; R109-L111 PolarHBondContact O-N 3.33Å; L111-W115 WeakPolarHBondContact O-CB 3.27Å; L111-W115 PolarHBondContact O-N 3.35Å
112	K	83.6	Confident	77.9	Confident	135 Å²	135	104.8 Å²	104.8	59%	0.587	54%	0.541	S	S	*	.	H	α-helix	trans	-58.4	-48.7	172.4	-92.5	-79.4	-175.5	174.5	0	111.9	W108 R109 T116	W108-K112 WeakPolarHBondContact O-CB 3.02Å; W108-K112 PolarHBondContact O-N 3.48Å; R109-K112 PolarHBondContact O-N 3.33Å; K112-T116 PolarHBondContact O-N 3.18Å; K112-T116 PolarHBondContact O-OG1 3.27Å
113	Y	81.3	Confident	75.3	Confident	173 Å²	173	107 Å²	107	68%	0.678	57%	0.57	S	S	*	*	H	α-helix	trans	-70.1	-42.4	178.6	-78.8	-72.2	0	0	0	112.6	R109 T110 W115 T116 V117	R109-Y113 VanDerWaalsContact O-CD2 3.3Å; R109-Y113 WeakPolarHBondContact O-CD2 3.19Å; R109-Y113 PolarHBondContact O-N 2.96Å; R109-Y113 VanDerWaalsContact O-N 3.08Å; T110-Y113 PolarHBondContact O-N 3.5Å; Y113-W115 VanDerWaalsContact C-N 3.33Å; Y113-W115 PolarHBondContact O-N 3.05Å; Y113-T116 WeakPolarHBondContact CA-OG1 3.42Å; Y113-T116 PolarHBondContact O-N 2.75Å; Y113-T116 PolarHBondContact O-OG1 2.65Å; Y113-V117 WeakPolarHBondContact O-CG2 3.22Å; Y113-V117 PolarHBondContact O-N 3.4Å
114	L	79.3	Confident	72.9	Confident	97 Å²	97	110.7 Å²	110.7	51%	0.508	59%	0.586	S	S	.	*	H	α-helix	trans	-63.6	-37.7	177.9	-169.3	71.9	0	0	0	111.6	T110 V117 C118	T110-L114 WeakPolarHBondContact O-CB 3.34Å; T110-L114 PolarHBondContact O-N 3.38Å; L114-V117 PolarHBondContact O-N 3.01Å; L114-C118 VanDerWaalsContact CD1-SG 3.56Å; L114-C118 VanDerWaalsContact O-CB 3.27Å; L114-C118 WeakPolarHBondContact O-CB 3.36Å; L114-C118 PolarHBondContact O-N 3.04Å
115	W	76.1	Confident	70.1	Confident	185 Å²	185	111.4 Å²	111.4	70%	0.701	60%	0.596	S	S	*	*	H	α-helix	trans	-62.7	-44.2	174.2	-170.9	-93.7	0	0	0	111.6	L111 Y113 V117 C119	L111-W115 WeakPolarHBondContact O-CB 3.27Å; L111-W115 PolarHBondContact O-N 3.35Å; Y113-W115 VanDerWaalsContact C-N 3.33Å; Y113-W115 PolarHBondContact O-N 3.05Å; W115-V117 VanDerWaalsContact C-N 3.35Å; W115-V117 PolarHBondContact O-N 3.03Å; W115-C119 HydrophobicContact CD2-CB 4.11Å; W115-C119 HydrophobicContact CE3-CB 4.49Å; W115-C119 VanDerWaalsContact CE3-SG 3.58Å; W115-C119 HydrophobicContact CG-CB 4.41Å; W115-C119 HydrophobicContact CZ2-CB 4.45Å; W115-C119 WeakPolarHBondContact O-CA 3.29Å; W115-C119 WeakPolarHBondContact O-CB 3.29Å; W115-C119 PolarHBondContact O-N 2.61Å
116	T	71.9	Confident	67.7	Low	87 Å²	87	119.8 Å²	119.8	53%	0.534	63%	0.631	S	S	.	*	H	α-helix	trans	-69.2	-28.1	175.7	43.9	0	0	0	0	114.1	K112 Y113 H120	K112-T116 PolarHBondContact O-N 3.18Å; K112-T116 PolarHBondContact O-OG1 3.27Å; Y113-T116 WeakPolarHBondContact CA-OG1 3.42Å; Y113-T116 PolarHBondContact O-N 2.75Å; Y113-T116 PolarHBondContact O-OG1 2.65Å; T116-H120 WeakPolarHBondContact O-CB 3.5Å
117	V	70.6	Confident	65	Low	102 Å²	102	125.9 Å²	125.9	62%	0.618	66%	0.658	S	S	*	*	H	α-helix	trans	-83.4	-45.7	178.2	171	0	0	0	0	111.8	Y113 L114 W115	Y113-V117 WeakPolarHBondContact O-CG2 3.22Å; Y113-V117 PolarHBondContact O-N 3.4Å; L114-V117 PolarHBondContact O-N 3.01Å; W115-V117 VanDerWaalsContact C-N 3.35Å; W115-V117 PolarHBondContact O-N 3.03Å
118	C	65.9	Low	62.3	Low	79 Å²	79	125.6 Å²	125.6	53%	0.534	67%	0.67	S	S	.	*	H	α-helix	trans	-86.3	-38.9	-175.1	-63.5	0	0	0	0	113.3	L114	L114-C118 VanDerWaalsContact CD1-SG 3.56Å; L114-C118 VanDerWaalsContact O-CB 3.27Å; L114-C118 WeakPolarHBondContact O-CB 3.36Å; L114-C118 PolarHBondContact O-N 3.04Å
119	C	59.5	Low	59.5	Low	72 Å²	72	124.9 Å²	124.9	49%	0.486	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94	4.3	-173.4	-54.6	0	0	0	0	114	W115	W115-C119 HydrophobicContact CD2-CB 4.11Å; W115-C119 HydrophobicContact CE3-CB 4.49Å; W115-C119 VanDerWaalsContact CE3-SG 3.58Å; W115-C119 HydrophobicContact CG-CB 4.41Å; W115-C119 HydrophobicContact CZ2-CB 4.45Å; W115-C119 WeakPolarHBondContact O-CA 3.29Å; W115-C119 WeakPolarHBondContact O-CB 3.29Å; W115-C119 PolarHBondContact O-N 2.61Å
120	H	52.9	Low	56.6	Low	166 Å²	166	129 Å²	129	77%	0.769	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	1.2	173.4	-124.7	55.1	0	0	0	114	T116 G122	T116-H120 WeakPolarHBondContact O-CB 3.5Å; H120-G122 VanDerWaalsContact C-N 3.27Å; H120-G122 PolarHBondContact O-N 3.07Å
121	C	45.9	Very low	54.1	Low	120 Å²	120	132.2 Å²	132.2	81%	0.811	71%	0.707	S	S	*	*	S	Bend	trans	-90.5	31.5	-178.5	-158.9	0	0	0	0	113.4
122	G	44.6	Very low	51.2	Low	80 Å²	80	134.7 Å²	134.7	83%	0.825	72%	0.721	S	S	*	*	S	Bend	trans	-145.3	32.2	-163.7	0	0	0	0	0	116.7	H120	H120-G122 VanDerWaalsContact C-N 3.27Å; H120-G122 PolarHBondContact O-N 3.07Å
123	G	37.9	Very low	48.6	Very low	73 Å²	73	135.2 Å²	135.2	75%	0.753	73%	0.73	S	S	*	*			trans	-162	130.2	178.2	0	0	0	0	0	113.7
124	K	42	Very low	46.1	Very low	200 Å²	200	130.4 Å²	130.4	87%	0.87	73%	0.732	S	S	*	*			trans	-66	162.9	-179.9	-53.2	171.3	179.6	172.8	0	111.2
125	T	33	Very low	43.5	Very low	134 Å²	134	131.8 Å²	131.8	82%	0.822	75%	0.751	S	S	*	*			cis	-153.5	167.5	20.5	-31.2	0	0	0	0	111.1
126	K	41.5	Very low	41.3	Very low	195 Å²	195	128.2 Å²	128.2	85%	0.848	75%	0.754	S	S	*	*			trans	-84.3	137.6	168.8	-61.7	179.1	-179.2	179.6	0	111.5
127	E	32.6	Very low	39.2	Very low	199 Å²	199	133.3 Å²	133.3	93%	0.93	77%	0.771	S	S	*	*			trans	-118.3	170.9	136.6	-70.6	-155.5	136.6	0	0	108.9
128	A	33.4	Very low	37.4	Very low	91 Å²	91	133 Å²	133	75%	0.752	78%	0.779	S	S	*	*			trans	-146.6	178.2	-162.6	0	0	0	0	0	113.2
129	Q	32.3	Very low	35.6	Very low	159 Å²	159	137.1 Å²	137.1	74%	0.743	80%	0.796	S	S	*	*			trans	90.4	139.9	-175	-54.6	-172.6	49	0	0	113.6
130	K	29	Very low	34.2	Very low	178 Å²	178	136.7 Å²	136.7	77%	0.774	80%	0.804	S	S	*	*			cis	-151.1	160.3	-3.5	-129.3	166.9	-171.8	153.8	0	113.3
131	I	35.5	Very low	33.1	Very low	150 Å²	150	135 Å²	135	77%	0.769	81%	0.806	S	S	*	*			trans	-73.5	138.7	169.4	-64.2	154	0	0	0	109.7
132	N	26	Very low	32.4	Very low	154 Å²	154	136.4 Å²	136.4	82%	0.824	80%	0.804	S	S	*	*				-153.9	154.2	125.4	-146.8	5.2	0	0	0	114
133	N	28.5	Very low	31.6	Very low	146 Å²	146	142 Å²	142	78%	0.781	81%	0.806	S	S	*	*			trans	-98.3	131.4	176.7	-80.6	-28.4	0	0	0	111.8
134	G	29.3	Very low	31.9	Very low	71 Å²	71	144.1 Å²	144.1	73%	0.732	81%	0.806	S	S	*	*				71.6	178.3	126.4	0	0	0	0	0	121.8
135	S	25.4	Very low	31.2	Very low	127 Å²	127	141 Å²	141	89%	0.888	80%	0.804	S	S	*	*			trans	98.7	135	169	76.9	0	0	0	0	119
136	S	28.5	Very low	31.4	Very low	110 Å²	110	141.9 Å²	141.9	77%	0.769	80%	0.804	S	S	*	*			trans	-61.6	150.7	-174.9	-37.5	0	0	0	0	115.3
137	Q	28.9	Very low	30.8	Very low	193 Å²	193	141.8 Å²	141.8	90%	0.902	81%	0.806	S	S	*	*				-169.7	166.2	101.7	-103.5	177.4	-27.2	0	0	112.6
138	A	32.6	Very low	31	Very low	95 Å²	95	141.8 Å²	141.8	79%	0.785	80%	0.803	S	S	*	*			trans	-69.9	162.7	162.4	0	0	0	0	0	109.2
139	D	27.3	Very low	30.9	Very low	167 Å²	167	146.1 Å²	146.1	89%	0.893	81%	0.808	S	S	*	*				-174.3	175.5	61.3	-174.2	16.8	0	0	0	109.6
140	G	31.6	Very low	30.9	Very low	63 Å²	63	147.4 Å²	147.4	65%	0.649	81%	0.814	S	S	*	*			trans	102.8	99	159.8	0	0	0	0	0	116.8
141	T	29.9	Very low	31.1	Very low	131 Å²	131	145 Å²	145	80%	0.804	81%	0.814	S	S	*	*			trans	-71.2	134.1	160.2	49.5	0	0	0	0	111.7
142	L	29.7	Very low	30.9	Very low	149 Å²	149	144.2 Å²	144.2	78%	0.78	82%	0.815	S	S	*	*				177.5	118.3	110	-113.4	114.4	0	0	0	115.1
143	K	29.5	Very low	31.2	Very low	197 Å²	197	141.3 Å²	141.3	86%	0.857	81%	0.813	S	S	*	*			trans	59.6	158.2	145.8	-75.3	-167.6	174	-174.1	0	121.6
144	P	43.4	Very low	31.8	Very low	117 Å²	117	138.4 Å²	138.4	76%	0.76	81%	0.809	S	S	*	*			trans	-109.3	162.5	-167.2	41.2	-33.3	0	0	0	115
145	V	28.2	Very low	32.3	Very low	136 Å²	136	144.1 Å²	144.1	82%	0.824	82%	0.817	S	S	*	*			trans	-140.4	151.6	152.3	179.5	0	0	0	0	107.1
146	D	35.4	Very low	33.7	Very low	152 Å²	152	143.1 Å²	143.1	81%	0.813	81%	0.805	S	S	*	*			trans	-61.9	131.2	-174.8	-51.1	-99.2	0	0	0	114.5
147	E	30.4	Very low	35.8	Very low	192 Å²	192	139.9 Å²	139.9	90%	0.897	79%	0.789	S	S	*	*			trans	-116.6	134	145.8	-73.1	-163.9	140.2	0	0	108.9	E149	E147-E149 PolarHBondContact O-N 2.69Å
148	K	36.2	Very low	38.3	Very low	199 Å²	199	141 Å²	141	87%	0.865	79%	0.785	S	S	*	*			trans	-84.5	103.5	176.3	-69.2	176.8	179	176.3	0	109.1	E150	K148-E150 PolarHBondContact O-N 2.74Å
149	E	30.9	Very low	40.5	Very low	183 Å²	183	144.1 Å²	144.1	86%	0.855	79%	0.785	S	S	*	*			trans	-69.1	111.4	157.4	-73.8	-165.1	127.5	0	0	108.8	E147 V151	E147-E149 PolarHBondContact O-N 2.69Å; E149-V151 VanDerWaalsContact C-N 3.28Å; E149-V151 PolarHBondContact O-N 3.17Å
150	E	31.9	Very low	43.2	Very low	185 Å²	185	139.1 Å²	139.1	86%	0.864	76%	0.761	S	S	*	*			trans	-67.9	89.4	165.7	-71.9	-169.7	124.8	0	0	109	K148 V152	K148-E150 PolarHBondContact O-N 2.74Å; E150-V152 PolarHBondContact O-N 2.9Å
151	V	33.2	Very low	45.7	Very low	128 Å²	128	139 Å²	139	78%	0.776	75%	0.75	S	S	*	*			trans	-60.7	105.5	168	179.8	0	0	0	0	107.7	E149 A153	E149-V151 VanDerWaalsContact C-N 3.28Å; E149-V151 PolarHBondContact O-N 3.17Å; V151-A153 PolarHBondContact O-N 3.49Å
152	V	31.8	Very low	48.4	Very low	133 Å²	133	135 Å²	135	81%	0.806	73%	0.725	S	S	*	*			trans	-51.8	115.9	-179.9	176.6	0	0	0	0	109.3	E150 A154	E150-V152 PolarHBondContact O-N 2.9Å; V152-A154 VanDerWaalsContact C-N 3.33Å; V152-A154 PolarHBondContact O-N 3.16Å
153	A	33.2	Very low	51.3	Low	93 Å²	93	130.6 Å²	130.6	77%	0.769	70%	0.7	S	S	*	*			trans	-70.5	86.8	-177.2	0	0	0	0	0	110.8	V151 E155	V151-A153 PolarHBondContact O-N 3.49Å; A153-E155 PolarHBondContact O-N 3.34Å
154	A	40	Very low	54	Low	86 Å²	86	125.3 Å²	125.3	71%	0.711	68%	0.681	S	S	*	*			trans	-56.9	127.8	162.4	0	0	0	0	0	108.6	V152 V156	V152-A154 VanDerWaalsContact C-N 3.33Å; V152-A154 PolarHBondContact O-N 3.16Å; A154-V156 PolarHBondContact O-N 3.48Å
155	E	40.5	Very low	56.1	Low	191 Å²	191	126.9 Å²	126.9	89%	0.893	67%	0.672	S	S	*	*			trans	-55.5	123.9	-171.6	-64.3	-176.5	127.9	0	0	111.4	A153 G157	A153-E155 PolarHBondContact O-N 3.34Å; E155-G157 VanDerWaalsContact C-N 3.34Å; E155-G157 PolarHBondContact O-N 3.11Å
156	V	54.8	Low	58.9	Low	106 Å²	106	120.4 Å²	120.4	64%	0.642	63%	0.633	S	S	*	*			trans	-70.9	91	-178	-174.7	0	0	0	0	108.9	A154 T160	A154-V156 PolarHBondContact O-N 3.48Å; V156-T160 VanDerWaalsContact CG1-OG1 3.31Å; V156-T160 WeakPolarHBondContact CG1-OG1 3.47Å
157	G	73.5	Confident	61.3	Low	41 Å²	41	114.4 Å²	114.4	42%	0.423	61%	0.607	S	S	.	*			trans	-58	145.6	-175.2	0	0	0	0	0	112.6	E155 M159 T160 S161	E155-G157 VanDerWaalsContact C-N 3.34Å; E155-G157 PolarHBondContact O-N 3.11Å; G157-M159 PolarHBondContact O-N 3.26Å; G157-T160 PolarHBondContact O-N 2.87Å; G157-T160 PolarHBondContact O-OG1 2.75Å; G157-S161 PolarHBondContact O-N 2.72Å
158	W	81.1	Confident	64	Low	217 Å²	217	108.2 Å²	108.2	82%	0.822	58%	0.582	S	S	*	*	H	α-helix	trans	-43.4	-38.3	-178.5	177.8	-84.7	0	0	0	114.5	T160 S161 V162	W158-T160 PolarHBondContact O-N 2.89Å; W158-S161 PolarHBondContact O-N 3.4Å; W158-V162 HydrophobicContact CD2-CG2 4.42Å; W158-V162 HydrophobicContact CG-CG2 4.46Å; W158-V162 HydrophobicContact CZ2-CG2 4.33Å; W158-V162 WeakPolarHBondContact O-CG2 3.33Å; W158-V162 PolarHBondContact O-N 3Å
159	M	77.1	Confident	66.4	Low	160 Å²	160	100.4 Å²	100.4	79%	0.788	55%	0.549	S	S	*	.	H	α-helix	trans	-61.7	-37.2	179	-164.6	83.4	78.9	0	0	113.6	G157 K163	G157-M159 PolarHBondContact O-N 3.26Å; M159-K163 VanDerWaalsContact O-CB 3.29Å; M159-K163 WeakPolarHBondContact O-CB 3.49Å; M159-K163 PolarHBondContact O-N 3.03Å
160	T	84.1	Confident	69	Low	63 Å²	63	93.4 Å²	93.4	39%	0.387	52%	0.517	S	S	.	.	H	α-helix	trans	-74.3	-45.3	175.7	46.1	0	0	0	0	110.5	V156 G157 W158 V162 K163 D164	V156-T160 VanDerWaalsContact CG1-OG1 3.31Å; V156-T160 WeakPolarHBondContact CG1-OG1 3.47Å; G157-T160 PolarHBondContact O-N 2.87Å; G157-T160 PolarHBondContact O-OG1 2.75Å; W158-T160 PolarHBondContact O-N 2.89Å; T160-V162 VanDerWaalsContact C-N 3.31Å; T160-V162 PolarHBondContact O-N 3.29Å; T160-K163 WeakPolarHBondContact O-CB 3.19Å; T160-K163 PolarHBondContact O-N 3.31Å; T160-D164 WeakPolarHBondContact O-CB 3.45Å; T160-D164 PolarHBondContact O-N 3.1Å
161	S	84.2	Confident	71.2	Confident	60 Å²	60	86.3 Å²	86.3	42%	0.42	49%	0.488	S	S	.	.	H	α-helix	trans	-56.8	-41.3	177.8	-49.8	0	0	0	0	113.2	G157 W158 W165	G157-S161 PolarHBondContact O-N 2.72Å; W158-S161 PolarHBondContact O-N 3.4Å; S161-W165 WeakPolarHBondContact O-CB 3.49Å; S161-W165 PolarHBondContact O-N 3.2Å
162	V	88.4	Confident	73.4	Confident	47 Å²	47	80.4 Å²	80.4	29%	0.285	45%	0.453	S	S	.	.	H	α-helix	trans	-71	-37.4	175.8	170.1	0	0	0	0	112.3	W158 T160 A166 I234	W158-V162 HydrophobicContact CD2-CG2 4.42Å; W158-V162 HydrophobicContact CG-CG2 4.46Å; W158-V162 HydrophobicContact CZ2-CG2 4.33Å; W158-V162 WeakPolarHBondContact O-CG2 3.33Å; W158-V162 PolarHBondContact O-N 3Å; T160-V162 VanDerWaalsContact C-N 3.31Å; T160-V162 PolarHBondContact O-N 3.29Å; V162-A166 WeakPolarHBondContact O-CB 3.29Å; V162-A166 PolarHBondContact O-N 2.75Å; V162-I234 HydrophobicContact CG1-CG2 3.95Å
163	K	89.1	Confident	75.8	Confident	57 Å²	57	80.7 Å²	80.7	25%	0.248	45%	0.445	C	S	.	.	H	α-helix	trans	-64	-44.6	174.9	176.2	-169.1	171.5	-129.5	0	111.5	M159 T160 A166 G167 A235 N237	M159-K163 VanDerWaalsContact O-CB 3.29Å; M159-K163 WeakPolarHBondContact O-CB 3.49Å; M159-K163 PolarHBondContact O-N 3.03Å; T160-K163 WeakPolarHBondContact O-CB 3.19Å; T160-K163 PolarHBondContact O-N 3.31Å; K163-A166 PolarHBondContact O-N 3.35Å; K163-G167 PolarHBondContact O-N 3.43Å; K163-A235 WeakPolarHBondContact CE-O 3.4Å; K163-N237 WeakPolarHBondContact CE-OD1 3.28Å; K163-N237 PolarHBondContact NZ-OD1 2.96Å
164	D	86.6	Confident	78.4	Confident	85 Å²	85	78.3 Å²	78.3	46%	0.455	42%	0.421	S	S	.	.	H	α-helix	trans	-71.4	-38.6	-176.8	-60.3	-25.9	0	0	0	110.7	T160 G167 V168	T160-D164 WeakPolarHBondContact O-CB 3.45Å; T160-D164 PolarHBondContact O-N 3.1Å; D164-G167 PolarHBondContact O-N 3.31Å; D164-V168 WeakPolarHBondContact O-CB 3.35Å; D164-V168 WeakPolarHBondContact O-CG2 3.37Å; D164-V168 PolarHBondContact O-N 3.46Å
165	W	87.9	Confident	80.5	Confident	150 Å²	150	80.9 Å²	80.9	57%	0.568	42%	0.422	S	S	*	.	H	α-helix	trans	-56.6	-48.3	168.3	173.9	83.7	0	0	0	112.3	S161 G167 V168 M169 L231	S161-W165 WeakPolarHBondContact O-CB 3.49Å; S161-W165 PolarHBondContact O-N 3.2Å; W165-G167 VanDerWaalsContact C-N 3.35Å; W165-G167 PolarHBondContact O-N 3.48Å; W165-V168 PolarHBondContact O-N 2.78Å; W165-M169 HydrophobicContact CD2-SD 4.26Å; W165-M169 HydrophobicContact CE3-SD 4.46Å; W165-M169 HydrophobicContact CH2-SD 3.61Å; W165-M169 HydrophobicContact CZ2-SD 3.33Å; W165-M169 WeakPolarHBondContact CZ2-SD 3.32Å; W165-M169 HydrophobicContact CZ3-SD 4.17Å; W165-M169 PolarHBondContact O-N 2.97Å; W165-M169 VanDerWaalsContact O-N 3.09Å; W165-L231 HydrophobicContact CH2-CD2 4.27Å; W165-L231 HydrophobicContact CZ3-CD2 3.86Å
166	A	86.9	Confident	82.8	Confident	0 Å²	0	76.1 Å²	76.1	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-63.5	-40.2	176.5	0	0	0	0	0	111.8	V162 K163 V168 M169 I170 I234 A235	V162-A166 WeakPolarHBondContact O-CB 3.29Å; V162-A166 PolarHBondContact O-N 2.75Å; K163-A166 PolarHBondContact O-N 3.35Å; A166-V168 PolarHBondContact O-N 3.14Å; A166-M169 PolarHBondContact O-N 3.34Å; A166-I170 WeakPolarHBondContact O-CG1 3.27Å; A166-I170 PolarHBondContact O-N 2.97Å; A166-I234 HydrophobicContact CB-CB 4.2Å; A166-I234 HydrophobicContact CB-CG2 3.69Å; A166-A235 HydrophobicContact CB-CB 4.02Å
167	G	85.5	Confident	84.4	Confident	27 Å²	27	71.1 Å²	71.1	28%	0.278	38%	0.376	S	S	.	.	H	α-helix	trans	-59.5	-43.2	174.8	0	0	0	0	0	113	K163 D164 W165 M169 I170 S171	K163-G167 PolarHBondContact O-N 3.43Å; D164-G167 PolarHBondContact O-N 3.31Å; W165-G167 VanDerWaalsContact C-N 3.35Å; W165-G167 PolarHBondContact O-N 3.48Å; G167-M169 VanDerWaalsContact C-N 3.29Å; G167-M169 PolarHBondContact O-N 3.37Å; G167-I170 PolarHBondContact O-N 3.25Å; G167-S171 VanDerWaalsContact O-CB 3.28Å; G167-S171 WeakPolarHBondContact O-CB 3.33Å; G167-S171 PolarHBondContact O-N 2.97Å; G167-S171 PolarHBondContact O-OG 3.3Å
168	V	86.9	Confident	84.9	Confident	62 Å²	62	74.2 Å²	74.2	38%	0.376	38%	0.375	S	S	.	.	H	α-helix	trans	-70.2	-21.9	177.1	170.2	0	0	0	0	113.1	D164 W165 A166 T174	D164-V168 WeakPolarHBondContact O-CB 3.35Å; D164-V168 WeakPolarHBondContact O-CG2 3.37Å; D164-V168 PolarHBondContact O-N 3.46Å; W165-V168 PolarHBondContact O-N 2.78Å; A166-V168 PolarHBondContact O-N 3.14Å; V168-T174 HydrophobicContact CG1-CG2 3.51Å; V168-T174 PolarHBondContact O-OG1 3.18Å; V168-T174 VanDerWaalsContact O-OG1 3.13Å
169	M	86.8	Confident	85.3	Confident	35 Å²	35	67.7 Å²	67.7	17%	0.172	36%	0.359	C	S	.	.	H	α-helix	trans	-78.9	-40	168.6	-73.7	-169.3	64.4	0	0	112.9	W165 A166 G167 G177 L180 L231	W165-M169 HydrophobicContact CD2-SD 4.26Å; W165-M169 HydrophobicContact CE3-SD 4.46Å; W165-M169 HydrophobicContact CH2-SD 3.61Å; W165-M169 HydrophobicContact CZ2-SD 3.33Å; W165-M169 WeakPolarHBondContact CZ2-SD 3.32Å; W165-M169 HydrophobicContact CZ3-SD 4.17Å; W165-M169 PolarHBondContact O-N 2.97Å; W165-M169 VanDerWaalsContact O-N 3.09Å; A166-M169 PolarHBondContact O-N 3.34Å; G167-M169 VanDerWaalsContact C-N 3.29Å; G167-M169 PolarHBondContact O-N 3.37Å; M169-G177 WeakPolarHBondContact O-CA 3.16Å; M169-L180 HydrophobicContact CE-CD2 4.24Å; M169-L231 HydrophobicContact CE-CD1 4.37Å
170	I	85.5	Confident	85.9	Confident	35 Å²	35	61 Å²	61	18%	0.179	33%	0.327	C	S	.	.	H	α-helix	trans	-73.3	-35.1	179.2	-62.7	-60.4	0	0	0	111.9	A166 G167 A172 L180 Y228 L231 R232 A235	A166-I170 WeakPolarHBondContact O-CG1 3.27Å; A166-I170 PolarHBondContact O-N 2.97Å; G167-I170 PolarHBondContact O-N 3.25Å; I170-A172 PolarHBondContact O-N 2.88Å; I170-A172 VanDerWaalsContact O-N 3.08Å; I170-L180 HydrophobicContact CD1-CD2 4.27Å; I170-Y228 HydrophobicContact CD1-CD2 4.01Å; I170-Y228 HydrophobicContact CD1-CE2 3.43Å; I170-Y228 VanDerWaalsContact CD1-CE2 3.43Å; I170-L231 HydrophobicContact CD1-CB 4.1Å; I170-R232 HydrophobicContact CD1-CG 3.79Å; I170-R232 HydrophobicContact CG1-CG 4.36Å; I170-A235 HydrophobicContact CG1-CB 4.49Å
171	S	78.9	Confident	86	Confident	37 Å²	37	58.2 Å²	58.2	26%	0.259	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	2.1	-173.4	69.1	0	0	0	0	116.2	G167 Q173	G167-S171 VanDerWaalsContact O-CB 3.28Å; G167-S171 WeakPolarHBondContact O-CB 3.33Å; G167-S171 PolarHBondContact O-N 2.97Å; G167-S171 PolarHBondContact O-OG 3.3Å; S171-Q173 PolarHBondContact O-N 3.5Å; S171-Q173 VanDerWaalsContact OG-CG 3.3Å; S171-Q173 WeakPolarHBondContact OG-CG 3.45Å; S171-Q173 PolarHBondContact OG-OE1 3.16Å
172	A	78.1	Confident	86.2	Confident	3 Å²	3	58.5 Å²	58.5	3%	0.025	31%	0.308	C	S	.	.	S	Bend	trans	53.6	17	-177.3	0	0	0	0	0	115.6	I170 T174 R178 V181 F288	I170-A172 PolarHBondContact O-N 2.88Å; I170-A172 VanDerWaalsContact O-N 3.08Å; A172-T174 VanDerWaalsContact C-N 3.34Å; A172-R178 HydrophobicContact CB-CG 4.02Å; A172-R178 WeakPolarHBondContact O-CG 3.27Å; A172-R178 PolarHBondContact O-NE 3.13Å; A172-V181 HydrophobicContact CB-CG2 4.36Å; A172-F288 HydrophobicContact CB-CB 3.78Å; A172-F288 HydrophobicContact CB-CD2 4.45Å; A172-F288 HydrophobicContact CB-CG 4.17Å
173	Q	82.4	Confident	86.3	Confident	139 Å²	139	59.9 Å²	59.9	65%	0.65	31%	0.314	S	S	*	.			trans	-69.1	-35.8	175.7	-70.9	169.3	-7	0	0	111.2	S171	S171-Q173 PolarHBondContact O-N 3.5Å; S171-Q173 VanDerWaalsContact OG-CG 3.3Å; S171-Q173 WeakPolarHBondContact OG-CG 3.45Å; S171-Q173 PolarHBondContact OG-OE1 3.16Å
174	T	87.5	Confident	86.3	Confident	44 Å²	44	57.4 Å²	57.4	27%	0.27	30%	0.303	S	S	.	.	S	Bend	trans	-90	154.4	176.7	52.7	0	0	0	0	112.4	V168 A172 T176 G177 R178	V168-T174 HydrophobicContact CG1-CG2 3.51Å; V168-T174 PolarHBondContact O-OG1 3.18Å; V168-T174 VanDerWaalsContact O-OG1 3.13Å; A172-T174 VanDerWaalsContact C-N 3.34Å; T174-T176 VanDerWaalsContact C-N 3.29Å; T174-T176 PolarHBondContact O-N 2.97Å; T174-T176 PolarHBondContact OG1-OG1 3.31Å; T174-G177 PolarHBondContact O-N 3.18Å; T174-G177 PolarHBondContact OG1-N 2.95Å; T174-G177 VanDerWaalsContact OG1-N 3.09Å; T174-R178 WeakPolarHBondContact O-CG 3.33Å; T174-R178 PolarHBondContact O-N 3.34Å
175	L	85.6	Confident	86.3	Confident	139 Å²	139	55.8 Å²	55.8	73%	0.728	29%	0.292	S	S	*	.	H	α-helix	trans	-59.1	-41.5	173.1	179.3	61.9	0	0	0	111.6	R178 V179	L175-R178 PolarHBondContact O-N 3.23Å; L175-V179 WeakPolarHBondContact O-CG2 3.39Å; L175-V179 PolarHBondContact O-N 2.85Å
176	T	88.2	Confident	86.4	Confident	92 Å²	92	51.2 Å²	51.2	56%	0.564	29%	0.286	S	S	*	.	H	α-helix	trans	-62.2	-41.4	174.7	43.9	0	0	0	0	112.1	T174 V179 L180	T174-T176 VanDerWaalsContact C-N 3.29Å; T174-T176 PolarHBondContact O-N 2.97Å; T174-T176 PolarHBondContact OG1-OG1 3.31Å; T176-V179 PolarHBondContact O-N 2.92Å; T176-L180 WeakPolarHBondContact O-CB 3.4Å; T176-L180 PolarHBondContact O-N 3.35Å
177	G	87.3	Confident	86.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63	-40	173	0	0	0	0	0	113.4	M169 T174 L180 V181	M169-G177 WeakPolarHBondContact O-CA 3.16Å; T174-G177 PolarHBondContact O-N 3.18Å; T174-G177 PolarHBondContact OG1-N 2.95Å; T174-G177 VanDerWaalsContact OG1-N 3.09Å; G177-L180 WeakPolarHBondContact O-CB 3.46Å; G177-L180 PolarHBondContact O-N 2.85Å; G177-V181 WeakPolarHBondContact O-CB 3.35Å; G177-V181 WeakPolarHBondContact O-CG2 3.49Å; G177-V181 PolarHBondContact O-N 3Å
178	R	85.6	Confident	86.9	Confident	106 Å²	106	52 Å²	52	40%	0.4	29%	0.285	S	S	.	.	H	α-helix	trans	-63.3	-43.5	174	-68.6	175.6	-170.6	-173.4	2.8	112.2	A172 T174 L175 V181 V182 L289	A172-R178 HydrophobicContact CB-CG 4.02Å; A172-R178 WeakPolarHBondContact O-CG 3.27Å; A172-R178 PolarHBondContact O-NE 3.13Å; T174-R178 WeakPolarHBondContact O-CG 3.33Å; T174-R178 PolarHBondContact O-N 3.34Å; L175-R178 PolarHBondContact O-N 3.23Å; R178-V181 PolarHBondContact O-N 3.1Å; R178-V182 WeakPolarHBondContact O-CG2 3.45Å; R178-V182 PolarHBondContact O-N 3.12Å; R178-L289 HydrophobicContact CB-CD2 4.36Å
179	V	89	Confident	87.2	Confident	80 Å²	80	52.3 Å²	52.3	49%	0.485	28%	0.284	S	S	.	.	H	α-helix	trans	-62	-44.2	175.3	171.8	0	0	0	0	110.8	L175 T176 V181 V182 L183	L175-V179 WeakPolarHBondContact O-CG2 3.39Å; L175-V179 PolarHBondContact O-N 2.85Å; T176-V179 PolarHBondContact O-N 2.92Å; V179-V181 PolarHBondContact O-N 3.42Å; V179-V182 PolarHBondContact O-N 3.08Å; V179-L183 HydrophobicContact CG1-CD1 3.93Å; V179-L183 HydrophobicContact CG1-CG 4.45Å; V179-L183 WeakPolarHBondContact O-CB 3.37Å; V179-L183 VanDerWaalsContact O-CG 3.29Å; V179-L183 WeakPolarHBondContact O-CG 3.38Å; V179-L183 PolarHBondContact O-N 3.24Å
180	L	90.1	Very high	87.5	Confident	21 Å²	21	51.6 Å²	51.6	11%	0.11	29%	0.285	C	S	.	.	H	α-helix	trans	-57.3	-49.2	174.7	178.6	66.5	0	0	0	111.5	M169 I170 T176 G177 L183 V184 F224 Y228 L231	M169-L180 HydrophobicContact CE-CD2 4.24Å; I170-L180 HydrophobicContact CD1-CD2 4.27Å; T176-L180 WeakPolarHBondContact O-CB 3.4Å; T176-L180 PolarHBondContact O-N 3.35Å; G177-L180 WeakPolarHBondContact O-CB 3.46Å; G177-L180 PolarHBondContact O-N 2.85Å; L180-L183 PolarHBondContact O-N 3.02Å; L180-V184 HydrophobicContact CD1-CG2 4.47Å; L180-V184 VanDerWaalsContact O-CG2 3.25Å; L180-V184 WeakPolarHBondContact O-CG2 3.25Å; L180-V184 PolarHBondContact O-N 3.15Å; L180-F224 HydrophobicContact CD1-CE2 4.33Å; L180-F224 HydrophobicContact CD1-CZ 3.92Å; L180-Y228 HydrophobicContact CD1-CD2 4.23Å; L180-Y228 HydrophobicContact CD2-CD2 4.19Å; L180-Y228 HydrophobicContact CD2-CE2 4.29Å; L180-Y228 HydrophobicContact CG-CD2 4.22Å; L180-Y228 HydrophobicContact CG-CE2 4.36Å; L180-L231 HydrophobicContact CD2-CD1 3.93Å
181	V	86.4	Confident	87.8	Confident	4 Å²	4	50 Å²	50	2%	0.024	28%	0.277	C	S	.	.	H	α-helix	trans	-63.8	-40.5	-179.8	164.1	0	0	0	0	112.4	A172 G177 R178 V179 V184 F185 I285	A172-V181 HydrophobicContact CB-CG2 4.36Å; G177-V181 WeakPolarHBondContact O-CB 3.35Å; G177-V181 WeakPolarHBondContact O-CG2 3.49Å; G177-V181 PolarHBondContact O-N 3Å; R178-V181 PolarHBondContact O-N 3.1Å; V179-V181 PolarHBondContact O-N 3.42Å; V181-V184 PolarHBondContact O-N 3.41Å; V181-F185 PolarHBondContact O-N 2.9Å; V181-F185 VanDerWaalsContact O-N 3.09Å; V181-I285 HydrophobicContact CG1-CB 4.29Å; V181-I285 HydrophobicContact CG1-CG1 4.03Å; V181-I285 HydrophobicContact CG1-CG2 3.79Å
182	V	87.4	Confident	88.4	Confident	65 Å²	65	48.7 Å²	48.7	39%	0.394	27%	0.267	S	S	.	.	H	α-helix	trans	-64.3	-40.9	173.7	170.9	0	0	0	0	111.6	R178 V179 F185 A186 L289	R178-V182 WeakPolarHBondContact O-CG2 3.45Å; R178-V182 PolarHBondContact O-N 3.12Å; V179-V182 PolarHBondContact O-N 3.08Å; V182-F185 PolarHBondContact O-N 2.92Å; V182-A186 WeakPolarHBondContact O-CB 3.28Å; V182-A186 PolarHBondContact O-N 3.4Å; V182-L289 HydrophobicContact CG2-CD1 3.8Å; V182-L289 HydrophobicContact CG2-CD2 3.77Å; V182-L289 HydrophobicContact CG2-CG 4.43Å
183	L	90.1	Very high	89.2	Confident	77 Å²	77	51.9 Å²	51.9	40%	0.403	29%	0.286	S	S	.	.	H	α-helix	trans	-65.6	-45.1	176.6	-72.4	170.3	0	0	0	111.6	V179 L180 F185 A186 L187 F224	V179-L183 HydrophobicContact CG1-CD1 3.93Å; V179-L183 HydrophobicContact CG1-CG 4.45Å; V179-L183 WeakPolarHBondContact O-CB 3.37Å; V179-L183 VanDerWaalsContact O-CG 3.29Å; V179-L183 WeakPolarHBondContact O-CG 3.38Å; V179-L183 PolarHBondContact O-N 3.24Å; L180-L183 PolarHBondContact O-N 3.02Å; L183-F185 VanDerWaalsContact C-N 3.26Å; L183-F185 PolarHBondContact O-N 2.8Å; L183-A186 PolarHBondContact O-N 3Å; L183-L187 HydrophobicContact CB-CD1 4.35Å; L183-L187 VanDerWaalsContact O-CB 3.23Å; L183-L187 WeakPolarHBondContact O-CB 3.49Å; L183-L187 WeakPolarHBondContact O-CD1 3.29Å; L183-L187 WeakPolarHBondContact O-CG 3.38Å; L183-L187 PolarHBondContact O-N 3.02Å; L183-F224 HydrophobicContact CB-CE2 4.26Å; L183-F224 HydrophobicContact CB-CZ 3.76Å
184	V	89.1	Confident	89.7	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.024	26%	0.259	C	S	.	.	H	α-helix	trans	-54.6	-43.6	174.4	170.2	0	0	0	0	111.2	L180 V181 S188 F224 Y228	L180-V184 HydrophobicContact CD1-CG2 4.47Å; L180-V184 VanDerWaalsContact O-CG2 3.25Å; L180-V184 WeakPolarHBondContact O-CG2 3.25Å; L180-V184 PolarHBondContact O-N 3.15Å; V181-V184 PolarHBondContact O-N 3.41Å; V184-S188 VanDerWaalsContact O-CB 3.23Å; V184-S188 WeakPolarHBondContact O-CB 3.03Å; V184-S188 PolarHBondContact O-N 2.95Å; V184-S188 PolarHBondContact O-OG 3.33Å; V184-F224 HydrophobicContact CB-CE1 4.4Å; V184-F224 HydrophobicContact CG2-CE1 3.64Å; V184-F224 HydrophobicContact CG2-CZ 3.99Å; V184-Y228 HydrophobicContact CB-CE1 4.44Å; V184-Y228 HydrophobicContact CG1-CD1 4.06Å; V184-Y228 HydrophobicContact CG1-CE1 3.66Å; V184-Y228 HydrophobicContact CG2-CD1 3.81Å; V184-Y228 HydrophobicContact CG2-CD2 3.49Å; V184-Y228 VanDerWaalsContact CG2-CD2 3.49Å; V184-Y228 HydrophobicContact CG2-CE1 3.88Å; V184-Y228 HydrophobicContact CG2-CE2 3.57Å; V184-Y228 HydrophobicContact CG2-CG 3.61Å
185	F	86.6	Confident	89.9	Confident	51 Å²	51	43.9 Å²	43.9	22%	0.224	25%	0.246	C	C	.	.	H	α-helix	trans	-65.3	-54.7	177.4	179.6	-113	0	0	0	112.6	V181 V182 L183 L187 S188 I189 F282 I285	V181-F185 PolarHBondContact O-N 2.9Å; V181-F185 VanDerWaalsContact O-N 3.09Å; V182-F185 PolarHBondContact O-N 2.92Å; L183-F185 VanDerWaalsContact C-N 3.26Å; L183-F185 PolarHBondContact O-N 2.8Å; F185-L187 VanDerWaalsContact C-N 3.35Å; F185-L187 PolarHBondContact O-N 2.91Å; F185-S188 PolarHBondContact O-N 3.13Å; F185-S188 VanDerWaalsContact O-N 3.13Å; F185-I189 HydrophobicContact CE1-CD1 3.78Å; F185-I189 HydrophobicContact CE2-CD1 3.84Å; F185-I189 HydrophobicContact CE2-CG1 4.39Å; F185-I189 HydrophobicContact CZ-CD1 3.39Å; F185-I189 HydrophobicContact CZ-CG1 4.38Å; F185-I189 PolarHBondContact O-N 3.48Å; F185-I189 VanDerWaalsContact O-N 3.09Å; F185-F282 HydrophobicContact CD2-CD2 4.08Å; F185-F282 HydrophobicContact CE1-CD2 4.25Å; F185-F282 AromaticContact CE1-CE2 3.99Å; F185-F282 HydrophobicContact CE1-CE2 3.99Å; F185-F282 HydrophobicContact CE2-CB 4.16Å; F185-F282 AromaticContact CE2-CD2 3.19Å; F185-F282 HydrophobicContact CE2-CD2 3.19Å; F185-F282 AromaticContact CE2-CE2 3.71Å; F185-F282 HydrophobicContact CE2-CE2 3.71Å; F185-F282 AromaticContact CE2-CG 3.9Å; F185-F282 HydrophobicContact CE2-CG 3.9Å; F185-F282 AromaticContact CZ-CD2 3.29Å; F185-F282 HydrophobicContact CZ-CD2 3.29Å; F185-F282 AromaticContact CZ-CE2 3.23Å; F185-F282 HydrophobicContact CZ-CE2 3.23Å; F185-F282 HydrophobicContact CZ-CG 4.25Å; F185-F282 HydrophobicContact CZ-CZ 4.16Å; F185-I285 HydrophobicContact CB-CD1 4.2Å; F185-I285 HydrophobicContact CB-CG2 4.18Å; F185-I285 HydrophobicContact CD2-CD1 4.27Å; F185-I285 HydrophobicContact CG-CG2 4.35Å
186	A	90.5	Very high	90.3	Very high	54 Å²	54	39.4 Å²	39.4	45%	0.446	22%	0.221	S	C	.	.	H	α-helix	trans	-61.1	-42.3	-177.5	0	0	0	0	0	112.3	V182 L183 S188 I189 G190	V182-A186 WeakPolarHBondContact O-CB 3.28Å; V182-A186 PolarHBondContact O-N 3.4Å; L183-A186 PolarHBondContact O-N 3Å; A186-S188 VanDerWaalsContact C-N 3.35Å; A186-I189 PolarHBondContact O-N 3.01Å; A186-G190 PolarHBondContact O-N 3.18Å
187	L	92.7	Very high	90.4	Very high	34 Å²	34	39.1 Å²	39.1	18%	0.178	22%	0.215	C	C	.	.	H	α-helix	trans	-70.9	-29.8	177.5	-61.9	170.1	0	0	0	111.8	L183 F185 G190 A191 F221 F224 F225	L183-L187 HydrophobicContact CB-CD1 4.35Å; L183-L187 VanDerWaalsContact O-CB 3.23Å; L183-L187 WeakPolarHBondContact O-CB 3.49Å; L183-L187 WeakPolarHBondContact O-CD1 3.29Å; L183-L187 WeakPolarHBondContact O-CG 3.38Å; L183-L187 PolarHBondContact O-N 3.02Å; F185-L187 VanDerWaalsContact C-N 3.35Å; F185-L187 PolarHBondContact O-N 2.91Å; L187-G190 PolarHBondContact O-N 3.3Å; L187-A191 WeakPolarHBondContact O-CB 3.35Å; L187-A191 PolarHBondContact O-N 3.45Å; L187-F221 HydrophobicContact CD2-CD1 3.6Å; L187-F221 HydrophobicContact CD2-CE1 3.4Å; L187-F221 HydrophobicContact CD2-CG 4.36Å; L187-F221 HydrophobicContact CD2-CZ 4.01Å; L187-F224 HydrophobicContact CD1-CB 4.32Å; L187-F224 HydrophobicContact CD1-CD1 3.45Å; L187-F224 VanDerWaalsContact CD1-CD1 3.45Å; L187-F224 HydrophobicContact CD1-CD2 3.99Å; L187-F224 HydrophobicContact CD1-CE1 3.62Å; L187-F224 HydrophobicContact CD1-CE2 4.12Å; L187-F224 HydrophobicContact CD1-CG 3.65Å; L187-F224 HydrophobicContact CD1-CZ 3.95Å; L187-F225 HydrophobicContact CB-CE1 4.35Å; L187-F225 HydrophobicContact CB-CZ 3.99Å
188	S	90.8	Very high	90.5	Very high	10 Å²	10	39.6 Å²	39.6	7%	0.07	22%	0.217	C	C	.	.	H	α-helix	trans	-68.5	-39.8	174.5	-65.9	0	0	0	0	112	V184 F185 A186 L192 F225 R278	V184-S188 VanDerWaalsContact O-CB 3.23Å; V184-S188 WeakPolarHBondContact O-CB 3.03Å; V184-S188 PolarHBondContact O-N 2.95Å; V184-S188 PolarHBondContact O-OG 3.33Å; F185-S188 PolarHBondContact O-N 3.13Å; F185-S188 VanDerWaalsContact O-N 3.13Å; A186-S188 VanDerWaalsContact C-N 3.35Å; S188-L192 PolarHBondContact O-N 3.29Å; S188-L192 VanDerWaalsContact O-N 3.11Å; S188-F225 WeakPolarHBondContact OG-CE1 3.42Å; S188-R278 WeakPolarHBondContact OG-CD 3.42Å
189	I	92	Very high	90.7	Very high	69 Å²	69	35 Å²	35	35%	0.354	20%	0.202	S	C	.	.	H	α-helix	trans	-63.7	-45.4	169.6	-67.7	178.4	0	0	0	110.1	F185 A186 A191 L192 V193 L279	F185-I189 HydrophobicContact CE1-CD1 3.78Å; F185-I189 HydrophobicContact CE2-CD1 3.84Å; F185-I189 HydrophobicContact CE2-CG1 4.39Å; F185-I189 HydrophobicContact CZ-CD1 3.39Å; F185-I189 HydrophobicContact CZ-CG1 4.38Å; F185-I189 PolarHBondContact O-N 3.48Å; F185-I189 VanDerWaalsContact O-N 3.09Å; A186-I189 PolarHBondContact O-N 3.01Å; I189-A191 PolarHBondContact O-N 3.03Å; I189-L192 PolarHBondContact O-N 3.29Å; I189-L192 VanDerWaalsContact O-N 3.12Å; I189-V193 HydrophobicContact CG2-CG2 4.31Å; I189-V193 WeakPolarHBondContact O-CG2 3.45Å; I189-V193 PolarHBondContact O-N 2.85Å; I189-L279 HydrophobicContact CG1-CD2 4.39Å
190	G	93.1	Very high	90.6	Very high	20 Å²	20	35.9 Å²	35.9	21%	0.206	21%	0.211	C	C	.	.	H	α-helix	trans	-55.8	-46.1	176.1	0	0	0	0	0	113.1	A186 L187 L192 V193 I194	A186-G190 PolarHBondContact O-N 3.18Å; L187-G190 PolarHBondContact O-N 3.3Å; G190-L192 VanDerWaalsContact C-N 3.29Å; G190-L192 PolarHBondContact O-N 3.32Å; G190-V193 PolarHBondContact O-N 3.28Å; G190-I194 WeakPolarHBondContact O-CG1 3.3Å; G190-I194 PolarHBondContact O-N 3.13Å
191	A	91.7	Very high	90.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67.7	-26.5	178.2	0	0	0	0	0	113.4	L187 I189 Y195 F221 F225 R275	L187-A191 WeakPolarHBondContact O-CB 3.35Å; L187-A191 PolarHBondContact O-N 3.45Å; I189-A191 PolarHBondContact O-N 3.03Å; A191-Y195 PolarHBondContact O-N 2.92Å; A191-F221 HydrophobicContact CB-CD2 4.07Å; A191-F225 HydrophobicContact CB-CE2 3.89Å; A191-F225 HydrophobicContact CB-CZ 4.3Å; A191-R275 VanDerWaalsContact O-CD 3.24Å; A191-R275 WeakPolarHBondContact O-CD 3.17Å; A191-R275 PolarHBondContact O-NH1 3.24Å
192	L	93.3	Very high	89.9	Confident	10 Å²	10	42.4 Å²	42.4	5%	0.052	25%	0.251	C	S	.	.	H	α-helix	trans	-77.2	-38.7	171.8	-179.1	61.5	0	0	0	111.8	S188 I189 G190 I194 Y195 F196 R275 A276 L279	S188-L192 PolarHBondContact O-N 3.29Å; S188-L192 VanDerWaalsContact O-N 3.11Å; I189-L192 PolarHBondContact O-N 3.29Å; I189-L192 VanDerWaalsContact O-N 3.12Å; G190-L192 VanDerWaalsContact C-N 3.29Å; G190-L192 PolarHBondContact O-N 3.32Å; L192-I194 VanDerWaalsContact C-N 3.34Å; L192-Y195 HydrophobicContact CD1-CD1 4.09Å; L192-Y195 WeakPolarHBondContact O-CB 3.45Å; L192-Y195 PolarHBondContact O-N 3.38Å; L192-Y195 VanDerWaalsContact O-N 3.14Å; L192-F196 HydrophobicContact CD1-CE1 3.79Å; L192-F196 HydrophobicContact CD1-CE2 4.45Å; L192-F196 HydrophobicContact CD1-CZ 3.76Å; L192-F196 HydrophobicContact CD2-CE2 4.29Å; L192-F196 HydrophobicContact CD2-CZ 3.96Å; L192-F196 HydrophobicContact CG-CE1 4.12Å; L192-F196 HydrophobicContact CG-CE2 3.87Å; L192-F196 HydrophobicContact CG-CZ 3.61Å; L192-F196 WeakPolarHBondContact O-CG 3.5Å; L192-F196 PolarHBondContact O-N 3.45Å; L192-R275 HydrophobicContact CD1-CB 4.5Å; L192-A276 HydrophobicContact CD1-CB 3.9Å; L192-A276 HydrophobicContact CD2-CB 4.41Å; L192-L279 HydrophobicContact CD2-CD1 3.96Å; L192-L279 HydrophobicContact CD2-CD2 4.46Å; L192-L279 HydrophobicContact CD2-CG 4.3Å
193	V	93.6	Very high	89.5	Confident	71 Å²	71	41.2 Å²	41.2	43%	0.43	24%	0.242	S	C	.	.	H	α-helix	trans	-64	-39.3	173	171.6	0	0	0	0	111.2	I189 G190 Y195 F196 I197	I189-V193 HydrophobicContact CG2-CG2 4.31Å; I189-V193 WeakPolarHBondContact O-CG2 3.45Å; I189-V193 PolarHBondContact O-N 2.85Å; G190-V193 PolarHBondContact O-N 3.28Å; V193-Y195 VanDerWaalsContact C-N 3.31Å; V193-Y195 PolarHBondContact O-N 3Å; V193-F196 PolarHBondContact O-N 3.34Å; V193-F196 VanDerWaalsContact O-N 3.14Å; V193-I197 HydrophobicContact CG1-CD1 4.26Å; V193-I197 WeakPolarHBondContact O-CG1 3.45Å; V193-I197 PolarHBondContact O-N 3.2Å
194	I	92.3	Very high	89	Confident	13 Å²	13	39.4 Å²	39.4	7%	0.067	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-43.1	170.9	-69.5	169.8	0	0	0	110.8	G190 L192 F196 I197 D198 I217 D218 F221	G190-I194 WeakPolarHBondContact O-CG1 3.3Å; G190-I194 PolarHBondContact O-N 3.13Å; L192-I194 VanDerWaalsContact C-N 3.34Å; I194-F196 VanDerWaalsContact C-N 3.33Å; I194-F196 PolarHBondContact O-N 3.42Å; I194-I197 PolarHBondContact O-N 3.4Å; I194-D198 WeakPolarHBondContact O-CB 3.2Å; I194-D198 PolarHBondContact O-N 3.26Å; I194-I217 HydrophobicContact CD1-CB 4.27Å; I194-I217 HydrophobicContact CD1-CG2 3.76Å; I194-D218 HydrophobicContact CD1-CB 4.25Å; I194-D218 HydrophobicContact CG2-CB 4.25Å; I194-F221 HydrophobicContact CD1-CD2 3.75Å; I194-F221 HydrophobicContact CD1-CE2 3.59Å
195	Y	92.6	Very high	88.6	Confident	1 Å²	1	40.6 Å²	40.6	0%	0.004	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-38.2	174.1	166.4	-103.6	0	0	0	112.7	A191 L192 V193 I197 D198 S199 L269 R272 F273 Y339	A191-Y195 PolarHBondContact O-N 2.92Å; L192-Y195 HydrophobicContact CD1-CD1 4.09Å; L192-Y195 WeakPolarHBondContact O-CB 3.45Å; L192-Y195 PolarHBondContact O-N 3.38Å; L192-Y195 VanDerWaalsContact O-N 3.14Å; V193-Y195 VanDerWaalsContact C-N 3.31Å; V193-Y195 PolarHBondContact O-N 3Å; Y195-I197 VanDerWaalsContact C-N 3.33Å; Y195-I197 PolarHBondContact O-N 3.29Å; Y195-D198 PolarHBondContact O-N 3.33Å; Y195-S199 VanDerWaalsContact O-CB 3.27Å; Y195-S199 WeakPolarHBondContact O-CB 3.37Å; Y195-S199 PolarHBondContact O-N 2.81Å; Y195-S199 PolarHBondContact O-OG 3.37Å; Y195-L269 HydrophobicContact CD2-CD1 3.76Å; Y195-L269 HydrophobicContact CE2-CD1 3.63Å; Y195-L269 HydrophobicContact CE2-CD2 4.47Å; Y195-L269 HydrophobicContact CE2-CG 4.01Å; Y195-R272 HydrophobicContact CD2-CB 3.53Å; Y195-R272 HydrophobicContact CE2-CB 4.22Å; Y195-R272 HydrophobicContact CG-CB 4.27Å; Y195-F273 HydrophobicContact CE1-CB 3.85Å; Y195-F273 HydrophobicContact CE2-CB 4Å; Y195-Y339 HydrophobicContact CE1-CD2 4.03Å; Y195-Y339 AromaticContact CE1-CE2 3.69Å; Y195-Y339 HydrophobicContact CE1-CE2 3.69Å; Y195-Y339 AromaticContact CE1-CZ 4Å; Y195-Y339 VanDerWaalsContact OH-CD2 3.3Å; Y195-Y339 WeakPolarHBondContact OH-CD2 3.38Å; Y195-Y339 WeakPolarHBondContact OH-CE2 3.47Å
196	F	93.7	Very high	88.2	Confident	45 Å²	45	40.9 Å²	40.9	20%	0.197	25%	0.248	C	C	.	.	H	α-helix	trans	-67	-31.9	175.4	-61.4	-28.6	0	0	0	113	L192 V193 I194 S199 L312 Y339 W340	L192-F196 HydrophobicContact CD1-CE1 3.79Å; L192-F196 HydrophobicContact CD1-CE2 4.45Å; L192-F196 HydrophobicContact CD1-CZ 3.76Å; L192-F196 HydrophobicContact CD2-CE2 4.29Å; L192-F196 HydrophobicContact CD2-CZ 3.96Å; L192-F196 HydrophobicContact CG-CE1 4.12Å; L192-F196 HydrophobicContact CG-CE2 3.87Å; L192-F196 HydrophobicContact CG-CZ 3.61Å; L192-F196 WeakPolarHBondContact O-CG 3.5Å; L192-F196 PolarHBondContact O-N 3.45Å; V193-F196 PolarHBondContact O-N 3.34Å; V193-F196 VanDerWaalsContact O-N 3.14Å; I194-F196 VanDerWaalsContact C-N 3.33Å; I194-F196 PolarHBondContact O-N 3.42Å; F196-S199 PolarHBondContact O-OG 2.96Å; F196-L312 HydrophobicContact CZ-CD1 4.38Å; F196-Y339 HydrophobicContact CD1-CD1 4.01Å; F196-Y339 AromaticContact CD1-CE1 3.62Å; F196-Y339 HydrophobicContact CD1-CE1 3.62Å; F196-Y339 HydrophobicContact CE1-CD1 4.22Å; F196-Y339 AromaticContact CE1-CE1 3.37Å; F196-Y339 HydrophobicContact CE1-CE1 3.37Å; F196-Y339 AromaticContact CE1-CZ 3.74Å; F196-Y339 HydrophobicContact CZ-CE1 4.34Å; F196-W340 HydrophobicContact CB-CZ2 4.13Å; F196-W340 HydrophobicContact CD1-CH2 4.18Å; F196-W340 HydrophobicContact CD1-CZ2 4.35Å; F196-W340 HydrophobicContact CD2-CH2 4.06Å; F196-W340 HydrophobicContact CD2-CZ2 4.33Å; F196-W340 HydrophobicContact CE1-CH2 4.33Å; F196-W340 HydrophobicContact CE2-CH2 4.2Å; F196-W340 HydrophobicContact CG-CH2 4.06Å; F196-W340 HydrophobicContact CG-CZ2 4.04Å; F196-W340 HydrophobicContact CZ-CH2 4.32Å
197	I	90.5	Very high	87.4	Confident	87 Å²	87	39.5 Å²	39.5	45%	0.446	23%	0.232	S	C	.	.	H	α-helix	trans	-70	-52.7	171.2	-64.1	164.3	0	0	0	109.7	V193 I194 Y195 S199 S200 T214	V193-I197 HydrophobicContact CG1-CD1 4.26Å; V193-I197 WeakPolarHBondContact O-CG1 3.45Å; V193-I197 PolarHBondContact O-N 3.2Å; I194-I197 PolarHBondContact O-N 3.4Å; Y195-I197 VanDerWaalsContact C-N 3.33Å; Y195-I197 PolarHBondContact O-N 3.29Å; I197-S199 PolarHBondContact O-N 2.98Å; I197-S200 PolarHBondContact O-N 3.41Å; I197-S200 VanDerWaalsContact O-N 3.14Å; I197-S200 PolarHBondContact O-OG 2.81Å; I197-T214 HydrophobicContact CG2-CG2 4.38Å
198	D	88.9	Confident	86.7	Confident	9 Å²	9	41.6 Å²	41.6	5%	0.048	24%	0.243	C	C	.	.	H	α-helix	trans	-57.1	-32.7	179	-75	-18.9	0	0	0	112.8	I194 Y195 S200 N201 L269 R272	I194-D198 WeakPolarHBondContact O-CB 3.2Å; I194-D198 PolarHBondContact O-N 3.26Å; Y195-D198 PolarHBondContact O-N 3.33Å; D198-S200 PolarHBondContact O-N 2.88Å; D198-S200 VanDerWaalsContact O-N 3.15Å; D198-N201 WeakPolarHBondContact O-CB 3.35Å; D198-N201 PolarHBondContact O-N 2.76Å; D198-L269 HydrophobicContact CB-CD1 3.75Å; D198-R272 IonicContact OD2-CZ 2.73Å; D198-R272 IonicContact OD2-NE 3.88Å; D198-R272 IonicContact OD2-NH1 3.98Å; D198-R272 PolarHBondContact OD2-NH1 3.01Å
199	S	89.6	Confident	86.1	Confident	10 Å²	10	43.3 Å²	43.3	7%	0.07	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-11.3	-179.2	73.5	0	0	0	0	114.7	Y195 F196 I197 Y339	Y195-S199 VanDerWaalsContact O-CB 3.27Å; Y195-S199 WeakPolarHBondContact O-CB 3.37Å; Y195-S199 PolarHBondContact O-N 2.81Å; Y195-S199 PolarHBondContact O-OG 3.37Å; F196-S199 PolarHBondContact O-OG 2.96Å; I197-S199 PolarHBondContact O-N 2.98Å; S199-Y339 WeakPolarHBondContact OG-CB 3.25Å
200	S	86.8	Confident	85.3	Confident	98 Å²	98	49.3 Å²	49.3	69%	0.685	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-12.7	170.4	68	0	0	0	0	113.6	I197 D198	I197-S200 PolarHBondContact O-N 3.41Å; I197-S200 VanDerWaalsContact O-N 3.14Å; I197-S200 PolarHBondContact O-OG 2.81Å; D198-S200 PolarHBondContact O-N 2.88Å; D198-S200 VanDerWaalsContact O-N 3.15Å
201	N	83.3	Confident	84.6	Confident	69 Å²	69	57.1 Å²	57.1	37%	0.369	30%	0.298	S	S	.	.	S	Bend	trans	-89.6	156.6	176.9	-67.3	-54.2	0	0	0	111.4	D198	D198-N201 WeakPolarHBondContact O-CB 3.35Å; D198-N201 PolarHBondContact O-N 2.76Å
202	P	79.1	Confident	84.2	Confident	94 Å²	94	58.5 Å²	58.5	61%	0.61	31%	0.305	S	S	*	.			trans	-59.4	147.7	171.5	25.1	-34.6	0	0	0	112.1	E204	P202-E204 PolarHBondContact O-N 2.86Å
203	I	79	Confident	83.8	Confident	39 Å²	39	65 Å²	65	20%	0.2	33%	0.333	C	S	.	.	S	Bend	trans	-48.7	-37.5	-170	-69.6	160.4	0	0	0	114.3	W268 L269 N323	I203-W268 WeakPolarHBondContact O-CA 3.32Å; I203-L269 PolarHBondContact O-N 3.11Å; I203-N323 VanDerWaalsContact CD1-C 3.4Å; I203-N323 HydrophobicContact CD1-CB 3.62Å; I203-N323 WeakPolarHBondContact CD1-O 3.17Å; I203-N323 HydrophobicContact CG1-CB 4.25Å
204	E	79.9	Confident	83.5	Confident	40 Å²	40	63.4 Å²	63.4	19%	0.187	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	122.6	178.9	-169.8	175	162.7	0	0	108.3	R85 M86 P202 R266 S267	R85-E204 WeakPolarHBondContact CA-OE2 3.41Å; R85-E204 VanDerWaalsContact CB-OE2 3.31Å; R85-E204 WeakPolarHBondContact CB-OE2 3.37Å; M86-E204 PolarHBondContact N-OE1 3.12Å; M86-E204 PolarHBondContact N-OE2 2.93Å; P202-E204 PolarHBondContact O-N 2.86Å; E204-R266 HydrophobicContact CG-CG 4.15Å; E204-R266 WeakPolarHBondContact OE1-CD 3.5Å; E204-R266 IonicContact OE1-CZ 2.71Å; E204-R266 IonicContact OE1-NE 3.92Å; E204-R266 IonicContact OE1-NH1 3.96Å; E204-R266 PolarHBondContact OE1-NH1 2.89Å; E204-S267 WeakPolarHBondContact CA-O 3.48Å
205	S	80	Confident	83.2	Confident	28 Å²	28	63 Å²	63	20%	0.196	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	155.7	-175.5	70	0	0	0	0	111	R266 S267	S205-R266 CarbonylContact O-C 3.57Å; S205-R266 WeakPolarHBondContact O-CG 3.45Å; S205-S267 PolarHBondContact N-O 2.91Å; S205-S267 PolarHBondContact O-N 3.16Å
206	C	78.4	Confident	82.9	Confident	57 Å²	57	66 Å²	66	39%	0.385	34%	0.335	S	S	.	.			trans	-108.7	107.7	-172.6	-61.7	0	0	0	0	111	C79	C79-C206 HydrophobicContact CB-CB 4.14Å; C79-C206 WeakPolarHBondContact CB-SG 3.46Å; C79-C206 WeakPolarHBondContact SG-CB 3.17Å; C79-C206 CovalentContact SG-SG 2.01Å; C79-C206 PolarHBondContact SG-SG 3.2Å
207	Q	73.3	Confident	82.8	Confident	26 Å²	26	66.6 Å²	66.6	12%	0.121	34%	0.34	C	S	.	.			trans	-117.7	108.3	-173.7	-75	173	-46.5	0	0	108.2	F209 D212 N265 S267	Q207-F209 PolarHBondContact O-N 3.28Å; Q207-D212 HydrophobicContact CB-CB 3.99Å; Q207-D212 HydrophobicContact CG-CB 4.31Å; Q207-D212 VanDerWaalsContact NE2-CG 3.28Å; Q207-D212 PolarHBondContact NE2-OD1 2.99Å; Q207-N265 PolarHBondContact N-O 3.44Å; Q207-N265 CarbonylContact O-C 3.48Å; Q207-S267 PolarHBondContact OE1-OG 3.25Å
208	N	79.1	Confident	82.8	Confident	77 Å²	77	62.5 Å²	62.5	41%	0.412	32%	0.319	S	S	.	.			trans	-66.7	120.9	173.6	172.8	88.1	0	0	0	109.5	Y210 K211 D212	N208-Y210 PolarHBondContact ND2-N 2.9Å; N208-Y210 PolarHBondContact O-N 3.29Å; N208-K211 PolarHBondContact O-N 3.35Å; N208-D212 PolarHBondContact O-N 3.29Å
209	F	78.2	Confident	82.8	Confident	47 Å²	47	64.1 Å²	64.1	21%	0.206	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-39.4	-169.4	179.4	-105.3	0	0	0	114.3	Q207 K211 L215 Q216 M219 V262 N265	Q207-F209 PolarHBondContact O-N 3.28Å; F209-K211 VanDerWaalsContact C-N 3.27Å; F209-K211 PolarHBondContact O-N 3.5Å; F209-L215 HydrophobicContact CD2-CD2 4.1Å; F209-L215 HydrophobicContact CD2-CG 4.1Å; F209-Q216 HydrophobicContact CD2-CG 4.47Å; F209-Q216 HydrophobicContact CE1-CG 4.47Å; F209-Q216 HydrophobicContact CE2-CG 4.05Å; F209-Q216 HydrophobicContact CZ-CG 4.05Å; F209-Q216 PolarHBondContact O-NE2 3.02Å; F209-M219 HydrophobicContact CE2-CB 4.16Å; F209-M219 HydrophobicContact CE2-CG 4.26Å; F209-M219 HydrophobicContact CZ-CG 4.46Å; F209-V262 HydrophobicContact CD2-CB 4.42Å; F209-V262 HydrophobicContact CD2-CG1 3.89Å; F209-V262 HydrophobicContact CD2-CG2 3.8Å; F209-V262 HydrophobicContact CE2-CG1 4.19Å; F209-V262 HydrophobicContact CE2-CG2 3.87Å; F209-V262 HydrophobicContact CG-CG1 4.15Å; F209-N265 PolarHBondContact N-OD1 3.12Å
210	Y	75.1	Confident	82.9	Confident	194 Å²	194	66.5 Å²	66.5	76%	0.761	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-10.4	179.9	-61	-78.3	0	0	0	115.3	N208	N208-Y210 PolarHBondContact ND2-N 2.9Å; N208-Y210 PolarHBondContact O-N 3.29Å
211	K	78.3	Confident	83.3	Confident	185 Å²	185	63.7 Å²	63.7	80%	0.804	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	-28.1	179.3	-73.3	-172.8	175.1	-175.9	0	113.3	N208 F209	N208-K211 PolarHBondContact O-N 3.35Å; F209-K211 VanDerWaalsContact C-N 3.27Å; F209-K211 PolarHBondContact O-N 3.5Å
212	D	82.8	Confident	83.7	Confident	29 Å²	29	60.4 Å²	60.4	16%	0.155	31%	0.305	C	S	.	.			trans	-95	110	-175.7	-165.5	82.5	0	0	0	111.9	Q207 N208 T214 L215 Q216	Q207-D212 HydrophobicContact CB-CB 3.99Å; Q207-D212 HydrophobicContact CG-CB 4.31Å; Q207-D212 VanDerWaalsContact NE2-CG 3.28Å; Q207-D212 PolarHBondContact NE2-OD1 2.99Å; N208-D212 PolarHBondContact O-N 3.29Å; D212-T214 VanDerWaalsContact CG-OG1 3.31Å; D212-T214 PolarHBondContact OD1-OG1 2.84Å; D212-T214 WeakPolarHBondContact OD2-CB 3.24Å; D212-T214 PolarHBondContact OD2-N 3.44Å; D212-T214 PolarHBondContact OD2-OG1 3.49Å; D212-L215 HydrophobicContact CB-CB 4.22Å; D212-L215 WeakPolarHBondContact OD2-CB 3.34Å; D212-L215 PolarHBondContact OD2-N 2.72Å; D212-Q216 WeakPolarHBondContact O-CG 3.36Å; D212-Q216 PolarHBondContact O-N 3.2Å
213	F	85.9	Confident	84.4	Confident	147 Å²	147	58.8 Å²	58.8	65%	0.645	29%	0.293	S	S	*	.	H	α-helix	trans	-73.9	-30.1	-177	-164.4	-119.9	0	0	0	112.4	Q216 I217	F213-Q216 PolarHBondContact O-N 2.87Å; F213-I217 HydrophobicContact CD1-CD1 3.81Å; F213-I217 HydrophobicContact CE1-CD1 3.61Å; F213-I217 HydrophobicContact CE1-CG1 4.4Å; F213-I217 HydrophobicContact CZ-CD1 4.18Å; F213-I217 WeakPolarHBondContact O-CG1 2.95Å; F213-I217 PolarHBondContact O-N 3.08Å
214	T	86.8	Confident	85.1	Confident	37 Å²	37	59 Å²	59	23%	0.227	29%	0.293	C	S	.	.	H	α-helix	trans	-60.6	-48.8	174.1	14.6	0	0	0	0	111.8	I197 D212 Q216 I217 D218	I197-T214 HydrophobicContact CG2-CG2 4.38Å; D212-T214 VanDerWaalsContact CG-OG1 3.31Å; D212-T214 PolarHBondContact OD1-OG1 2.84Å; D212-T214 WeakPolarHBondContact OD2-CB 3.24Å; D212-T214 PolarHBondContact OD2-N 3.44Å; D212-T214 PolarHBondContact OD2-OG1 3.49Å; T214-Q216 VanDerWaalsContact C-N 3.33Å; T214-Q216 PolarHBondContact O-N 3.06Å; T214-I217 PolarHBondContact O-N 2.87Å; T214-D218 WeakPolarHBondContact O-CB 3.4Å; T214-D218 PolarHBondContact O-N 3.32Å
215	L	85	Confident	85.8	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.016	29%	0.285	C	S	.	.	H	α-helix	trans	-65.9	-32.7	176.9	-174.8	60.9	0	0	0	112.6	F209 D212 M219 V262	F209-L215 HydrophobicContact CD2-CD2 4.1Å; F209-L215 HydrophobicContact CD2-CG 4.1Å; D212-L215 HydrophobicContact CB-CB 4.22Å; D212-L215 WeakPolarHBondContact OD2-CB 3.34Å; D212-L215 PolarHBondContact OD2-N 2.72Å; L215-M219 VanDerWaalsContact O-CB 3.22Å; L215-M219 WeakPolarHBondContact O-CB 3.35Å; L215-M219 PolarHBondContact O-N 3.11Å; L215-V262 HydrophobicContact CD1-CG2 4.34Å; L215-V262 HydrophobicContact CG-CG2 4.36Å
216	Q	88	Confident	86.4	Confident	64 Å²	64	60 Å²	60	30%	0.299	30%	0.296	S	S	.	.	H	α-helix	trans	-65.9	-44.9	174.5	-70.8	170.2	22.9	0	0	112.2	F209 D212 F213 T214 A220	F209-Q216 HydrophobicContact CD2-CG 4.47Å; F209-Q216 HydrophobicContact CE1-CG 4.47Å; F209-Q216 HydrophobicContact CE2-CG 4.05Å; F209-Q216 HydrophobicContact CZ-CG 4.05Å; F209-Q216 PolarHBondContact O-NE2 3.02Å; D212-Q216 WeakPolarHBondContact O-CG 3.36Å; D212-Q216 PolarHBondContact O-N 3.2Å; F213-Q216 PolarHBondContact O-N 2.87Å; T214-Q216 VanDerWaalsContact C-N 3.33Å; T214-Q216 PolarHBondContact O-N 3.06Å; Q216-A220 PolarHBondContact O-N 2.93Å; Q216-A220 VanDerWaalsContact O-N 3.16Å
217	I	90.6	Very high	87.1	Confident	59 Å²	59	62.9 Å²	62.9	30%	0.303	31%	0.307	S	S	.	.	H	α-helix	trans	-67.2	-43.5	175.6	-63.9	172.1	0	0	0	110.4	I194 F213 T214 M219 A220 F221	I194-I217 HydrophobicContact CD1-CB 4.27Å; I194-I217 HydrophobicContact CD1-CG2 3.76Å; F213-I217 HydrophobicContact CD1-CD1 3.81Å; F213-I217 HydrophobicContact CE1-CD1 3.61Å; F213-I217 HydrophobicContact CE1-CG1 4.4Å; F213-I217 HydrophobicContact CZ-CD1 4.18Å; F213-I217 WeakPolarHBondContact O-CG1 2.95Å; F213-I217 PolarHBondContact O-N 3.08Å; T214-I217 PolarHBondContact O-N 2.87Å; I217-M219 VanDerWaalsContact C-N 3.32Å; I217-M219 PolarHBondContact O-N 3.43Å; I217-A220 WeakPolarHBondContact O-CB 3.43Å; I217-A220 PolarHBondContact O-N 2.95Å; I217-A220 VanDerWaalsContact O-N 3.13Å; I217-F221 HydrophobicContact CG2-CD1 4.07Å; I217-F221 HydrophobicContact CG2-CD2 4.15Å; I217-F221 HydrophobicContact CG2-CE1 3.54Å; I217-F221 HydrophobicContact CG2-CE2 3.63Å; I217-F221 HydrophobicContact CG2-CG 4.37Å; I217-F221 HydrophobicContact CG2-CZ 3.31Å; I217-F221 WeakPolarHBondContact O-CD1 3.38Å; I217-F221 WeakPolarHBondContact O-CG 3.23Å; I217-F221 PolarHBondContact O-N 3.12Å
218	D	90.2	Very high	87.9	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.7	-39.8	179.5	-160.7	41.8	0	0	0	111.7	I194 T214 A220 F221 N222 V258 R272 R275	I194-D218 HydrophobicContact CD1-CB 4.25Å; I194-D218 HydrophobicContact CG2-CB 4.25Å; T214-D218 WeakPolarHBondContact O-CB 3.4Å; T214-D218 PolarHBondContact O-N 3.32Å; D218-A220 PolarHBondContact O-N 3.49Å; D218-F221 PolarHBondContact O-N 3.5Å; D218-N222 WeakPolarHBondContact O-CB 3.14Å; D218-N222 PolarHBondContact O-N 3.39Å; D218-N222 PolarHBondContact O-ND2 3.09Å; D218-N222 PolarHBondContact OD1-ND2 3.37Å; D218-V258 WeakPolarHBondContact OD2-CG2 3.44Å; D218-R272 IonicContact OD2-CZ 2.77Å; D218-R272 IonicContact OD2-NH1 3.76Å; D218-R272 PolarHBondContact OD2-NH1 3.31Å; D218-R275 VanDerWaalsContact CG-NH2 3.28Å; D218-R275 IonicContact OD1-CZ 2.96Å; D218-R275 IonicContact OD1-NH1 3.45Å; D218-R275 PolarHBondContact OD1-NH1 3.37Å; D218-R275 IonicContact OD1-NH2 2.8Å; D218-R275 PolarHBondContact OD1-NH2 3.38Å; D218-R275 IonicContact OD2-CZ 3.92Å; D218-R275 IonicContact OD2-NH1 2.8Å; D218-R275 IonicContact OD2-NH2 3.7Å; D218-R275 PolarHBondContact OD2-NH2 2.81Å
219	M	89.4	Confident	88.6	Confident	44 Å²	44	60.2 Å²	60.2	22%	0.217	29%	0.291	C	S	.	.	H	α-helix	trans	-58.7	-46.4	171.9	179.1	62.8	163.6	0	0	111.7	F209 L215 I217 F221 N222 V223 V258 F259 V262	F209-M219 HydrophobicContact CE2-CB 4.16Å; F209-M219 HydrophobicContact CE2-CG 4.26Å; F209-M219 HydrophobicContact CZ-CG 4.46Å; L215-M219 VanDerWaalsContact O-CB 3.22Å; L215-M219 WeakPolarHBondContact O-CB 3.35Å; L215-M219 PolarHBondContact O-N 3.11Å; I217-M219 VanDerWaalsContact C-N 3.32Å; I217-M219 PolarHBondContact O-N 3.43Å; M219-F221 PolarHBondContact O-N 3.01Å; M219-N222 PolarHBondContact O-N 3.03Å; M219-V223 HydrophobicContact CE-CG2 4.47Å; M219-V223 WeakPolarHBondContact O-CG2 3.33Å; M219-V223 PolarHBondContact O-N 3Å; M219-V223 HydrophobicContact SD-CG2 4.32Å; M219-V258 HydrophobicContact SD-CG1 4.5Å; M219-F259 HydrophobicContact CE-CD1 3.79Å; M219-F259 HydrophobicContact CE-CE1 3.73Å; M219-F259 HydrophobicContact SD-CD1 3.85Å; M219-F259 HydrophobicContact SD-CE1 3.76Å; M219-V262 HydrophobicContact CB-CG2 4.45Å; M219-V262 HydrophobicContact CE-CG2 4.44Å; M219-V262 HydrophobicContact CG-CG2 4.33Å; M219-V262 HydrophobicContact SD-CG2 3.95Å
220	A	91.9	Very high	89.3	Confident	59 Å²	59	59.2 Å²	59.2	49%	0.488	29%	0.294	S	S	.	.	H	α-helix	trans	-61.8	-41.3	177.1	0	0	0	0	0	112.5	Q216 I217 D218 F224	Q216-A220 PolarHBondContact O-N 2.93Å; Q216-A220 VanDerWaalsContact O-N 3.16Å; I217-A220 WeakPolarHBondContact O-CB 3.43Å; I217-A220 PolarHBondContact O-N 2.95Å; I217-A220 VanDerWaalsContact O-N 3.13Å; D218-A220 PolarHBondContact O-N 3.49Å; A220-F224 PolarHBondContact O-N 3.23Å; A220-F224 VanDerWaalsContact O-N 3.13Å
221	F	94.4	Very high	90	Very high	39 Å²	39	51.5 Å²	51.5	17%	0.171	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-43.3	176.6	-67.4	-1.7	0	0	0	111.8	L187 A191 I194 I217 D218 M219 F224 F225	L187-F221 HydrophobicContact CD2-CD1 3.6Å; L187-F221 HydrophobicContact CD2-CE1 3.4Å; L187-F221 HydrophobicContact CD2-CG 4.36Å; L187-F221 HydrophobicContact CD2-CZ 4.01Å; A191-F221 HydrophobicContact CB-CD2 4.07Å; I194-F221 HydrophobicContact CD1-CD2 3.75Å; I194-F221 HydrophobicContact CD1-CE2 3.59Å; I217-F221 HydrophobicContact CG2-CD1 4.07Å; I217-F221 HydrophobicContact CG2-CD2 4.15Å; I217-F221 HydrophobicContact CG2-CE1 3.54Å; I217-F221 HydrophobicContact CG2-CE2 3.63Å; I217-F221 HydrophobicContact CG2-CG 4.37Å; I217-F221 HydrophobicContact CG2-CZ 3.31Å; I217-F221 WeakPolarHBondContact O-CD1 3.38Å; I217-F221 WeakPolarHBondContact O-CG 3.23Å; I217-F221 PolarHBondContact O-N 3.12Å; D218-F221 PolarHBondContact O-N 3.5Å; M219-F221 PolarHBondContact O-N 3.01Å; F221-F224 WeakPolarHBondContact O-CB 3.45Å; F221-F224 PolarHBondContact O-N 3.5Å; F221-F225 HydrophobicContact CB-CE2 3.99Å; F221-F225 WeakPolarHBondContact O-CD2 3.4Å; F221-F225 WeakPolarHBondContact O-CG 3.27Å; F221-F225 PolarHBondContact O-N 3.39Å
222	N	92.3	Very high	90.6	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-74.8	-27	-179	-70.9	-81.6	0	0	0	113.4	D218 M219 F225 L226 V255 V258 R275	D218-N222 WeakPolarHBondContact O-CB 3.14Å; D218-N222 PolarHBondContact O-N 3.39Å; D218-N222 PolarHBondContact O-ND2 3.09Å; D218-N222 PolarHBondContact OD1-ND2 3.37Å; M219-N222 PolarHBondContact O-N 3.03Å; N222-F225 PolarHBondContact O-N 3.14Å; N222-L226 WeakPolarHBondContact O-CB 3.29Å; N222-L226 PolarHBondContact O-N 3.44Å; N222-V255 HydrophobicContact CB-CG1 4.45Å; N222-V255 HydrophobicContact CB-CG2 4.27Å; N222-V258 HydrophobicContact CB-CB 4.33Å; N222-V258 HydrophobicContact CB-CG1 4.25Å; N222-R275 PolarHBondContact ND2-NH2 3.26Å
223	V	93.9	Very high	91.1	Very high	60 Å²	60	45.3 Å²	45.3	36%	0.364	24%	0.238	S	C	.	.	H	α-helix	trans	-63.9	-42.2	165.1	168.9	0	0	0	0	111.2	M219 L226 L227 F259	M219-V223 HydrophobicContact CE-CG2 4.47Å; M219-V223 WeakPolarHBondContact O-CG2 3.33Å; M219-V223 PolarHBondContact O-N 3Å; M219-V223 HydrophobicContact SD-CG2 4.32Å; V223-L226 PolarHBondContact O-N 3.04Å; V223-L227 WeakPolarHBondContact O-CG 3.4Å; V223-L227 PolarHBondContact O-N 2.58Å; V223-F259 HydrophobicContact CG2-CE1 3.92Å; V223-F259 HydrophobicContact CG2-CZ 3.99Å
224	F	94.6	Very high	91.3	Very high	45 Å²	45	41.5 Å²	41.5	20%	0.197	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-43	174.1	177.7	-86.1	0	0	0	112.1	L180 L183 V184 L187 A220 F221 L226 L227 Y228	L180-F224 HydrophobicContact CD1-CE2 4.33Å; L180-F224 HydrophobicContact CD1-CZ 3.92Å; L183-F224 HydrophobicContact CB-CE2 4.26Å; L183-F224 HydrophobicContact CB-CZ 3.76Å; V184-F224 HydrophobicContact CB-CE1 4.4Å; V184-F224 HydrophobicContact CG2-CE1 3.64Å; V184-F224 HydrophobicContact CG2-CZ 3.99Å; L187-F224 HydrophobicContact CD1-CB 4.32Å; L187-F224 HydrophobicContact CD1-CD1 3.45Å; L187-F224 VanDerWaalsContact CD1-CD1 3.45Å; L187-F224 HydrophobicContact CD1-CD2 3.99Å; L187-F224 HydrophobicContact CD1-CE1 3.62Å; L187-F224 HydrophobicContact CD1-CE2 4.12Å; L187-F224 HydrophobicContact CD1-CG 3.65Å; L187-F224 HydrophobicContact CD1-CZ 3.95Å; A220-F224 PolarHBondContact O-N 3.23Å; A220-F224 VanDerWaalsContact O-N 3.13Å; F221-F224 WeakPolarHBondContact O-CB 3.45Å; F221-F224 PolarHBondContact O-N 3.5Å; F224-L226 VanDerWaalsContact C-N 3.33Å; F224-L226 PolarHBondContact O-N 2.9Å; F224-L227 PolarHBondContact O-N 3.47Å; F224-Y228 PolarHBondContact O-N 2.77Å
225	F	93.4	Very high	91.4	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-35.8	175.6	-63.6	-51.6	0	0	0	112.8	L187 S188 A191 F221 N222 L227 Y228 F229 V255 R278	L187-F225 HydrophobicContact CB-CE1 4.35Å; L187-F225 HydrophobicContact CB-CZ 3.99Å; S188-F225 WeakPolarHBondContact OG-CE1 3.42Å; A191-F225 HydrophobicContact CB-CE2 3.89Å; A191-F225 HydrophobicContact CB-CZ 4.3Å; F221-F225 HydrophobicContact CB-CE2 3.99Å; F221-F225 WeakPolarHBondContact O-CD2 3.4Å; F221-F225 WeakPolarHBondContact O-CG 3.27Å; F221-F225 PolarHBondContact O-N 3.39Å; N222-F225 PolarHBondContact O-N 3.14Å; F225-L227 PolarHBondContact O-N 2.84Å; F225-Y228 PolarHBondContact O-N 3.2Å; F225-F229 VanDerWaalsContact O-CB 3.28Å; F225-F229 WeakPolarHBondContact O-CB 3.39Å; F225-F229 PolarHBondContact O-N 3.44Å; F225-V255 HydrophobicContact CB-CG2 3.98Å; F225-R278 VanDerWaalsContact CD2-NH1 3.26Å
226	L	93.4	Very high	91.6	Very high	85 Å²	85	41.4 Å²	41.4	45%	0.445	23%	0.226	S	C	.	.	H	α-helix	trans	-61.5	-42.6	173.7	-177.7	63.1	0	0	0	112	N222 V223 F224 G230 V255 F259	N222-L226 WeakPolarHBondContact O-CB 3.29Å; N222-L226 PolarHBondContact O-N 3.44Å; V223-L226 PolarHBondContact O-N 3.04Å; F224-L226 VanDerWaalsContact C-N 3.33Å; F224-L226 PolarHBondContact O-N 2.9Å; L226-G230 PolarHBondContact O-N 2.84Å; L226-V255 HydrophobicContact CB-CG1 4.22Å; L226-F259 HydrophobicContact CD2-CE2 4Å; L226-F259 HydrophobicContact CD2-CZ 3.96Å
227	L	92.5	Very high	91.6	Very high	118 Å²	118	45.2 Å²	45.2	62%	0.618	25%	0.249	S	C	*	.	H	α-helix	trans	-66	-42.6	175.7	-66.7	172.6	0	0	0	111.7	V223 F224 F225 G230 L231	V223-L227 WeakPolarHBondContact O-CG 3.4Å; V223-L227 PolarHBondContact O-N 2.58Å; F224-L227 PolarHBondContact O-N 3.47Å; F225-L227 PolarHBondContact O-N 2.84Å; L227-G230 PolarHBondContact O-N 2.9Å; L227-L231 PolarHBondContact O-N 2.86Å
228	Y	91.3	Very high	91.6	Very high	20 Å²	20	45.1 Å²	45.1	8%	0.078	25%	0.249	C	C	.	.	H	α-helix	trans	-64.9	-43.6	176.8	-178.8	-115.6	0	0	0	112.4	I170 L180 V184 F224 F225 G230 L231 R232	I170-Y228 HydrophobicContact CD1-CD2 4.01Å; I170-Y228 HydrophobicContact CD1-CE2 3.43Å; I170-Y228 VanDerWaalsContact CD1-CE2 3.43Å; L180-Y228 HydrophobicContact CD1-CD2 4.23Å; L180-Y228 HydrophobicContact CD2-CD2 4.19Å; L180-Y228 HydrophobicContact CD2-CE2 4.29Å; L180-Y228 HydrophobicContact CG-CD2 4.22Å; L180-Y228 HydrophobicContact CG-CE2 4.36Å; V184-Y228 HydrophobicContact CB-CE1 4.44Å; V184-Y228 HydrophobicContact CG1-CD1 4.06Å; V184-Y228 HydrophobicContact CG1-CE1 3.66Å; V184-Y228 HydrophobicContact CG2-CD1 3.81Å; V184-Y228 HydrophobicContact CG2-CD2 3.49Å; V184-Y228 VanDerWaalsContact CG2-CD2 3.49Å; V184-Y228 HydrophobicContact CG2-CE1 3.88Å; V184-Y228 HydrophobicContact CG2-CE2 3.57Å; V184-Y228 HydrophobicContact CG2-CG 3.61Å; F224-Y228 PolarHBondContact O-N 2.77Å; F225-Y228 PolarHBondContact O-N 3.2Å; Y228-G230 VanDerWaalsContact C-N 3.29Å; Y228-G230 PolarHBondContact O-N 3.12Å; Y228-L231 PolarHBondContact O-N 3.26Å; Y228-R232 HydrophobicContact CD1-CG 4.49Å; Y228-R232 HydrophobicContact CE1-CG 4.12Å; Y228-R232 HydrophobicContact CE2-CG 4.24Å; Y228-R232 WeakPolarHBondContact O-CG 3.3Å; Y228-R232 PolarHBondContact O-N 2.92Å
229	F	92.4	Very high	91.6	Very high	27 Å²	27	48.1 Å²	48.1	12%	0.118	26%	0.262	C	S	.	.	H	α-helix	trans	-56.2	-43.9	171	173.7	-89.8	0	0	0	111.2	F225 L231 R232 F233 F242 W243 D251 F252	F225-F229 VanDerWaalsContact O-CB 3.28Å; F225-F229 WeakPolarHBondContact O-CB 3.39Å; F225-F229 PolarHBondContact O-N 3.44Å; F229-L231 PolarHBondContact O-N 3.2Å; F229-R232 PolarHBondContact O-N 3.48Å; F229-F233 HydrophobicContact CE1-CB 4.42Å; F229-F233 WeakPolarHBondContact O-CB 3.38Å; F229-F233 PolarHBondContact O-N 3.03Å; F229-F242 HydrophobicContact CD2-CE1 4.23Å; F229-F242 AromaticContact CD2-CZ 3.99Å; F229-F242 HydrophobicContact CD2-CZ 3.99Å; F229-F242 AromaticContact CE2-CE1 3.61Å; F229-F242 HydrophobicContact CE2-CE1 3.61Å; F229-F242 AromaticContact CE2-CZ 3.81Å; F229-F242 HydrophobicContact CE2-CZ 3.81Å; F229-F242 AromaticContact CZ-CE1 3.85Å; F229-F242 HydrophobicContact CZ-CE1 3.85Å; F229-F242 HydrophobicContact CZ-CZ 4.44Å; F229-W243 HydrophobicContact CZ-CE3 4.48Å; F229-W243 HydrophobicContact CZ-CZ3 4.05Å; F229-D251 HydrophobicContact CD2-CB 4.1Å; F229-F252 HydrophobicContact CE1-CE1 4.25Å; F229-F252 AromaticContact CE2-CE1 3.82Å; F229-F252 HydrophobicContact CE2-CE1 3.82Å; F229-F252 HydrophobicContact CE2-CE2 4.44Å; F229-F252 AromaticContact CE2-CZ 3.68Å; F229-F252 HydrophobicContact CE2-CZ 3.68Å; F229-F252 AromaticContact CZ-CE1 3.48Å; F229-F252 HydrophobicContact CZ-CE1 3.48Å; F229-F252 VanDerWaalsContact CZ-CE1 3.48Å; F229-F252 AromaticContact CZ-CZ 3.48Å; F229-F252 HydrophobicContact CZ-CZ 3.48Å; F229-F252 VanDerWaalsContact CZ-CZ 3.48Å
230	G	92.4	Very high	91.7	Very high	26 Å²	26	47.5 Å²	47.5	27%	0.268	26%	0.26	S	S	.	.	H	α-helix	trans	-58.4	-45.4	175	0	0	0	0	0	113.3	L226 L227 Y228 F233 I234	L226-G230 PolarHBondContact O-N 2.84Å; L227-G230 PolarHBondContact O-N 2.9Å; Y228-G230 VanDerWaalsContact C-N 3.29Å; Y228-G230 PolarHBondContact O-N 3.12Å; G230-F233 PolarHBondContact O-N 3.08Å; G230-I234 VanDerWaalsContact O-CG1 3.29Å; G230-I234 WeakPolarHBondContact O-CG1 3.19Å; G230-I234 PolarHBondContact O-N 2.27Å
231	L	90.4	Very high	91.7	Very high	32 Å²	32	54 Å²	54	17%	0.168	27%	0.272	C	S	.	.	H	α-helix	trans	-62.7	-45.2	175.5	-69.2	173.6	0	0	0	112	W165 M169 I170 L180 L227 Y228 F229 I234 A235	W165-L231 HydrophobicContact CH2-CD2 4.27Å; W165-L231 HydrophobicContact CZ3-CD2 3.86Å; M169-L231 HydrophobicContact CE-CD1 4.37Å; I170-L231 HydrophobicContact CD1-CB 4.1Å; L180-L231 HydrophobicContact CD2-CD1 3.93Å; L227-L231 PolarHBondContact O-N 2.86Å; Y228-L231 PolarHBondContact O-N 3.26Å; F229-L231 PolarHBondContact O-N 3.2Å; L231-I234 PolarHBondContact O-N 2.92Å; L231-A235 WeakPolarHBondContact O-CB 3.3Å; L231-A235 PolarHBondContact O-N 3.15Å
232	R	91.3	Very high	91.6	Very high	18 Å²	18	52.5 Å²	52.5	7%	0.068	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-44.6	175.4	-65.7	-164	-66.1	135.5	-3.5	111.8	I170 Y228 F229 I234 A235 A236 F242 E245 N247 D251	I170-R232 HydrophobicContact CD1-CG 3.79Å; I170-R232 HydrophobicContact CG1-CG 4.36Å; Y228-R232 HydrophobicContact CD1-CG 4.49Å; Y228-R232 HydrophobicContact CE1-CG 4.12Å; Y228-R232 HydrophobicContact CE2-CG 4.24Å; Y228-R232 WeakPolarHBondContact O-CG 3.3Å; Y228-R232 PolarHBondContact O-N 2.92Å; F229-R232 PolarHBondContact O-N 3.48Å; R232-I234 VanDerWaalsContact C-N 3.32Å; R232-I234 PolarHBondContact O-N 2.85Å; R232-A235 PolarHBondContact O-N 3.48Å; R232-A236 PolarHBondContact O-N 3.42Å; R232-F242 HydrophobicContact CB-CE2 3.5Å; R232-F242 VanDerWaalsContact CB-CE2 3.5Å; R232-F242 HydrophobicContact CB-CZ 3.63Å; R232-E245 IonicContact NH1-OE1 3.53Å; R232-E245 PolarHBondContact NH1-OE1 3.46Å; R232-E245 IonicContact NH1-OE2 2.78Å; R232-N247 PolarHBondContact NH2-O 3.39Å; R232-D251 IonicContact CZ-OD2 2.72Å; R232-D251 IonicContact NH2-OD2 3.6Å; R232-D251 PolarHBondContact NH2-OD2 2.98Å
233	F	92.2	Very high	91.6	Very high	67 Å²	67	53.7 Å²	53.7	29%	0.294	27%	0.27	S	S	.	.	H	α-helix	trans	-60.2	-40.1	177.1	-179.5	-95.5	0	0	0	112	F229 G230 K239 F242 W243	F229-F233 HydrophobicContact CE1-CB 4.42Å; F229-F233 WeakPolarHBondContact O-CB 3.38Å; F229-F233 PolarHBondContact O-N 3.03Å; G230-F233 PolarHBondContact O-N 3.08Å; F233-K239 HydrophobicContact CE2-CB 4.27Å; F233-K239 HydrophobicContact CE2-CD 4.39Å; F233-K239 HydrophobicContact CZ-CD 4.37Å; F233-K239 WeakPolarHBondContact O-CE 3.45Å; F233-K239 PolarHBondContact O-NZ 3.49Å; F233-F242 HydrophobicContact CB-CD1 4.21Å; F233-F242 HydrophobicContact CB-CE1 3.62Å; F233-F242 HydrophobicContact CB-CZ 4.25Å; F233-F242 AromaticContact CD2-CD1 3.73Å; F233-F242 HydrophobicContact CD2-CD1 3.73Å; F233-F242 AromaticContact CD2-CE1 3.79Å; F233-F242 HydrophobicContact CD2-CE1 3.79Å; F233-F242 HydrophobicContact CG-CD1 4.44Å; F233-F242 HydrophobicContact CG-CE1 4.21Å; F233-W243 HydrophobicContact CD2-CE3 4.22Å; F233-W243 HydrophobicContact CD2-CZ3 4.19Å; F233-W243 AromaticContact CE2-CE3 3.92Å; F233-W243 HydrophobicContact CE2-CE3 3.92Å; F233-W243 AromaticContact CE2-CZ3 3.92Å; F233-W243 HydrophobicContact CE2-CZ3 3.92Å
234	I	90.6	Very high	91.5	Very high	66 Å²	66	55.3 Å²	55.3	34%	0.338	28%	0.276	S	S	.	.	H	α-helix	trans	-65.5	-49.1	175.7	-71.4	166.8	0	0	0	110.8	V162 A166 G230 L231 R232 A236 K239	V162-I234 HydrophobicContact CG1-CG2 3.95Å; A166-I234 HydrophobicContact CB-CB 4.2Å; A166-I234 HydrophobicContact CB-CG2 3.69Å; G230-I234 VanDerWaalsContact O-CG1 3.29Å; G230-I234 WeakPolarHBondContact O-CG1 3.19Å; G230-I234 PolarHBondContact O-N 2.27Å; L231-I234 PolarHBondContact O-N 2.92Å; R232-I234 VanDerWaalsContact C-N 3.32Å; R232-I234 PolarHBondContact O-N 2.85Å; I234-A236 PolarHBondContact O-N 3.38Å; I234-K239 PolarHBondContact O-NZ 2.61Å
235	A	88.8	Confident	91.3	Very high	20 Å²	20	55.5 Å²	55.5	17%	0.165	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-33.9	-178	0	0	0	0	0	114	K163 A166 I170 L231 R232 N237	K163-A235 WeakPolarHBondContact CE-O 3.4Å; A166-A235 HydrophobicContact CB-CB 4.02Å; I170-A235 HydrophobicContact CG1-CB 4.49Å; L231-A235 WeakPolarHBondContact O-CB 3.3Å; L231-A235 PolarHBondContact O-N 3.15Å; R232-A235 PolarHBondContact O-N 3.48Å; A235-N237 PolarHBondContact O-N 2.69Å
236	A	90	Very high	91.1	Very high	18 Å²	18	59.4 Å²	59.4	15%	0.149	30%	0.301	C	S	.	.			trans	-52.4	132.1	-173.2	0	0	0	0	0	114.2	R232 I234 K239 F242	R232-A236 PolarHBondContact O-N 3.42Å; I234-A236 PolarHBondContact O-N 3.38Å; A236-K239 HydrophobicContact CB-CD 4.3Å; A236-K239 WeakPolarHBondContact O-CE 3.36Å; A236-K239 PolarHBondContact O-NZ 3.42Å; A236-F242 HydrophobicContact CB-CB 3.67Å; A236-F242 HydrophobicContact CB-CD2 4.18Å; A236-F242 HydrophobicContact CB-CG 3.85Å
237	N	87.8	Confident	90.8	Very high	145 Å²	145	56.5 Å²	56.5	78%	0.775	29%	0.286	S	S	*	.	S	Bend	trans	-67.7	-51.5	175	-74.9	-39.5	0	0	0	111.7	K163 A235	K163-N237 WeakPolarHBondContact CE-OD1 3.28Å; K163-N237 PolarHBondContact NZ-OD1 2.96Å; A235-N237 PolarHBondContact O-N 2.69Å
238	D	90.6	Very high	90.7	Very high	57 Å²	57	50.9 Å²	50.9	31%	0.305	26%	0.256	S	S	.	.			trans	-107	117.3	174.3	-171.8	-48.9	0	0	0	109.7	R109 L240 W241 F242	R109-D238 IonicContact CZ-OD1 3.43Å; R109-D238 IonicContact CZ-OD2 3.67Å; R109-D238 IonicContact NH1-OD1 3.17Å; R109-D238 IonicContact NH1-OD2 3.84Å; R109-D238 PolarHBondContact NH1-OD2 3.14Å; R109-D238 IonicContact NH2-OD1 3.82Å; R109-D238 PolarHBondContact NH2-OD1 3.07Å; R109-D238 IonicContact NH2-OD2 2.96Å; R109-D238 PolarHBondContact NH2-OD2 3.12Å; D238-L240 WeakPolarHBondContact OD1-CA 3.42Å; D238-L240 WeakPolarHBondContact OD1-CB 3.42Å; D238-L240 PolarHBondContact OD1-N 2.87Å; D238-W241 HydrophobicContact CB-CB 3.91Å; D238-W241 PolarHBondContact OD1-N 2.9Å; D238-F242 WeakPolarHBondContact O-CB 3.29Å; D238-F242 PolarHBondContact O-N 2.92Å; D238-F242 VanDerWaalsContact O-N 3.15Å
239	K	90.1	Very high	90.7	Very high	63 Å²	63	51.9 Å²	51.9	27%	0.274	26%	0.264	S	S	.	.	H	α-helix	trans	-72.6	-26.9	-178.9	-52.3	-52	-174.4	-167.5	0	113.5	F233 I234 A236 W243	F233-K239 HydrophobicContact CE2-CB 4.27Å; F233-K239 HydrophobicContact CE2-CD 4.39Å; F233-K239 HydrophobicContact CZ-CD 4.37Å; F233-K239 WeakPolarHBondContact O-CE 3.45Å; F233-K239 PolarHBondContact O-NZ 3.49Å; I234-K239 PolarHBondContact O-NZ 2.61Å; A236-K239 HydrophobicContact CB-CD 4.3Å; A236-K239 WeakPolarHBondContact O-CE 3.36Å; A236-K239 PolarHBondContact O-NZ 3.42Å; K239-W243 WeakPolarHBondContact O-CB 3.07Å; K239-W243 PolarHBondContact O-N 3.5Å
240	L	91.5	Very high	90.6	Very high	31 Å²	31	50.7 Å²	50.7	16%	0.162	26%	0.259	C	S	.	.	H	α-helix	trans	-76.9	-43.3	177	179.4	64.4	0	0	0	110.7	L102 I105 L106 D238 W243 L244	L102-L240 HydrophobicContact CD1-CD1 3.44Å; L102-L240 VanDerWaalsContact CD1-CD1 3.44Å; I105-L240 HydrophobicContact CG2-CB 3.85Å; I105-L240 HydrophobicContact CG2-CD1 4.04Å; L106-L240 HydrophobicContact CD2-CD1 4.15Å; L106-L240 HydrophobicContact CD2-CD2 4.06Å; L106-L240 HydrophobicContact CG-CD1 4.49Å; D238-L240 WeakPolarHBondContact OD1-CA 3.42Å; D238-L240 WeakPolarHBondContact OD1-CB 3.42Å; D238-L240 PolarHBondContact OD1-N 2.87Å; L240-W243 WeakPolarHBondContact O-CB 3.23Å; L240-W243 PolarHBondContact O-N 3.11Å; L240-L244 HydrophobicContact CD1-CD1 4.45Å; L240-L244 PolarHBondContact O-N 3.36Å
241	W	91.6	Very high	90.6	Very high	195 Å²	195	49.8 Å²	49.8	74%	0.739	25%	0.249	S	C	*	.	H	α-helix	trans	-62.9	-44.9	176.7	-169	70.3	0	0	0	111.1	D238 W243 L244 E245	D238-W241 HydrophobicContact CB-CB 3.91Å; D238-W241 PolarHBondContact OD1-N 2.9Å; W241-W243 VanDerWaalsContact C-N 3.3Å; W241-W243 PolarHBondContact O-N 3.5Å; W241-L244 CarbonylContact O-C 3.57Å; W241-L244 PolarHBondContact O-N 2.86Å; W241-L244 VanDerWaalsContact O-N 3.15Å; W241-E245 PolarHBondContact O-N 2.92Å; W241-E245 VanDerWaalsContact O-N 3.09Å
242	F	92.7	Very high	90.7	Very high	7 Å²	7	48.7 Å²	48.7	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-34.4	172.7	174.6	-96.5	0	0	0	113.5	F229 R232 F233 A236 D238 L244 E245 S248	F229-F242 HydrophobicContact CD2-CE1 4.23Å; F229-F242 AromaticContact CD2-CZ 3.99Å; F229-F242 HydrophobicContact CD2-CZ 3.99Å; F229-F242 AromaticContact CE2-CE1 3.61Å; F229-F242 HydrophobicContact CE2-CE1 3.61Å; F229-F242 AromaticContact CE2-CZ 3.81Å; F229-F242 HydrophobicContact CE2-CZ 3.81Å; F229-F242 AromaticContact CZ-CE1 3.85Å; F229-F242 HydrophobicContact CZ-CE1 3.85Å; F229-F242 HydrophobicContact CZ-CZ 4.44Å; R232-F242 HydrophobicContact CB-CE2 3.5Å; R232-F242 VanDerWaalsContact CB-CE2 3.5Å; R232-F242 HydrophobicContact CB-CZ 3.63Å; F233-F242 HydrophobicContact CB-CD1 4.21Å; F233-F242 HydrophobicContact CB-CE1 3.62Å; F233-F242 HydrophobicContact CB-CZ 4.25Å; F233-F242 AromaticContact CD2-CD1 3.73Å; F233-F242 HydrophobicContact CD2-CD1 3.73Å; F233-F242 AromaticContact CD2-CE1 3.79Å; F233-F242 HydrophobicContact CD2-CE1 3.79Å; F233-F242 HydrophobicContact CG-CD1 4.44Å; F233-F242 HydrophobicContact CG-CE1 4.21Å; A236-F242 HydrophobicContact CB-CB 3.67Å; A236-F242 HydrophobicContact CB-CD2 4.18Å; A236-F242 HydrophobicContact CB-CG 3.85Å; D238-F242 WeakPolarHBondContact O-CB 3.29Å; D238-F242 PolarHBondContact O-N 2.92Å; D238-F242 VanDerWaalsContact O-N 3.15Å; F242-L244 PolarHBondContact O-N 2.9Å; F242-E245 WeakPolarHBondContact CD2-OE2 3.33Å; F242-E245 WeakPolarHBondContact O-CB 3.42Å; F242-E245 PolarHBondContact O-N 2.9Å; F242-S248 VanDerWaalsContact CE2-OG 3.3Å; F242-S248 WeakPolarHBondContact CE2-OG 3.24Å; F242-S248 VanDerWaalsContact CZ-OG 3.27Å; F242-S248 WeakPolarHBondContact CZ-OG 3.39Å; F242-S248 WeakPolarHBondContact O-CB 3.47Å; F242-S248 PolarHBondContact O-OG 2.9Å
243	W	92.6	Very high	90.7	Very high	26 Å²	26	49.2 Å²	49.2	10%	0.098	25%	0.245	C	C	.	.	H	α-helix	trans	-68.5	-24.3	177.5	-156	-91.6	0	0	0	113.2	F98 I105 F229 F233 K239 L240 W241 F252	F98-W243 AromaticContact CD2-NE1 3.89Å; F98-W243 PolarHBondContact O-NE1 2.95Å; I105-W243 HydrophobicContact CD1-CB 3.92Å; I105-W243 HydrophobicContact CD1-CD2 3.58Å; I105-W243 HydrophobicContact CD1-CE3 3.48Å; I105-W243 VanDerWaalsContact CD1-CE3 3.48Å; I105-W243 HydrophobicContact CD1-CG 3.78Å; I105-W243 HydrophobicContact CD1-CZ3 4.24Å; F229-W243 HydrophobicContact CZ-CE3 4.48Å; F229-W243 HydrophobicContact CZ-CZ3 4.05Å; F233-W243 HydrophobicContact CD2-CE3 4.22Å; F233-W243 HydrophobicContact CD2-CZ3 4.19Å; F233-W243 AromaticContact CE2-CE3 3.92Å; F233-W243 HydrophobicContact CE2-CE3 3.92Å; F233-W243 AromaticContact CE2-CZ3 3.92Å; F233-W243 HydrophobicContact CE2-CZ3 3.92Å; K239-W243 WeakPolarHBondContact O-CB 3.07Å; K239-W243 PolarHBondContact O-N 3.5Å; L240-W243 WeakPolarHBondContact O-CB 3.23Å; L240-W243 PolarHBondContact O-N 3.11Å; W241-W243 VanDerWaalsContact C-N 3.3Å; W241-W243 PolarHBondContact O-N 3.5Å; W243-F252 HydrophobicContact CD2-CE2 4.03Å; W243-F252 AromaticContact CD2-CZ 3.57Å; W243-F252 HydrophobicContact CD2-CZ 3.57Å; W243-F252 AromaticContact CE2-CE2 3.79Å; W243-F252 AromaticContact CE2-CZ 3.34Å; W243-F252 AromaticContact CE3-CZ 3.77Å; W243-F252 HydrophobicContact CE3-CZ 3.77Å; W243-F252 HydrophobicContact CG-CE2 4.25Å; W243-F252 HydrophobicContact CG-CZ 4.25Å; W243-F252 AromaticContact CH2-CE1 3.66Å; W243-F252 HydrophobicContact CH2-CE1 3.66Å; W243-F252 AromaticContact CH2-CZ 3.58Å; W243-F252 HydrophobicContact CH2-CZ 3.58Å; W243-F252 AromaticContact CZ2-CE1 3.57Å; W243-F252 HydrophobicContact CZ2-CE1 3.57Å; W243-F252 HydrophobicContact CZ2-CE2 4.16Å; W243-F252 AromaticContact CZ2-CZ 3.34Å; W243-F252 HydrophobicContact CZ2-CZ 3.34Å; W243-F252 HydrophobicContact CZ3-CE1 4.2Å; W243-F252 AromaticContact CZ3-CZ 3.8Å; W243-F252 HydrophobicContact CZ3-CZ 3.8Å; W243-F252 AromaticContact NE1-CE2 3.91Å; W243-F252 AromaticContact NE1-CZ 3.93Å
244	L	91.4	Very high	90.7	Very high	93 Å²	93	46.1 Å²	46.1	49%	0.487	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	1.6	178.5	-59.9	176.5	0	0	0	112.8	F98 L102 L240 W241 F242	F98-L244 HydrophobicContact CE2-CD2 4.24Å; F98-L244 HydrophobicContact CZ-CD2 3.95Å; L102-L244 HydrophobicContact CD1-CD2 4.25Å; L240-L244 HydrophobicContact CD1-CD1 4.45Å; L240-L244 PolarHBondContact O-N 3.36Å; W241-L244 CarbonylContact O-C 3.57Å; W241-L244 PolarHBondContact O-N 2.86Å; W241-L244 VanDerWaalsContact O-N 3.15Å; F242-L244 PolarHBondContact O-N 2.9Å
245	E	90.8	Very high	90.8	Very high	50 Å²	50	43.3 Å²	43.3	23%	0.234	22%	0.218	C	C	.	.	S	Bend	trans	-66.3	134.6	175	-168.7	-161.8	125.9	0	0	110.5	R232 W241 F242 N247 S248 V249	R232-E245 IonicContact NH1-OE1 3.53Å; R232-E245 PolarHBondContact NH1-OE1 3.46Å; R232-E245 IonicContact NH1-OE2 2.78Å; W241-E245 PolarHBondContact O-N 2.92Å; W241-E245 VanDerWaalsContact O-N 3.09Å; F242-E245 WeakPolarHBondContact CD2-OE2 3.33Å; F242-E245 WeakPolarHBondContact O-CB 3.42Å; F242-E245 PolarHBondContact O-N 2.9Å; E245-N247 PolarHBondContact O-N 3.4Å; E245-N247 VanDerWaalsContact O-N 3.15Å; E245-N247 WeakPolarHBondContact OE1-CB 3.22Å; E245-N247 PolarHBondContact OE1-ND2 2.9Å; E245-S248 WeakPolarHBondContact O-CA 3.47Å; E245-S248 VanDerWaalsContact O-CB 3.31Å; E245-S248 WeakPolarHBondContact O-CB 3.34Å; E245-S248 PolarHBondContact O-N 3.23Å; E245-V249 PolarHBondContact O-N 2.94Å
246	V	88.7	Confident	91	Very high	83 Å²	83	43.4 Å²	43.4	50%	0.503	22%	0.216	S	C	.	.	H	α-helix	trans	-54.6	-39.8	-176	-179.7	0	0	0	0	112.3	S248 V249 V250 L277	V246-S248 VanDerWaalsContact C-N 3.28Å; V246-S248 PolarHBondContact O-N 2.82Å; V246-V249 WeakPolarHBondContact O-CB 3.47Å; V246-V249 PolarHBondContact O-N 2.68Å; V246-V250 WeakPolarHBondContact O-CG2 3.27Å; V246-V250 PolarHBondContact O-N 2.98Å; V246-L277 HydrophobicContact CG1-CD1 4.44Å
247	N	86.7	Confident	91	Very high	24 Å²	24	43.3 Å²	43.3	13%	0.128	21%	0.214	C	C	.	.	H	α-helix	trans	-68.4	-27.6	178.9	-48.6	-61.7	0	0	0	112.5	R232 E245 D251 Q281	R232-N247 PolarHBondContact NH2-O 3.39Å; E245-N247 PolarHBondContact O-N 3.4Å; E245-N247 VanDerWaalsContact O-N 3.15Å; E245-N247 WeakPolarHBondContact OE1-CB 3.22Å; E245-N247 PolarHBondContact OE1-ND2 2.9Å; N247-D251 PolarHBondContact O-N 2.88Å; N247-Q281 VanDerWaalsContact CG-NE2 3.34Å; N247-Q281 PolarHBondContact ND2-NE2 2.81Å
248	S	90.7	Very high	91.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-75.5	-39.8	172.4	-58.8	0	0	0	0	111.2	F242 E245 V246 V250 D251 F252	F242-S248 VanDerWaalsContact CE2-OG 3.3Å; F242-S248 WeakPolarHBondContact CE2-OG 3.24Å; F242-S248 VanDerWaalsContact CZ-OG 3.27Å; F242-S248 WeakPolarHBondContact CZ-OG 3.39Å; F242-S248 WeakPolarHBondContact O-CB 3.47Å; F242-S248 PolarHBondContact O-OG 2.9Å; E245-S248 WeakPolarHBondContact O-CA 3.47Å; E245-S248 VanDerWaalsContact O-CB 3.31Å; E245-S248 WeakPolarHBondContact O-CB 3.34Å; E245-S248 PolarHBondContact O-N 3.23Å; V246-S248 VanDerWaalsContact C-N 3.28Å; V246-S248 PolarHBondContact O-N 2.82Å; S248-V250 VanDerWaalsContact C-N 3.33Å; S248-V250 PolarHBondContact O-N 2.82Å; S248-D251 PolarHBondContact O-N 2.75Å; S248-D251 VanDerWaalsContact O-N 3.14Å; S248-F252 WeakPolarHBondContact O-CD2 3.39Å; S248-F252 WeakPolarHBondContact O-CG 3.38Å; S248-F252 PolarHBondContact O-N 3.19Å
249	V	90.9	Very high	91.1	Very high	41 Å²	41	37.1 Å²	37.1	25%	0.248	18%	0.178	C	C	.	.	H	α-helix	trans	-59	-43	173.9	175.6	0	0	0	0	111.2	F98 E245 V246 D251 F252 F253	F98-V249 HydrophobicContact CE2-CG2 4.28Å; E245-V249 PolarHBondContact O-N 2.94Å; V246-V249 WeakPolarHBondContact O-CB 3.47Å; V246-V249 PolarHBondContact O-N 2.68Å; V249-D251 VanDerWaalsContact C-N 3.34Å; V249-D251 PolarHBondContact O-N 3.05Å; V249-F252 PolarHBondContact O-N 2.91Å; V249-F253 HydrophobicContact CG1-CD2 3.8Å; V249-F253 HydrophobicContact CG1-CE2 3.79Å; V249-F253 VanDerWaalsContact O-CD2 3.27Å; V249-F253 WeakPolarHBondContact O-CD2 3.46Å; V249-F253 PolarHBondContact O-N 2.88Å
250	V	91.9	Very high	91.1	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-59.6	-43	173.8	173.7	0	0	0	0	111.6	V246 S248 F253 T254 L274 L277 R278	V246-V250 WeakPolarHBondContact O-CG2 3.27Å; V246-V250 PolarHBondContact O-N 2.98Å; S248-V250 VanDerWaalsContact C-N 3.33Å; S248-V250 PolarHBondContact O-N 2.82Å; V250-F253 PolarHBondContact O-N 2.98Å; V250-T254 HydrophobicContact CG1-CG2 4.18Å; V250-T254 WeakPolarHBondContact O-CB 3.1Å; V250-T254 VanDerWaalsContact O-CG2 3.28Å; V250-T254 WeakPolarHBondContact O-CG2 3.34Å; V250-T254 PolarHBondContact O-N 3.11Å; V250-T254 VanDerWaalsContact O-N 3.08Å; V250-T254 PolarHBondContact O-OG1 3Å; V250-L274 HydrophobicContact CG1-CB 4.49Å; V250-L274 WeakPolarHBondContact CG1-O 3.25Å; V250-L277 HydrophobicContact CG2-CB 3.76Å; V250-L277 HydrophobicContact CG2-CD1 3.96Å; V250-L277 HydrophobicContact CG2-CG 4.47Å; V250-R278 HydrophobicContact CG1-CG 3.88Å
251	D	91.1	Very high	90.9	Very high	8 Å²	8	33.9 Å²	33.9	4%	0.043	17%	0.165	C	C	.	.	H	α-helix	trans	-63.1	-43.4	178.3	-67.1	-14	0	0	0	111.2	F229 R232 N247 S248 V249 F253 T254 V255 P256 R278	F229-D251 HydrophobicContact CD2-CB 4.1Å; R232-D251 IonicContact CZ-OD2 2.72Å; R232-D251 IonicContact NH2-OD2 3.6Å; R232-D251 PolarHBondContact NH2-OD2 2.98Å; N247-D251 PolarHBondContact O-N 2.88Å; S248-D251 PolarHBondContact O-N 2.75Å; S248-D251 VanDerWaalsContact O-N 3.14Å; V249-D251 VanDerWaalsContact C-N 3.34Å; V249-D251 PolarHBondContact O-N 3.05Å; D251-F253 VanDerWaalsContact C-N 3.31Å; D251-F253 PolarHBondContact O-N 2.95Å; D251-T254 PolarHBondContact O-N 3.36Å; D251-V255 WeakPolarHBondContact O-CB 3.2Å; D251-V255 PolarHBondContact O-N 3.41Å; D251-P256 WeakPolarHBondContact O-CD 3.36Å; D251-R278 IonicContact OD1-CZ 2.67Å; D251-R278 IonicContact OD1-NE 2.9Å; D251-R278 PolarHBondContact OD1-NE 3.45Å; D251-R278 IonicContact OD1-NH2 2.8Å; D251-R278 PolarHBondContact OD1-NH2 3.14Å
252	F	92.5	Very high	90.6	Very high	8 Å²	8	26 Å²	26	4%	0.035	14%	0.138	C	C	.	.	H	α-helix	trans	-63	-29.8	176.6	-61.1	-49.3	0	0	0	114.5	S94 T97 F98 F229 W243 S248 V249 P256	S94-F252 VanDerWaalsContact CB-O 3.23Å; S94-F252 WeakPolarHBondContact CB-O 3.27Å; S94-F252 PolarHBondContact OG-O 2.86Å; T97-F252 HydrophobicContact CG2-CD1 3.87Å; T97-F252 HydrophobicContact CG2-CE1 4.33Å; F98-F252 AromaticContact CD2-CD2 3.62Å; F98-F252 HydrophobicContact CD2-CD2 3.62Å; F98-F252 AromaticContact CD2-CE2 3.98Å; F98-F252 HydrophobicContact CD2-CE2 3.98Å; F98-F252 HydrophobicContact CD2-CG 4.43Å; F98-F252 HydrophobicContact CE2-CD2 4.38Å; F229-F252 HydrophobicContact CE1-CE1 4.25Å; F229-F252 AromaticContact CE2-CE1 3.82Å; F229-F252 HydrophobicContact CE2-CE1 3.82Å; F229-F252 HydrophobicContact CE2-CE2 4.44Å; F229-F252 AromaticContact CE2-CZ 3.68Å; F229-F252 HydrophobicContact CE2-CZ 3.68Å; F229-F252 AromaticContact CZ-CE1 3.48Å; F229-F252 HydrophobicContact CZ-CE1 3.48Å; F229-F252 VanDerWaalsContact CZ-CE1 3.48Å; F229-F252 AromaticContact CZ-CZ 3.48Å; F229-F252 HydrophobicContact CZ-CZ 3.48Å; F229-F252 VanDerWaalsContact CZ-CZ 3.48Å; W243-F252 HydrophobicContact CD2-CE2 4.03Å; W243-F252 AromaticContact CD2-CZ 3.57Å; W243-F252 HydrophobicContact CD2-CZ 3.57Å; W243-F252 AromaticContact CE2-CE2 3.79Å; W243-F252 AromaticContact CE2-CZ 3.34Å; W243-F252 AromaticContact CE3-CZ 3.77Å; W243-F252 HydrophobicContact CE3-CZ 3.77Å; W243-F252 HydrophobicContact CG-CE2 4.25Å; W243-F252 HydrophobicContact CG-CZ 4.25Å; W243-F252 AromaticContact CH2-CE1 3.66Å; W243-F252 HydrophobicContact CH2-CE1 3.66Å; W243-F252 AromaticContact CH2-CZ 3.58Å; W243-F252 HydrophobicContact CH2-CZ 3.58Å; W243-F252 AromaticContact CZ2-CE1 3.57Å; W243-F252 HydrophobicContact CZ2-CE1 3.57Å; W243-F252 HydrophobicContact CZ2-CE2 4.16Å; W243-F252 AromaticContact CZ2-CZ 3.34Å; W243-F252 HydrophobicContact CZ2-CZ 3.34Å; W243-F252 HydrophobicContact CZ3-CE1 4.2Å; W243-F252 AromaticContact CZ3-CZ 3.8Å; W243-F252 HydrophobicContact CZ3-CZ 3.8Å; W243-F252 AromaticContact NE1-CE2 3.91Å; W243-F252 AromaticContact NE1-CZ 3.93Å; S248-F252 WeakPolarHBondContact O-CD2 3.39Å; S248-F252 WeakPolarHBondContact O-CG 3.38Å; S248-F252 PolarHBondContact O-N 3.19Å; V249-F252 PolarHBondContact O-N 2.91Å; F252-P256 VanDerWaalsContact O-CD 3.23Å; F252-P256 WeakPolarHBondContact O-CD 3.49Å; F252-P256 WeakPolarHBondContact O-CG 3.32Å
253	F	92.3	Very high	90.4	Very high	30 Å²	30	35.1 Å²	35.1	13%	0.132	17%	0.174	C	C	.	.	H	α-helix	trans	-92.8	-6.8	178	-74.1	-65.4	0	0	0	114.9	M95 V249 V250 D251 L271 L274	M95-F253 HydrophobicContact CE-CE1 3.5Å; M95-F253 VanDerWaalsContact CE-CE1 3.5Å; M95-F253 HydrophobicContact CE-CZ 3.45Å; M95-F253 VanDerWaalsContact CE-CZ 3.45Å; V249-F253 HydrophobicContact CG1-CD2 3.8Å; V249-F253 HydrophobicContact CG1-CE2 3.79Å; V249-F253 VanDerWaalsContact O-CD2 3.27Å; V249-F253 WeakPolarHBondContact O-CD2 3.46Å; V249-F253 PolarHBondContact O-N 2.88Å; V250-F253 PolarHBondContact O-N 2.98Å; D251-F253 VanDerWaalsContact C-N 3.31Å; D251-F253 PolarHBondContact O-N 2.95Å; F253-L271 HydrophobicContact CB-CD1 4.35Å; F253-L271 HydrophobicContact CD1-CD1 3.51Å; F253-L271 HydrophobicContact CE1-CD1 4.06Å; F253-L271 HydrophobicContact CG-CD1 4.11Å; F253-L274 HydrophobicContact CB-CD1 3.53Å; F253-L274 HydrophobicContact CD2-CD1 4.18Å; F253-L274 HydrophobicContact CG-CD1 4.01Å
254	T	91.3	Very high	90	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-117.5	-30.8	-177.1	58	0	0	0	0	114	V250 D251 V258 L274 R275 R278	V250-T254 HydrophobicContact CG1-CG2 4.18Å; V250-T254 WeakPolarHBondContact O-CB 3.1Å; V250-T254 VanDerWaalsContact O-CG2 3.28Å; V250-T254 WeakPolarHBondContact O-CG2 3.34Å; V250-T254 PolarHBondContact O-N 3.11Å; V250-T254 VanDerWaalsContact O-N 3.08Å; V250-T254 PolarHBondContact O-OG1 3Å; D251-T254 PolarHBondContact O-N 3.36Å; T254-V258 WeakPolarHBondContact O-CG2 3.24Å; T254-L274 HydrophobicContact CG2-CB 4.28Å; T254-R275 HydrophobicContact CG2-CG 3.7Å; T254-R278 PolarHBondContact OG1-NH2 3.43Å
255	V	93	Very high	89.5	Confident	7 Å²	7	35.3 Å²	35.3	4%	0.042	18%	0.177	C	C	.	.	S	Bend	trans	-86.8	-52.8	-175.1	173.9	0	0	0	0	113	N222 F225 L226 D251 V258 F259	N222-V255 HydrophobicContact CB-CG1 4.45Å; N222-V255 HydrophobicContact CB-CG2 4.27Å; F225-V255 HydrophobicContact CB-CG2 3.98Å; L226-V255 HydrophobicContact CB-CG1 4.22Å; D251-V255 WeakPolarHBondContact O-CB 3.2Å; D251-V255 PolarHBondContact O-N 3.41Å; V255-V258 PolarHBondContact O-N 2.64Å; V255-F259 HydrophobicContact CG1-CD2 4.15Å; V255-F259 HydrophobicContact CG1-CE2 3.55Å; V255-F259 HydrophobicContact CG1-CZ 4.49Å; V255-F259 WeakPolarHBondContact O-CD2 3.49Å
256	P	93.1	Very high	89.2	Confident	21 Å²	21	34.2 Å²	34.2	14%	0.136	17%	0.171	C	C	.	.	H	α-helix	trans	-57.2	-40.1	178	-22.3	32.3	0	0	0	115.3	T97 D251 F252 V258 F259 V260	T97-P256 HydrophobicContact CG2-CG 4.27Å; D251-P256 WeakPolarHBondContact O-CD 3.36Å; F252-P256 VanDerWaalsContact O-CD 3.23Å; F252-P256 WeakPolarHBondContact O-CD 3.49Å; F252-P256 WeakPolarHBondContact O-CG 3.32Å; P256-V258 VanDerWaalsContact C-N 3.26Å; P256-V258 PolarHBondContact O-N 2.74Å; P256-F259 PolarHBondContact O-N 2.94Å; P256-V260 PolarHBondContact O-N 2.87Å; P256-V260 VanDerWaalsContact O-N 3.11Å
257	P	90.7	Very high	89	Confident	16 Å²	16	30.7 Å²	30.7	10%	0.104	15%	0.15	C	C	.	.	H	α-helix	trans	-62.5	-28.2	177.3	-28	38.9	0	0	0	114.2	F90 S94 V260 S261	F90-P257 HydrophobicContact CB-CB 4.29Å; F90-P257 HydrophobicContact CD1-CB 4.24Å; F90-P257 WeakPolarHBondContact CD1-O 3.28Å; S94-P257 WeakPolarHBondContact OG-CD 3.24Å; S94-P257 VanDerWaalsContact OG-CG 3.32Å; S94-P257 WeakPolarHBondContact OG-CG 3.4Å; P257-V260 PolarHBondContact O-N 2.77Å; P257-S261 WeakPolarHBondContact O-CB 3.21Å; P257-S261 PolarHBondContact O-N 3.18Å
258	V	90.3	Very high	89	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.006	15%	0.147	C	C	.	.	H	α-helix	trans	-73	-38.7	177.6	175.1	0	0	0	0	110.8	D218 M219 N222 T254 V255 P256 V260 S261 V262	D218-V258 WeakPolarHBondContact OD2-CG2 3.44Å; M219-V258 HydrophobicContact SD-CG1 4.5Å; N222-V258 HydrophobicContact CB-CB 4.33Å; N222-V258 HydrophobicContact CB-CG1 4.25Å; T254-V258 WeakPolarHBondContact O-CG2 3.24Å; V255-V258 PolarHBondContact O-N 2.64Å; P256-V258 VanDerWaalsContact C-N 3.26Å; P256-V258 PolarHBondContact O-N 2.74Å; V258-V260 PolarHBondContact O-N 3.25Å; V258-S261 VanDerWaalsContact O-CB 3.3Å; V258-S261 WeakPolarHBondContact O-CB 3.4Å; V258-S261 PolarHBondContact O-N 3.34Å; V258-S261 VanDerWaalsContact O-N 3.15Å; V258-V262 PolarHBondContact O-N 3.34Å
259	F	90.3	Very high	88.8	Confident	71 Å²	71	31 Å²	31	31%	0.311	15%	0.15	S	C	.	.	H	α-helix	trans	-63.5	-39.8	171.2	-67.3	-61.3	0	0	0	112.3	M219 V223 L226 V255 P256 S261 V262 Y263	M219-F259 HydrophobicContact CE-CD1 3.79Å; M219-F259 HydrophobicContact CE-CE1 3.73Å; M219-F259 HydrophobicContact SD-CD1 3.85Å; M219-F259 HydrophobicContact SD-CE1 3.76Å; V223-F259 HydrophobicContact CG2-CE1 3.92Å; V223-F259 HydrophobicContact CG2-CZ 3.99Å; L226-F259 HydrophobicContact CD2-CE2 4Å; L226-F259 HydrophobicContact CD2-CZ 3.96Å; V255-F259 HydrophobicContact CG1-CD2 4.15Å; V255-F259 HydrophobicContact CG1-CE2 3.55Å; V255-F259 HydrophobicContact CG1-CZ 4.49Å; V255-F259 WeakPolarHBondContact O-CD2 3.49Å; P256-F259 PolarHBondContact O-N 2.94Å; F259-S261 VanDerWaalsContact C-N 3.31Å; F259-S261 PolarHBondContact O-N 3.21Å; F259-V262 PolarHBondContact O-N 3.37Å; F259-Y263 WeakPolarHBondContact O-CB 3.4Å; F259-Y263 PolarHBondContact O-N 2.95Å
260	V	89.4	Confident	88.6	Confident	26 Å²	26	29.1 Å²	29.1	16%	0.158	14%	0.139	C	C	.	.	H	α-helix	trans	-63.9	-36.9	171.8	175.4	0	0	0	0	111.4	F90 P256 P257 V258 Y263 L264	F90-V260 HydrophobicContact CD1-CB 4.1Å; F90-V260 HydrophobicContact CD1-CG1 3.84Å; F90-V260 HydrophobicContact CE1-CB 4.4Å; F90-V260 HydrophobicContact CE1-CG1 3.99Å; F90-V260 HydrophobicContact CG-CG1 4.15Å; F90-V260 HydrophobicContact CZ-CG1 4.41Å; P256-V260 PolarHBondContact O-N 2.87Å; P256-V260 VanDerWaalsContact O-N 3.11Å; P257-V260 PolarHBondContact O-N 2.77Å; V258-V260 PolarHBondContact O-N 3.25Å; V260-Y263 PolarHBondContact O-N 2.77Å; V260-L264 HydrophobicContact CG1-CD1 3.64Å; V260-L264 HydrophobicContact CG1-CG 4.1Å; V260-L264 WeakPolarHBondContact O-CB 3.48Å; V260-L264 WeakPolarHBondContact O-CG 3.49Å; V260-L264 PolarHBondContact O-N 3.44Å
261	S	86.6	Confident	88.5	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.1	-44.7	178.5	-170	0	0	0	0	112.8	P257 V258 F259 N265 R266 S267	P257-S261 WeakPolarHBondContact O-CB 3.21Å; P257-S261 PolarHBondContact O-N 3.18Å; V258-S261 VanDerWaalsContact O-CB 3.3Å; V258-S261 WeakPolarHBondContact O-CB 3.4Å; V258-S261 PolarHBondContact O-N 3.34Å; V258-S261 VanDerWaalsContact O-N 3.15Å; F259-S261 VanDerWaalsContact C-N 3.31Å; F259-S261 PolarHBondContact O-N 3.21Å; S261-N265 WeakPolarHBondContact O-CA 3.5Å; S261-N265 PolarHBondContact O-N 3.29Å; S261-R266 WeakPolarHBondContact CA-O 3.49Å; S261-R266 WeakPolarHBondContact CB-O 3.19Å; S261-R266 PolarHBondContact O-N 3.3Å; S261-R266 VanDerWaalsContact O-N 3.11Å; S261-R266 PolarHBondContact OG-O 3.22Å; S261-S267 WeakPolarHBondContact OG-CA 3.48Å
262	V	86.9	Confident	88.6	Confident	30 Å²	30	31.1 Å²	31.1	18%	0.182	15%	0.148	C	C	.	.	H	α-helix	trans	-67	-42.2	174.1	178.4	0	0	0	0	111.1	F209 L215 M219 V258 F259 L264 N265	F209-V262 HydrophobicContact CD2-CB 4.42Å; F209-V262 HydrophobicContact CD2-CG1 3.89Å; F209-V262 HydrophobicContact CD2-CG2 3.8Å; F209-V262 HydrophobicContact CE2-CG1 4.19Å; F209-V262 HydrophobicContact CE2-CG2 3.87Å; F209-V262 HydrophobicContact CG-CG1 4.15Å; L215-V262 HydrophobicContact CD1-CG2 4.34Å; L215-V262 HydrophobicContact CG-CG2 4.36Å; M219-V262 HydrophobicContact CB-CG2 4.45Å; M219-V262 HydrophobicContact CE-CG2 4.44Å; M219-V262 HydrophobicContact CG-CG2 4.33Å; M219-V262 HydrophobicContact SD-CG2 3.95Å; V258-V262 PolarHBondContact O-N 3.34Å; F259-V262 PolarHBondContact O-N 3.37Å; V262-L264 PolarHBondContact O-N 3.37Å; V262-N265 PolarHBondContact O-N 3.34Å
263	Y	87.2	Confident	88.6	Confident	198 Å²	198	31 Å²	31	78%	0.776	15%	0.147	S	C	*	.	H	α-helix	trans	-62.5	-39.2	178.8	-177.9	-104.6	0	0	0	113.1	F259 V260	F259-Y263 WeakPolarHBondContact O-CB 3.4Å; F259-Y263 PolarHBondContact O-N 2.95Å; V260-Y263 PolarHBondContact O-N 2.77Å
264	L	83.9	Confident	88.7	Confident	62 Å²	62	30.9 Å²	30.9	33%	0.325	15%	0.148	S	C	.	.	H	α-helix	trans	-91.8	-3.1	-179.7	-61.5	-178.9	0	0	0	114.3	A89 F90 V260 V262 R266	A89-L264 HydrophobicContact CB-CD1 4.36Å; F90-L264 HydrophobicContact CE2-CD1 4.33Å; F90-L264 HydrophobicContact CZ-CD1 4.33Å; V260-L264 HydrophobicContact CG1-CD1 3.64Å; V260-L264 HydrophobicContact CG1-CG 4.1Å; V260-L264 WeakPolarHBondContact O-CB 3.48Å; V260-L264 WeakPolarHBondContact O-CG 3.49Å; V260-L264 PolarHBondContact O-N 3.44Å; V262-L264 PolarHBondContact O-N 3.37Å; L264-R266 HydrophobicContact CB-CB 4.2Å; L264-R266 PolarHBondContact O-N 2.87Å
265	N	82.4	Confident	88.7	Confident	62 Å²	62	31 Å²	31	33%	0.332	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.5	39	-168.8	-73.7	-88.1	0	0	0	113.1	Q207 F209 S261 V262	Q207-N265 PolarHBondContact N-O 3.44Å; Q207-N265 CarbonylContact O-C 3.48Å; F209-N265 PolarHBondContact N-OD1 3.12Å; S261-N265 WeakPolarHBondContact O-CA 3.5Å; S261-N265 PolarHBondContact O-N 3.29Å; V262-N265 PolarHBondContact O-N 3.34Å
266	R	82.9	Confident	88.7	Confident	27 Å²	27	30.7 Å²	30.7	10%	0.102	15%	0.146	C	C	.	.			trans	-139.3	129.5	-174.3	-168	179.7	-54.5	-165.1	2.2	109.5	C79 Q84 F90 E204 S205 S261 L264	C79-R266 VanDerWaalsContact CB-NH2 3.34Å; C79-R266 PolarHBondContact O-NH2 3.39Å; Q84-R266 PolarHBondContact O-NH1 3.36Å; Q84-R266 VanDerWaalsContact O-NH1 3.12Å; F90-R266 HydrophobicContact CZ-CB 4.45Å; F90-R266 WeakPolarHBondContact CZ-O 3.36Å; E204-R266 HydrophobicContact CG-CG 4.15Å; E204-R266 WeakPolarHBondContact OE1-CD 3.5Å; E204-R266 IonicContact OE1-CZ 2.71Å; E204-R266 IonicContact OE1-NE 3.92Å; E204-R266 IonicContact OE1-NH1 3.96Å; E204-R266 PolarHBondContact OE1-NH1 2.89Å; S205-R266 CarbonylContact O-C 3.57Å; S205-R266 WeakPolarHBondContact O-CG 3.45Å; S261-R266 WeakPolarHBondContact CA-O 3.49Å; S261-R266 WeakPolarHBondContact CB-O 3.19Å; S261-R266 PolarHBondContact O-N 3.3Å; S261-R266 VanDerWaalsContact O-N 3.11Å; S261-R266 PolarHBondContact OG-O 3.22Å; L264-R266 HydrophobicContact CB-CB 4.2Å; L264-R266 PolarHBondContact O-N 2.87Å
267	S	84.1	Confident	88.7	Confident	8 Å²	8	31.1 Å²	31.1	6%	0.056	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	144.1	174.9	-169.5	0	0	0	0	111	E204 S205 Q207 S261 R272	E204-S267 WeakPolarHBondContact CA-O 3.48Å; S205-S267 PolarHBondContact N-O 2.91Å; S205-S267 PolarHBondContact O-N 3.16Å; Q207-S267 PolarHBondContact OE1-OG 3.25Å; S261-S267 WeakPolarHBondContact OG-CA 3.48Å; S267-R272 PolarHBondContact OG-NH2 3.42Å
268	W	87.6	Confident	88.7	Confident	22 Å²	22	31 Å²	31	8%	0.083	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	127.7	174.4	178.1	59.2	0	0	0	108.2	W87 F90 L91 I203 G270 R272	W87-W268 HydrophobicContact CB-CD2 4.42Å; W87-W268 HydrophobicContact CB-CZ2 4.17Å; F90-W268 HydrophobicContact CB-CD2 4.15Å; F90-W268 HydrophobicContact CB-CE3 3.3Å; F90-W268 HydrophobicContact CB-CZ3 3.6Å; F90-W268 HydrophobicContact CD1-CB 4.12Å; F90-W268 HydrophobicContact CD1-CE3 4.32Å; F90-W268 HydrophobicContact CD2-CB 4Å; F90-W268 HydrophobicContact CD2-CD2 4.4Å; F90-W268 HydrophobicContact CD2-CE3 4.33Å; F90-W268 HydrophobicContact CD2-CG 4.32Å; F90-W268 HydrophobicContact CE1-CB 4.04Å; F90-W268 HydrophobicContact CE2-CB 3.94Å; F90-W268 HydrophobicContact CG-CB 4.1Å; F90-W268 HydrophobicContact CG-CD2 4.27Å; F90-W268 AromaticContact CG-CE3 3.77Å; F90-W268 HydrophobicContact CG-CE3 3.77Å; F90-W268 HydrophobicContact CG-CG 4.46Å; F90-W268 HydrophobicContact CZ-CB 3.96Å; L91-W268 HydrophobicContact CB-CH2 4.23Å; I203-W268 WeakPolarHBondContact O-CA 3.32Å; W268-G270 VanDerWaalsContact CZ2-CA 3.44Å; W268-R272 PolarHBondContact O-NE 3.27Å
269	L	85.9	Confident	88.6	Confident	10 Å²	10	32.5 Å²	32.5	5%	0.052	15%	0.152	C	C	.	.			trans	-68.2	-47.8	-178.6	-172.3	68.3	0	0	0	110.8	Y195 D198 I203 L271 R272	Y195-L269 HydrophobicContact CD2-CD1 3.76Å; Y195-L269 HydrophobicContact CE2-CD1 3.63Å; Y195-L269 HydrophobicContact CE2-CD2 4.47Å; Y195-L269 HydrophobicContact CE2-CG 4.01Å; D198-L269 HydrophobicContact CB-CD1 3.75Å; I203-L269 PolarHBondContact O-N 3.11Å; L269-L271 PolarHBondContact O-N 3.28Å; L269-R272 WeakPolarHBondContact O-CB 3.33Å; L269-R272 WeakPolarHBondContact O-CD 3.47Å; L269-R272 WeakPolarHBondContact O-CG 3.06Å; L269-R272 PolarHBondContact O-N 2.99Å; L269-R272 VanDerWaalsContact O-N 3.14Å
270	G	86.6	Confident	88.6	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.01	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	41.2	-131.4	167.5	0	0	0	0	0	115.6	W268 R272 F273	W268-G270 VanDerWaalsContact CZ2-CA 3.44Å; G270-R272 VanDerWaalsContact C-N 3.27Å; G270-R272 PolarHBondContact O-N 3.23Å; G270-F273 WeakPolarHBondContact O-CD1 3.47Å; G270-F273 WeakPolarHBondContact O-CE1 3.42Å
271	L	91.5	Very high	88.4	Confident	34 Å²	34	31.2 Å²	31.2	18%	0.178	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-85.6	15.2	-177.5	-58.5	178	0	0	0	114	L91 F253 L269 F273 L274 L320	L91-L271 HydrophobicContact CD1-CD1 3.86Å; F253-L271 HydrophobicContact CB-CD1 4.35Å; F253-L271 HydrophobicContact CD1-CD1 3.51Å; F253-L271 HydrophobicContact CE1-CD1 4.06Å; F253-L271 HydrophobicContact CG-CD1 4.11Å; L269-L271 PolarHBondContact O-N 3.28Å; L271-F273 HydrophobicContact CD2-CE1 3.78Å; L271-F273 HydrophobicContact CD2-CZ 3.73Å; L271-F273 PolarHBondContact O-N 3.03Å; L271-F273 VanDerWaalsContact O-N 3.08Å; L271-L274 HydrophobicContact CB-CD1 3.98Å; L271-L274 HydrophobicContact CB-CG 4.44Å; L271-L274 WeakPolarHBondContact O-CB 3.31Å; L271-L274 WeakPolarHBondContact O-CG 3.13Å; L271-L274 PolarHBondContact O-N 3.02Å; L271-L320 HydrophobicContact CD2-CD2 4.16Å
272	R	92.1	Very high	88.4	Confident	18 Å²	18	34.5 Å²	34.5	7%	0.068	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-56.6	-26.3	178.5	-71	175.7	-170.5	-120.5	-12.5	112.8	Y195 D198 D218 S267 W268 L269 G270 L274 R275	Y195-R272 HydrophobicContact CD2-CB 3.53Å; Y195-R272 HydrophobicContact CE2-CB 4.22Å; Y195-R272 HydrophobicContact CG-CB 4.27Å; D198-R272 IonicContact OD2-CZ 2.73Å; D198-R272 IonicContact OD2-NE 3.88Å; D198-R272 IonicContact OD2-NH1 3.98Å; D198-R272 PolarHBondContact OD2-NH1 3.01Å; D218-R272 IonicContact OD2-CZ 2.77Å; D218-R272 IonicContact OD2-NH1 3.76Å; D218-R272 PolarHBondContact OD2-NH1 3.31Å; S267-R272 PolarHBondContact OG-NH2 3.42Å; W268-R272 PolarHBondContact O-NE 3.27Å; L269-R272 WeakPolarHBondContact O-CB 3.33Å; L269-R272 WeakPolarHBondContact O-CD 3.47Å; L269-R272 WeakPolarHBondContact O-CG 3.06Å; L269-R272 PolarHBondContact O-N 2.99Å; L269-R272 VanDerWaalsContact O-N 3.14Å; G270-R272 VanDerWaalsContact C-N 3.27Å; G270-R272 PolarHBondContact O-N 3.23Å; R272-L274 PolarHBondContact O-N 3.41Å; R272-R275 VanDerWaalsContact O-CB 3.31Å; R272-R275 WeakPolarHBondContact O-CB 3.22Å; R272-R275 WeakPolarHBondContact O-CD 3.5Å; R272-R275 WeakPolarHBondContact O-CG 3.5Å; R272-R275 PolarHBondContact O-N 2.73Å; R272-R275 VanDerWaalsContact O-N 3.13Å
273	F	92.8	Very high	88.4	Confident	5 Å²	5	33.5 Å²	33.5	2%	0.022	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-60.2	-23.8	176.3	64	-97.3	0	0	0	114.3	Y195 G270 L271 R275 A276 T313 G316 F317 L320	Y195-F273 HydrophobicContact CE1-CB 3.85Å; Y195-F273 HydrophobicContact CE2-CB 4Å; G270-F273 WeakPolarHBondContact O-CD1 3.47Å; G270-F273 WeakPolarHBondContact O-CE1 3.42Å; L271-F273 HydrophobicContact CD2-CE1 3.78Å; L271-F273 HydrophobicContact CD2-CZ 3.73Å; L271-F273 PolarHBondContact O-N 3.03Å; L271-F273 VanDerWaalsContact O-N 3.08Å; F273-R275 PolarHBondContact O-N 3.38Å; F273-A276 WeakPolarHBondContact O-CB 3.4Å; F273-A276 PolarHBondContact O-N 3.4Å; F273-T313 HydrophobicContact CD2-CG2 3.9Å; F273-T313 WeakPolarHBondContact CD2-O 3.43Å; F273-T313 HydrophobicContact CE2-CG2 4.1Å; F273-G316 WeakPolarHBondContact CD1-O 3.47Å; F273-F317 HydrophobicContact CE2-CB 4Å; F273-F317 HydrophobicContact CE2-CD2 4.48Å; F273-F317 HydrophobicContact CZ-CB 3.98Å; F273-F317 AromaticContact CZ-CD2 3.96Å; F273-F317 HydrophobicContact CZ-CD2 3.96Å; F273-F317 HydrophobicContact CZ-CG 4.46Å; F273-L320 HydrophobicContact CE1-CB 4.29Å; F273-L320 HydrophobicContact CE1-CD2 4.01Å
274	L	93.3	Very high	88.3	Confident	28 Å²	28	28.4 Å²	28.4	15%	0.147	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-61.3	-16.5	176.2	-65.6	175.7	0	0	0	112.8	V250 F253 T254 L271 R272 A276 L277 T313	V250-L274 HydrophobicContact CG1-CB 4.49Å; V250-L274 WeakPolarHBondContact CG1-O 3.25Å; F253-L274 HydrophobicContact CB-CD1 3.53Å; F253-L274 HydrophobicContact CD2-CD1 4.18Å; F253-L274 HydrophobicContact CG-CD1 4.01Å; T254-L274 HydrophobicContact CG2-CB 4.28Å; L271-L274 HydrophobicContact CB-CD1 3.98Å; L271-L274 HydrophobicContact CB-CG 4.44Å; L271-L274 WeakPolarHBondContact O-CB 3.31Å; L271-L274 WeakPolarHBondContact O-CG 3.13Å; L271-L274 PolarHBondContact O-N 3.02Å; R272-L274 PolarHBondContact O-N 3.41Å; L274-A276 PolarHBondContact O-N 3.46Å; L274-L277 HydrophobicContact CD2-CD1 4.03Å; L274-L277 WeakPolarHBondContact O-CB 3.29Å; L274-L277 PolarHBondContact O-N 3.42Å; L274-T313 HydrophobicContact CD2-CG2 3.95Å
275	R	92.9	Very high	88.3	Confident	3 Å²	3	26 Å²	26	1%	0.011	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-54.9	-28.7	169.3	-66.3	171.7	-177.7	-168.5	-0.8	112.4	A191 L192 D218 N222 T254 R272 F273 L277 R278	A191-R275 VanDerWaalsContact O-CD 3.24Å; A191-R275 WeakPolarHBondContact O-CD 3.17Å; A191-R275 PolarHBondContact O-NH1 3.24Å; L192-R275 HydrophobicContact CD1-CB 4.5Å; D218-R275 VanDerWaalsContact CG-NH2 3.28Å; D218-R275 IonicContact OD1-CZ 2.96Å; D218-R275 IonicContact OD1-NH1 3.45Å; D218-R275 PolarHBondContact OD1-NH1 3.37Å; D218-R275 IonicContact OD1-NH2 2.8Å; D218-R275 PolarHBondContact OD1-NH2 3.38Å; D218-R275 IonicContact OD2-CZ 3.92Å; D218-R275 IonicContact OD2-NH1 2.8Å; D218-R275 IonicContact OD2-NH2 3.7Å; D218-R275 PolarHBondContact OD2-NH2 2.81Å; N222-R275 PolarHBondContact ND2-NH2 3.26Å; T254-R275 HydrophobicContact CG2-CG 3.7Å; R272-R275 VanDerWaalsContact O-CB 3.31Å; R272-R275 WeakPolarHBondContact O-CB 3.22Å; R272-R275 WeakPolarHBondContact O-CD 3.5Å; R272-R275 WeakPolarHBondContact O-CG 3.5Å; R272-R275 PolarHBondContact O-N 2.73Å; R272-R275 VanDerWaalsContact O-N 3.13Å; F273-R275 PolarHBondContact O-N 3.38Å; R275-L277 VanDerWaalsContact C-N 3.25Å; R275-L277 PolarHBondContact O-N 3.46Å; R275-R278 WeakPolarHBondContact O-CB 3.38Å; R275-R278 PolarHBondContact O-N 2.84Å; R275-R278 VanDerWaalsContact O-N 3.15Å
276	A	92.7	Very high	88.5	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.008	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-63.9	-26.3	175.8	0	0	0	0	0	113.4	L192 F273 L274 R278 L279 S309 L312	L192-A276 HydrophobicContact CD1-CB 3.9Å; L192-A276 HydrophobicContact CD2-CB 4.41Å; F273-A276 WeakPolarHBondContact O-CB 3.4Å; F273-A276 PolarHBondContact O-N 3.4Å; L274-A276 PolarHBondContact O-N 3.46Å; A276-R278 VanDerWaalsContact C-N 3.26Å; A276-R278 PolarHBondContact O-N 3.18Å; A276-L279 VanDerWaalsContact O-CB 3.31Å; A276-L279 WeakPolarHBondContact O-CB 3.21Å; A276-L279 WeakPolarHBondContact O-CG 3.38Å; A276-L279 PolarHBondContact O-N 2.95Å; A276-S309 WeakPolarHBondContact O-CB 3.27Å; A276-L312 HydrophobicContact CB-CB 3.92Å
277	L	92.5	Very high	88.6	Confident	30 Å²	30	27.6 Å²	27.6	16%	0.157	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-67.6	-23.1	174.9	-66.1	178.3	0	0	0	112.9	V246 V250 L274 R275 L279 I280 T313	V246-L277 HydrophobicContact CG1-CD1 4.44Å; V250-L277 HydrophobicContact CG2-CB 3.76Å; V250-L277 HydrophobicContact CG2-CD1 3.96Å; V250-L277 HydrophobicContact CG2-CG 4.47Å; L274-L277 HydrophobicContact CD2-CD1 4.03Å; L274-L277 WeakPolarHBondContact O-CB 3.29Å; L274-L277 PolarHBondContact O-N 3.42Å; R275-L277 VanDerWaalsContact C-N 3.25Å; R275-L277 PolarHBondContact O-N 3.46Å; L277-L279 PolarHBondContact O-N 3.3Å; L277-L279 VanDerWaalsContact O-N 3.15Å; L277-I280 HydrophobicContact CD2-CD1 4.21Å; L277-I280 WeakPolarHBondContact O-CB 3.4Å; L277-I280 VanDerWaalsContact O-CG1 3.27Å; L277-I280 WeakPolarHBondContact O-CG1 3.42Å; L277-I280 PolarHBondContact O-N 2.94Å; L277-I280 VanDerWaalsContact O-N 3.08Å; L277-T313 HydrophobicContact CD1-CG2 4.17Å; L277-T313 HydrophobicContact CD2-CG2 3.99Å; L277-T313 VanDerWaalsContact CD2-OG1 3.31Å; L277-T313 WeakPolarHBondContact CD2-OG1 3.43Å; L277-T313 HydrophobicContact CG-CG2 3.89Å; L277-T313 WeakPolarHBondContact CG-OG1 3.23Å
278	R	90.1	Very high	88.6	Confident	14 Å²	14	30.6 Å²	30.6	5%	0.053	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-63.9	-17.4	173.9	-63.4	-162.6	-175.7	130.1	-0.5	112.9	S188 F225 V250 D251 T254 R275 A276 I280 Q281	S188-R278 WeakPolarHBondContact OG-CD 3.42Å; F225-R278 VanDerWaalsContact CD2-NH1 3.26Å; V250-R278 HydrophobicContact CG1-CG 3.88Å; D251-R278 IonicContact OD1-CZ 2.67Å; D251-R278 IonicContact OD1-NE 2.9Å; D251-R278 PolarHBondContact OD1-NE 3.45Å; D251-R278 IonicContact OD1-NH2 2.8Å; D251-R278 PolarHBondContact OD1-NH2 3.14Å; T254-R278 PolarHBondContact OG1-NH2 3.43Å; R275-R278 WeakPolarHBondContact O-CB 3.38Å; R275-R278 PolarHBondContact O-N 2.84Å; R275-R278 VanDerWaalsContact O-N 3.15Å; A276-R278 VanDerWaalsContact C-N 3.26Å; A276-R278 PolarHBondContact O-N 3.18Å; R278-I280 PolarHBondContact O-N 2.99Å; R278-Q281 PolarHBondContact O-N 2.95Å
279	L	89.4	Confident	88.2	Confident	32 Å²	32	31.9 Å²	31.9	17%	0.168	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-60.4	-28.7	172.8	-64.7	176.9	0	0	0	112	I189 L192 A276 L277 Q281 F282 S305 I308 L312	I189-L279 HydrophobicContact CG1-CD2 4.39Å; L192-L279 HydrophobicContact CD2-CD1 3.96Å; L192-L279 HydrophobicContact CD2-CD2 4.46Å; L192-L279 HydrophobicContact CD2-CG 4.3Å; A276-L279 VanDerWaalsContact O-CB 3.31Å; A276-L279 WeakPolarHBondContact O-CB 3.21Å; A276-L279 WeakPolarHBondContact O-CG 3.38Å; A276-L279 PolarHBondContact O-N 2.95Å; L277-L279 PolarHBondContact O-N 3.3Å; L277-L279 VanDerWaalsContact O-N 3.15Å; L279-Q281 PolarHBondContact O-N 2.82Å; L279-Q281 VanDerWaalsContact O-N 3.1Å; L279-F282 WeakPolarHBondContact O-CB 2.99Å; L279-F282 PolarHBondContact O-N 3.33Å; L279-S305 PolarHBondContact O-OG 3.11Å; L279-I308 HydrophobicContact CD1-CG2 4.16Å; L279-L312 HydrophobicContact CD1-CD1 4.16Å
280	I	89.4	Confident	88	Confident	51 Å²	51	36 Å²	36	26%	0.262	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-49.8	-42	180	-65.7	172	0	0	0	111.4	L277 R278 F282 S283 S305 S309	L277-I280 HydrophobicContact CD2-CD1 4.21Å; L277-I280 WeakPolarHBondContact O-CB 3.4Å; L277-I280 VanDerWaalsContact O-CG1 3.27Å; L277-I280 WeakPolarHBondContact O-CG1 3.42Å; L277-I280 PolarHBondContact O-N 2.94Å; L277-I280 VanDerWaalsContact O-N 3.08Å; R278-I280 PolarHBondContact O-N 2.99Å; I280-F282 PolarHBondContact O-N 2.72Å; I280-F282 VanDerWaalsContact O-N 3.1Å; I280-S283 PolarHBondContact O-OG 3.03Å; I280-S305 VanDerWaalsContact CA-OG 3.25Å; I280-S305 WeakPolarHBondContact CA-OG 3.06Å; I280-S305 PolarHBondContact O-OG 3.27Å; I280-S309 WeakPolarHBondContact CG1-OG 3.25Å
281	Q	86.4	Confident	88	Confident	20 Å²	20	41.1 Å²	41.1	9%	0.093	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-66.5	-8.3	-179.7	-60.6	-172.2	-50.9	0	0	114.5	N247 R278 L279 S283 E284 I285	N247-Q281 VanDerWaalsContact CG-NE2 3.34Å; N247-Q281 PolarHBondContact ND2-NE2 2.81Å; R278-Q281 PolarHBondContact O-N 2.95Å; L279-Q281 PolarHBondContact O-N 2.82Å; L279-Q281 VanDerWaalsContact O-N 3.1Å; Q281-S283 VanDerWaalsContact C-N 3.33Å; Q281-S283 PolarHBondContact O-N 2.79Å; Q281-E284 PolarHBondContact O-N 3.12Å; Q281-I285 HydrophobicContact CB-CD1 3.84Å; Q281-I285 HydrophobicContact CB-CG1 4.34Å; Q281-I285 WeakPolarHBondContact O-CB 3.37Å; Q281-I285 WeakPolarHBondContact O-CG1 3.14Å; Q281-I285 PolarHBondContact O-N 2.99Å
282	F	85.6	Confident	87.8	Confident	68 Å²	68	40.6 Å²	40.6	30%	0.298	20%	0.199	S	C	.	.	H	α-helix	trans	-58.8	-38.5	-175.8	179.9	-139.9	0	0	0	113.8	F185 L279 I280 L286 V301	F185-F282 HydrophobicContact CD2-CD2 4.08Å; F185-F282 HydrophobicContact CE1-CD2 4.25Å; F185-F282 AromaticContact CE1-CE2 3.99Å; F185-F282 HydrophobicContact CE1-CE2 3.99Å; F185-F282 HydrophobicContact CE2-CB 4.16Å; F185-F282 AromaticContact CE2-CD2 3.19Å; F185-F282 HydrophobicContact CE2-CD2 3.19Å; F185-F282 AromaticContact CE2-CE2 3.71Å; F185-F282 HydrophobicContact CE2-CE2 3.71Å; F185-F282 AromaticContact CE2-CG 3.9Å; F185-F282 HydrophobicContact CE2-CG 3.9Å; F185-F282 AromaticContact CZ-CD2 3.29Å; F185-F282 HydrophobicContact CZ-CD2 3.29Å; F185-F282 AromaticContact CZ-CE2 3.23Å; F185-F282 HydrophobicContact CZ-CE2 3.23Å; F185-F282 HydrophobicContact CZ-CG 4.25Å; F185-F282 HydrophobicContact CZ-CZ 4.16Å; L279-F282 WeakPolarHBondContact O-CB 2.99Å; L279-F282 PolarHBondContact O-N 3.33Å; I280-F282 PolarHBondContact O-N 2.72Å; I280-F282 VanDerWaalsContact O-N 3.1Å; F282-L286 HydrophobicContact CD1-CD1 4.37Å; F282-L286 HydrophobicContact CD2-CD1 3.76Å; F282-L286 HydrophobicContact CD2-CG 3.87Å; F282-L286 HydrophobicContact CE1-CD1 4.02Å; F282-L286 HydrophobicContact CE2-CD1 3.36Å; F282-L286 HydrophobicContact CE2-CD2 4.09Å; F282-L286 HydrophobicContact CE2-CG 3.67Å; F282-L286 HydrophobicContact CG-CD1 4.27Å; F282-L286 HydrophobicContact CZ-CD1 3.52Å; F282-L286 HydrophobicContact CZ-CG 4.33Å; F282-L286 WeakPolarHBondContact O-CB 3.36Å; F282-L286 VanDerWaalsContact O-CG 3.31Å; F282-L286 WeakPolarHBondContact O-CG 3.4Å; F282-L286 PolarHBondContact O-N 3.44Å; F282-V301 HydrophobicContact CD1-CG1 3.89Å; F282-V301 HydrophobicContact CE1-CG1 4.11Å
283	S	86.5	Confident	87.4	Confident	10 Å²	10	47.7 Å²	47.7	7%	0.07	23%	0.231	C	C	.	.	H	α-helix	trans	-64.2	-46.7	176.5	48.5	0	0	0	0	111.7	I280 Q281 L286 Q287 N302	I280-S283 PolarHBondContact O-OG 3.03Å; Q281-S283 VanDerWaalsContact C-N 3.33Å; Q281-S283 PolarHBondContact O-N 2.79Å; S283-L286 PolarHBondContact O-N 2.86Å; S283-Q287 WeakPolarHBondContact O-CB 3.34Å; S283-Q287 PolarHBondContact O-N 3.31Å; S283-N302 PolarHBondContact OG-OD1 3.04Å
284	E	85.1	Confident	87	Confident	91 Å²	91	51.3 Å²	51.3	43%	0.425	25%	0.253	S	S	.	.	H	α-helix	trans	-64	-45.9	177.2	-175.6	179.5	-161.3	0	0	111.8	Q281 L286 Q287 F288	Q281-E284 PolarHBondContact O-N 3.12Å; E284-L286 PolarHBondContact O-N 3.48Å; E284-Q287 WeakPolarHBondContact O-CB 3.37Å; E284-Q287 PolarHBondContact O-N 2.92Å; E284-Q287 VanDerWaalsContact O-N 3.13Å; E284-F288 HydrophobicContact CG-CD2 4.24Å; E284-F288 HydrophobicContact CG-CE1 4.27Å; E284-F288 HydrophobicContact CG-CE2 3.57Å; E284-F288 HydrophobicContact CG-CZ 3.57Å; E284-F288 WeakPolarHBondContact O-CG 3.45Å; E284-F288 PolarHBondContact O-N 3.44Å; E284-F288 WeakPolarHBondContact OE1-CZ 3.38Å
285	I	85.2	Confident	86.7	Confident	11 Å²	11	54.4 Å²	54.4	6%	0.056	28%	0.277	C	S	.	.	H	α-helix	trans	-60.4	-45.4	177.1	-71.3	169.6	0	0	0	111.3	V181 F185 Q281 Q287 F288 L289	V181-I285 HydrophobicContact CG1-CB 4.29Å; V181-I285 HydrophobicContact CG1-CG1 4.03Å; V181-I285 HydrophobicContact CG1-CG2 3.79Å; F185-I285 HydrophobicContact CB-CD1 4.2Å; F185-I285 HydrophobicContact CB-CG2 4.18Å; F185-I285 HydrophobicContact CD2-CD1 4.27Å; F185-I285 HydrophobicContact CG-CG2 4.35Å; Q281-I285 HydrophobicContact CB-CD1 3.84Å; Q281-I285 HydrophobicContact CB-CG1 4.34Å; Q281-I285 WeakPolarHBondContact O-CB 3.37Å; Q281-I285 WeakPolarHBondContact O-CG1 3.14Å; Q281-I285 PolarHBondContact O-N 2.99Å; I285-Q287 VanDerWaalsContact C-N 3.29Å; I285-Q287 PolarHBondContact O-N 2.81Å; I285-F288 PolarHBondContact O-N 2.74Å; I285-L289 HydrophobicContact CG2-CD1 4.17Å; I285-L289 VanDerWaalsContact O-CG 3.32Å; I285-L289 WeakPolarHBondContact O-CG 3.17Å; I285-L289 PolarHBondContact O-N 2.96Å
286	L	85.6	Confident	86.4	Confident	26 Å²	26	58.6 Å²	58.6	14%	0.136	30%	0.3	C	S	.	.	H	α-helix	trans	-68	-27.6	176.3	-75.8	174.7	0	0	0	113.3	F282 S283 E284 N290 I291 L292 V301	F282-L286 HydrophobicContact CD1-CD1 4.37Å; F282-L286 HydrophobicContact CD2-CD1 3.76Å; F282-L286 HydrophobicContact CD2-CG 3.87Å; F282-L286 HydrophobicContact CE1-CD1 4.02Å; F282-L286 HydrophobicContact CE2-CD1 3.36Å; F282-L286 HydrophobicContact CE2-CD2 4.09Å; F282-L286 HydrophobicContact CE2-CG 3.67Å; F282-L286 HydrophobicContact CG-CD1 4.27Å; F282-L286 HydrophobicContact CZ-CD1 3.52Å; F282-L286 HydrophobicContact CZ-CG 4.33Å; F282-L286 WeakPolarHBondContact O-CB 3.36Å; F282-L286 VanDerWaalsContact O-CG 3.31Å; F282-L286 WeakPolarHBondContact O-CG 3.4Å; F282-L286 PolarHBondContact O-N 3.44Å; S283-L286 PolarHBondContact O-N 2.86Å; E284-L286 PolarHBondContact O-N 3.48Å; L286-N290 PolarHBondContact O-N 3.14Å; L286-I291 HydrophobicContact CD2-CB 4.18Å; L286-I291 HydrophobicContact CD2-CD1 3.71Å; L286-I291 HydrophobicContact CD2-CG2 4.17Å; L286-I291 PolarHBondContact O-N 2.74Å; L286-L292 HydrophobicContact CB-CD1 3.58Å; L286-L292 HydrophobicContact CB-CG 3.8Å; L286-L292 HydrophobicContact CD1-CD1 3.92Å; L286-L292 HydrophobicContact CD1-CG 4.29Å; L286-L292 HydrophobicContact CG-CD1 4.44Å; L286-L292 PolarHBondContact O-N 3.1Å; L286-V301 HydrophobicContact CD1-CG1 4.08Å
287	Q	85.8	Confident	86.1	Confident	97 Å²	97	60 Å²	60	45%	0.453	31%	0.31	S	S	.	.	H	α-helix	trans	-71.7	-45	172.9	-174.3	177.5	-7.4	0	0	111.1	S283 E284 I285 L289 N290	S283-Q287 WeakPolarHBondContact O-CB 3.34Å; S283-Q287 PolarHBondContact O-N 3.31Å; E284-Q287 WeakPolarHBondContact O-CB 3.37Å; E284-Q287 PolarHBondContact O-N 2.92Å; E284-Q287 VanDerWaalsContact O-N 3.13Å; I285-Q287 VanDerWaalsContact C-N 3.29Å; I285-Q287 PolarHBondContact O-N 2.81Å; Q287-L289 VanDerWaalsContact C-N 3.25Å; Q287-L289 PolarHBondContact O-N 3.16Å; Q287-N290 WeakPolarHBondContact O-CA 3.45Å; Q287-N290 PolarHBondContact O-N 2.82Å
288	F	82.9	Confident	86	Confident	70 Å²	70	60.8 Å²	60.8	31%	0.307	31%	0.314	S	S	.	.	H	α-helix	trans	-58.7	-36	173.2	-68.9	-25.3	0	0	0	112.9	A172 E284 I285 N290	A172-F288 HydrophobicContact CB-CB 3.78Å; A172-F288 HydrophobicContact CB-CD2 4.45Å; A172-F288 HydrophobicContact CB-CG 4.17Å; E284-F288 HydrophobicContact CG-CD2 4.24Å; E284-F288 HydrophobicContact CG-CE1 4.27Å; E284-F288 HydrophobicContact CG-CE2 3.57Å; E284-F288 HydrophobicContact CG-CZ 3.57Å; E284-F288 WeakPolarHBondContact O-CG 3.45Å; E284-F288 PolarHBondContact O-N 3.44Å; E284-F288 WeakPolarHBondContact OE1-CZ 3.38Å; I285-F288 PolarHBondContact O-N 2.74Å; F288-N290 PolarHBondContact O-N 2.67Å; F288-N290 PolarHBondContact O-ND2 3.42Å
289	L	79.7	Confident	86.1	Confident	50 Å²	50	64.5 Å²	64.5	26%	0.262	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	1.7	174.1	-63.8	171.8	0	0	0	113.9	R178 V182 I285 Q287 I291	R178-L289 HydrophobicContact CB-CD2 4.36Å; V182-L289 HydrophobicContact CG2-CD1 3.8Å; V182-L289 HydrophobicContact CG2-CD2 3.77Å; V182-L289 HydrophobicContact CG2-CG 4.43Å; I285-L289 HydrophobicContact CG2-CD1 4.17Å; I285-L289 VanDerWaalsContact O-CG 3.32Å; I285-L289 WeakPolarHBondContact O-CG 3.17Å; I285-L289 PolarHBondContact O-N 2.96Å; Q287-L289 VanDerWaalsContact C-N 3.25Å; Q287-L289 PolarHBondContact O-N 3.16Å; L289-I291 HydrophobicContact CB-CD1 3.9Å; L289-I291 HydrophobicContact CB-CG1 4.13Å; L289-I291 HydrophobicContact CD1-CD1 4.37Å; L289-I291 PolarHBondContact O-N 3.3Å
290	N	81.9	Confident	86.2	Confident	95 Å²	95	64.7 Å²	64.7	51%	0.508	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.8	24.5	-178.5	-72.3	-98.2	0	0	0	114.3	L286 Q287 F288 K293	L286-N290 PolarHBondContact O-N 3.14Å; Q287-N290 WeakPolarHBondContact O-CA 3.45Å; Q287-N290 PolarHBondContact O-N 2.82Å; F288-N290 PolarHBondContact O-N 2.67Å; F288-N290 PolarHBondContact O-ND2 3.42Å; N290-K293 WeakPolarHBondContact O-CE 3.49Å
291	I	86.7	Confident	86.3	Confident	110 Å²	110	63.5 Å²	63.5	56%	0.564	33%	0.326	S	S	*	.			trans	-81.1	-46.1	177.1	-65.4	167.6	0	0	0	109.6	L286 L289	L286-I291 HydrophobicContact CD2-CB 4.18Å; L286-I291 HydrophobicContact CD2-CD1 3.71Å; L286-I291 HydrophobicContact CD2-CG2 4.17Å; L286-I291 PolarHBondContact O-N 2.74Å; L289-I291 HydrophobicContact CB-CD1 3.9Å; L289-I291 HydrophobicContact CB-CG1 4.13Å; L289-I291 HydrophobicContact CD1-CD1 4.37Å; L289-I291 PolarHBondContact O-N 3.3Å
292	L	87.5	Confident	86.6	Confident	22 Å²	22	65.5 Å²	65.5	12%	0.115	34%	0.337	C	S	.	.			trans	-88.7	112.1	174.5	-61.7	173.7	0	0	0	110.2	L286 I298 V301	L286-L292 HydrophobicContact CB-CD1 3.58Å; L286-L292 HydrophobicContact CB-CG 3.8Å; L286-L292 HydrophobicContact CD1-CD1 3.92Å; L286-L292 HydrophobicContact CD1-CG 4.29Å; L286-L292 HydrophobicContact CG-CD1 4.44Å; L286-L292 PolarHBondContact O-N 3.1Å; L292-I298 HydrophobicContact CB-CG1 3.73Å; L292-V301 HydrophobicContact CD1-CB 3.86Å; L292-V301 HydrophobicContact CD1-CG1 4.05Å; L292-V301 HydrophobicContact CD1-CG2 3.96Å; L292-V301 HydrophobicContact CD2-CG2 3.91Å
293	K	83.9	Confident	86.9	Confident	168 Å²	168	62.8 Å²	62.8	73%	0.73	33%	0.326	S	S	*	.			trans	-114.4	-18	-175.9	-61.8	-174.9	-177.3	-179.4	0	114.9	N290	N290-K293 WeakPolarHBondContact O-CE 3.49Å
294	T	84.6	Confident	87.2	Confident	80 Å²	80	65.3 Å²	65.3	49%	0.491	34%	0.338	S	S	.	.	S	Bend	trans	-108.3	145.3	-177.6	76.5	0	0	0	0	110.9	N296 S297 I298	T294-N296 VanDerWaalsContact C-N 3.28Å; T294-N296 PolarHBondContact O-N 3.1Å; T294-S297 PolarHBondContact N-OG 3.1Å; T294-S297 VanDerWaalsContact N-OG 3.14Å; T294-S297 PolarHBondContact O-N 2.88Å; T294-S297 VanDerWaalsContact O-N 3.08Å; T294-S297 PolarHBondContact O-OG 2.6Å; T294-S297 VanDerWaalsContact OG1-CB 3.28Å; T294-S297 WeakPolarHBondContact OG1-CB 3.49Å; T294-S297 PolarHBondContact OG1-N 2.81Å; T294-S297 VanDerWaalsContact OG1-N 3.13Å; T294-S297 PolarHBondContact OG1-OG 3.23Å; T294-I298 WeakPolarHBondContact O-CG1 3.32Å; T294-I298 PolarHBondContact O-N 3.04Å
295	S	87.3	Confident	87.5	Confident	94 Å²	94	61.3 Å²	61.3	66%	0.657	32%	0.32	S	S	*	.	H	α-helix	trans	-52.6	-47.3	177.1	-173.8	0	0	0	0	111.6	S297 I298 K299	S295-S297 PolarHBondContact O-N 2.89Å; S295-I298 PolarHBondContact O-N 3.29Å; S295-K299 WeakPolarHBondContact O-CB 3.06Å; S295-K299 PolarHBondContact O-N 3.04Å
296	N	85.6	Confident	87.9	Confident	90 Å²	90	62.7 Å²	62.7	48%	0.481	33%	0.328	S	S	.	.	H	α-helix	trans	-58.9	-43.5	177.7	-62.1	23.1	0	0	0	112.1	T294 L300 L390	T294-N296 VanDerWaalsContact C-N 3.28Å; T294-N296 PolarHBondContact O-N 3.1Å; N296-L300 VanDerWaalsContact O-CB 3.22Å; N296-L300 WeakPolarHBondContact O-CB 2.99Å; N296-L300 PolarHBondContact O-N 3.21Å; N296-L390 HydrophobicContact CB-CD2 4.04Å
297	S	87.4	Confident	88.2	Confident	32 Å²	32	62.7 Å²	62.7	22%	0.224	33%	0.327	C	S	.	.	H	α-helix	trans	-67.6	-37.1	177.5	60.9	0	0	0	0	113.2	T294 S295 V301	T294-S297 PolarHBondContact N-OG 3.1Å; T294-S297 VanDerWaalsContact N-OG 3.14Å; T294-S297 PolarHBondContact O-N 2.88Å; T294-S297 VanDerWaalsContact O-N 3.08Å; T294-S297 PolarHBondContact O-OG 2.6Å; T294-S297 VanDerWaalsContact OG1-CB 3.28Å; T294-S297 WeakPolarHBondContact OG1-CB 3.49Å; T294-S297 PolarHBondContact OG1-N 2.81Å; T294-S297 VanDerWaalsContact OG1-N 3.13Å; T294-S297 PolarHBondContact OG1-OG 3.23Å; S295-S297 PolarHBondContact O-N 2.89Å; S297-V301 WeakPolarHBondContact O-CG2 3.15Å; S297-V301 PolarHBondContact O-N 3.45Å
298	I	90.1	Very high	88.6	Confident	46 Å²	46	61.3 Å²	61.3	24%	0.236	32%	0.322	C	S	.	.	H	α-helix	trans	-67.8	-47.7	176.5	-65.2	166.1	0	0	0	109.5	L292 T294 S295 V301 N302	L292-I298 HydrophobicContact CB-CG1 3.73Å; T294-I298 WeakPolarHBondContact O-CG1 3.32Å; T294-I298 PolarHBondContact O-N 3.04Å; S295-I298 PolarHBondContact O-N 3.29Å; I298-V301 PolarHBondContact O-N 2.9Å; I298-N302 VanDerWaalsContact O-CB 3.28Å; I298-N302 WeakPolarHBondContact O-CB 3.09Å; I298-N302 PolarHBondContact O-N 2.98Å
299	K	91	Very high	89	Confident	91 Å²	91	58 Å²	58	40%	0.396	31%	0.307	S	S	.	.	H	α-helix	trans	-60.6	-47.1	178.4	-167.4	177.6	-177.7	-172	0	111.9	S295 N302 L303 E386 L390	S295-K299 WeakPolarHBondContact O-CB 3.06Å; S295-K299 PolarHBondContact O-N 3.04Å; K299-N302 PolarHBondContact O-N 3.26Å; K299-L303 HydrophobicContact CG-CD1 4.08Å; K299-L303 WeakPolarHBondContact O-CG 3.08Å; K299-L303 PolarHBondContact O-N 3.13Å; K299-E386 VanDerWaalsContact CE-CD 3.42Å; K299-E386 VanDerWaalsContact CE-OE1 3.23Å; K299-E386 WeakPolarHBondContact CE-OE1 3.2Å; K299-E386 WeakPolarHBondContact CE-OE2 3.15Å; K299-E386 VanDerWaalsContact NZ-CD 3.28Å; K299-E386 IonicContact NZ-OE1 3.03Å; K299-E386 PolarHBondContact NZ-OE1 3.29Å; K299-E386 IonicContact NZ-OE2 3.73Å; K299-L390 HydrophobicContact CB-CD1 4.35Å; K299-L390 HydrophobicContact CD-CD1 4.24Å; K299-L390 HydrophobicContact CG-CD1 4.15Å
300	L	91.4	Very high	89.7	Confident	37 Å²	37	57.5 Å²	57.5	19%	0.194	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-49.2	178.6	177.6	60.3	0	0	0	112.1	N296 N302 L303 L304 I387 L390 I391	N296-L300 VanDerWaalsContact O-CB 3.22Å; N296-L300 WeakPolarHBondContact O-CB 2.99Å; N296-L300 PolarHBondContact O-N 3.21Å; L300-N302 VanDerWaalsContact C-N 3.33Å; L300-N302 PolarHBondContact O-N 3.33Å; L300-L303 PolarHBondContact O-N 3.29Å; L300-L304 HydrophobicContact CD1-CD1 3.91Å; L300-L304 HydrophobicContact CD1-CG 4.29Å; L300-L304 HydrophobicContact CG-CD1 3.99Å; L300-L304 WeakPolarHBondContact O-CB 3.34Å; L300-L304 WeakPolarHBondContact O-CG 3.35Å; L300-L304 PolarHBondContact O-N 3.4Å; L300-I387 HydrophobicContact CD1-CB 4.41Å; L300-I387 HydrophobicContact CD1-CG1 4.3Å; L300-I387 HydrophobicContact CD1-CG2 4Å; L300-L390 HydrophobicContact CB-CB 4.49Å; L300-L390 HydrophobicContact CB-CD1 4.19Å; L300-L390 HydrophobicContact CD1-CB 4.26Å; L300-I391 HydrophobicContact CD1-CD1 4.25Å; L300-I391 HydrophobicContact CD1-CG1 4.04Å; L300-I391 HydrophobicContact CD2-CG1 4.05Å
301	V	92.3	Very high	90.3	Very high	25 Å²	25	55.5 Å²	55.5	15%	0.152	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-35	178.6	175.6	0	0	0	0	111.4	F282 L286 L292 S297 I298 S305	F282-V301 HydrophobicContact CD1-CG1 3.89Å; F282-V301 HydrophobicContact CE1-CG1 4.11Å; L286-V301 HydrophobicContact CD1-CG1 4.08Å; L292-V301 HydrophobicContact CD1-CB 3.86Å; L292-V301 HydrophobicContact CD1-CG1 4.05Å; L292-V301 HydrophobicContact CD1-CG2 3.96Å; L292-V301 HydrophobicContact CD2-CG2 3.91Å; S297-V301 WeakPolarHBondContact O-CG2 3.15Å; S297-V301 PolarHBondContact O-N 3.45Å; I298-V301 PolarHBondContact O-N 2.9Å; V301-S305 WeakPolarHBondContact O-CB 3.43Å; V301-S305 PolarHBondContact O-N 2.7Å
302	N	92.3	Very high	90.7	Very high	62 Å²	62	51.1 Å²	51.1	33%	0.332	27%	0.269	S	S	.	.	H	α-helix	trans	-65	-45.6	176.5	-162.7	52.4	0	0	0	112.4	S283 I298 K299 L300 S305 I306	S283-N302 PolarHBondContact OG-OD1 3.04Å; I298-N302 VanDerWaalsContact O-CB 3.28Å; I298-N302 WeakPolarHBondContact O-CB 3.09Å; I298-N302 PolarHBondContact O-N 2.98Å; K299-N302 PolarHBondContact O-N 3.26Å; L300-N302 VanDerWaalsContact C-N 3.33Å; L300-N302 PolarHBondContact O-N 3.33Å; N302-S305 WeakPolarHBondContact O-CB 3.37Å; N302-S305 PolarHBondContact O-N 2.77Å; N302-I306 VanDerWaalsContact O-CG1 3.32Å; N302-I306 WeakPolarHBondContact O-CG1 3.46Å; N302-I306 PolarHBondContact O-N 3.27Å
303	L	92.6	Very high	91	Very high	11 Å²	11	50.9 Å²	50.9	6%	0.058	27%	0.269	C	S	.	.	H	α-helix	trans	-62.7	-48	176.4	-69.2	166.6	0	0	0	111.8	K299 L300 S305 I306 F307 Y383 E386 I387 L390	K299-L303 HydrophobicContact CG-CD1 4.08Å; K299-L303 WeakPolarHBondContact O-CG 3.08Å; K299-L303 PolarHBondContact O-N 3.13Å; L300-L303 PolarHBondContact O-N 3.29Å; L303-S305 VanDerWaalsContact C-N 3.3Å; L303-S305 PolarHBondContact O-N 2.63Å; L303-I306 PolarHBondContact O-N 3.1Å; L303-F307 WeakPolarHBondContact O-CB 3.49Å; L303-F307 PolarHBondContact O-N 3.26Å; L303-Y383 HydrophobicContact CD2-CD1 3.73Å; L303-Y383 HydrophobicContact CD2-CD2 4.28Å; L303-Y383 HydrophobicContact CD2-CE1 3.88Å; L303-Y383 HydrophobicContact CD2-CE2 4.41Å; L303-Y383 HydrophobicContact CD2-CG 3.94Å; L303-E386 HydrophobicContact CD1-CB 4.32Å; L303-E386 HydrophobicContact CD1-CG 3.79Å; L303-E386 VanDerWaalsContact CD1-OE2 3.26Å; L303-E386 WeakPolarHBondContact CD1-OE2 3.41Å; L303-I387 HydrophobicContact CB-CD1 4.09Å; L303-I387 HydrophobicContact CB-CG1 3.94Å; L303-I387 HydrophobicContact CD1-CG1 4.29Å; L303-L390 HydrophobicContact CD1-CD1 3.96Å
304	L	92.3	Very high	91.5	Very high	63 Å²	63	43.4 Å²	43.4	33%	0.33	24%	0.238	S	C	.	.	H	α-helix	trans	-59.3	-42.3	175.7	-73.9	167.9	0	0	0	111.8	L300 I308 I387	L300-L304 HydrophobicContact CD1-CD1 3.91Å; L300-L304 HydrophobicContact CD1-CG 4.29Å; L300-L304 HydrophobicContact CG-CD1 3.99Å; L300-L304 WeakPolarHBondContact O-CB 3.34Å; L300-L304 WeakPolarHBondContact O-CG 3.35Å; L300-L304 PolarHBondContact O-N 3.4Å; L304-I308 WeakPolarHBondContact O-CB 3.39Å; L304-I308 WeakPolarHBondContact O-CD1 3.12Å; L304-I308 VanDerWaalsContact O-CG1 3.22Å; L304-I308 WeakPolarHBondContact O-CG1 3.42Å; L304-I308 PolarHBondContact O-N 3.44Å; L304-I387 HydrophobicContact CD2-CD1 3.97Å; L304-I387 HydrophobicContact CD2-CG2 4.23Å; L304-I387 HydrophobicContact CG-CD1 4.27Å
305	S	92.1	Very high	92.1	Very high	7 Å²	7	39.6 Å²	39.6	5%	0.049	22%	0.215	C	C	.	.	H	α-helix	trans	-60.2	-54.8	178.8	-179.1	0	0	0	0	111.8	L279 I280 V301 N302 L303 F307 I308 S309	L279-S305 PolarHBondContact O-OG 3.11Å; I280-S305 VanDerWaalsContact CA-OG 3.25Å; I280-S305 WeakPolarHBondContact CA-OG 3.06Å; I280-S305 PolarHBondContact O-OG 3.27Å; V301-S305 WeakPolarHBondContact O-CB 3.43Å; V301-S305 PolarHBondContact O-N 2.7Å; N302-S305 WeakPolarHBondContact O-CB 3.37Å; N302-S305 PolarHBondContact O-N 2.77Å; L303-S305 VanDerWaalsContact C-N 3.3Å; L303-S305 PolarHBondContact O-N 2.63Å; S305-F307 VanDerWaalsContact C-N 3.34Å; S305-F307 PolarHBondContact O-N 3.5Å; S305-I308 PolarHBondContact O-N 2.71Å; S305-S309 VanDerWaalsContact O-CB 3.3Å; S305-S309 WeakPolarHBondContact O-CB 3.49Å; S305-S309 PolarHBondContact O-N 3.17Å; S305-S309 PolarHBondContact O-OG 3.09Å
306	I	92.3	Very high	92.4	Very high	40 Å²	40	35.1 Å²	35.1	21%	0.205	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-39.4	-179.3	-62.8	165.2	0	0	0	111.1	N302 L303 S309 T310 Y383	N302-I306 VanDerWaalsContact O-CG1 3.32Å; N302-I306 WeakPolarHBondContact O-CG1 3.46Å; N302-I306 PolarHBondContact O-N 3.27Å; L303-I306 PolarHBondContact O-N 3.1Å; I306-S309 WeakPolarHBondContact CA-OG 3.37Å; I306-S309 PolarHBondContact O-OG 2.81Å; I306-S309 VanDerWaalsContact O-OG 3.1Å; I306-T310 VanDerWaalsContact O-CB 3.24Å; I306-T310 WeakPolarHBondContact O-CB 3.37Å; I306-T310 PolarHBondContact O-N 3.1Å; I306-T310 VanDerWaalsContact O-N 3.09Å; I306-T310 PolarHBondContact O-OG1 2.91Å; I306-Y383 HydrophobicContact CB-CE2 4.3Å; I306-Y383 HydrophobicContact CG2-CE2 3.92Å
307	F	92.9	Very high	92.8	Very high	27 Å²	27	34.6 Å²	34.6	12%	0.118	18%	0.177	C	C	.	.	H	α-helix	trans	-61.2	-53	176.9	-175.8	-91	0	0	0	111.5	L303 S305 T310 W311 M347 M350 F380 Y383 V384	L303-F307 WeakPolarHBondContact O-CB 3.49Å; L303-F307 PolarHBondContact O-N 3.26Å; S305-F307 VanDerWaalsContact C-N 3.34Å; S305-F307 PolarHBondContact O-N 3.5Å; F307-T310 PolarHBondContact O-N 3.4Å; F307-W311 WeakPolarHBondContact O-CB 3.2Å; F307-W311 PolarHBondContact O-N 2.81Å; F307-M347 HydrophobicContact CE1-CE 4.21Å; F307-M347 HydrophobicContact CZ-CE 4.3Å; F307-M350 HydrophobicContact CD2-CE 4.32Å; F307-M350 HydrophobicContact CE1-CE 4.41Å; F307-M350 HydrophobicContact CE2-CE 3.51Å; F307-M350 HydrophobicContact CZ-CE 3.56Å; F307-M350 HydrophobicContact CZ-SD 4.4Å; F307-F380 HydrophobicContact CE2-CD2 4.27Å; F307-F380 HydrophobicContact CZ-CD2 4.32Å; F307-Y383 HydrophobicContact CB-CD2 4.33Å; F307-Y383 HydrophobicContact CD2-CD2 4.45Å; F307-V384 HydrophobicContact CE2-CG2 4.02Å; F307-V384 HydrophobicContact CZ-CG2 4.36Å
308	I	93.3	Very high	93.2	Very high	67 Å²	67	33.1 Å²	33.1	34%	0.344	17%	0.167	S	C	.	.	H	α-helix	trans	-67	-44.7	-178	-66.9	167.3	0	0	0	111	L279 L304 S305 T310 W311 L312	L279-I308 HydrophobicContact CD1-CG2 4.16Å; L304-I308 WeakPolarHBondContact O-CB 3.39Å; L304-I308 WeakPolarHBondContact O-CD1 3.12Å; L304-I308 VanDerWaalsContact O-CG1 3.22Å; L304-I308 WeakPolarHBondContact O-CG1 3.42Å; L304-I308 PolarHBondContact O-N 3.44Å; S305-I308 PolarHBondContact O-N 2.71Å; I308-T310 VanDerWaalsContact C-N 3.31Å; I308-T310 PolarHBondContact O-N 3.02Å; I308-W311 PolarHBondContact O-N 2.65Å; I308-L312 HydrophobicContact CG2-CD1 3.62Å; I308-L312 HydrophobicContact CG2-CG 4.22Å; I308-L312 WeakPolarHBondContact O-CB 3.1Å; I308-L312 VanDerWaalsContact O-CG 3.31Å; I308-L312 WeakPolarHBondContact O-CG 3.44Å; I308-L312 PolarHBondContact O-N 2.75Å
309	S	93	Very high	93.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.1	-42.8	179.5	68.8	0	0	0	0	111.7	A276 I280 S305 I306 T313	A276-S309 WeakPolarHBondContact O-CB 3.27Å; I280-S309 WeakPolarHBondContact CG1-OG 3.25Å; S305-S309 VanDerWaalsContact O-CB 3.3Å; S305-S309 WeakPolarHBondContact O-CB 3.49Å; S305-S309 PolarHBondContact O-N 3.17Å; S305-S309 PolarHBondContact O-OG 3.09Å; I306-S309 WeakPolarHBondContact CA-OG 3.37Å; I306-S309 PolarHBondContact O-OG 2.81Å; I306-S309 VanDerWaalsContact O-OG 3.1Å; S309-T313 VanDerWaalsContact O-CB 3.23Å; S309-T313 WeakPolarHBondContact O-CB 3.34Å; S309-T313 PolarHBondContact O-N 3.29Å; S309-T313 PolarHBondContact O-OG1 2.96Å
310	T	92.6	Very high	93.4	Very high	41 Å²	41	28 Å²	28	25%	0.252	14%	0.144	S	C	.	.	H	α-helix	trans	-73.4	-42.2	-176.5	-51.6	0	0	0	0	111.3	I306 F307 I308 T313 A314 M379	I306-T310 VanDerWaalsContact O-CB 3.24Å; I306-T310 WeakPolarHBondContact O-CB 3.37Å; I306-T310 PolarHBondContact O-N 3.1Å; I306-T310 VanDerWaalsContact O-N 3.09Å; I306-T310 PolarHBondContact O-OG1 2.91Å; F307-T310 PolarHBondContact O-N 3.4Å; I308-T310 VanDerWaalsContact C-N 3.31Å; I308-T310 PolarHBondContact O-N 3.02Å; T310-T313 PolarHBondContact O-N 2.66Å; T310-A314 VanDerWaalsContact O-CB 3.26Å; T310-A314 WeakPolarHBondContact O-CB 3.4Å; T310-A314 PolarHBondContact O-N 3Å; T310-M379 HydrophobicContact CG2-CE 3.84Å; T310-M379 HydrophobicContact CG2-SD 4.12Å
311	W	94.6	Very high	93.4	Very high	53 Å²	53	27.1 Å²	27.1	20%	0.201	14%	0.14	C	C	.	.	H	α-helix	trans	-60.5	-50.3	174.9	173	41	0	0	0	112.3	F307 I308 T313 A314 A315 V343 M347 M350	F307-W311 WeakPolarHBondContact O-CB 3.2Å; F307-W311 PolarHBondContact O-N 2.81Å; I308-W311 PolarHBondContact O-N 2.65Å; W311-T313 PolarHBondContact O-N 2.98Å; W311-A314 PolarHBondContact O-N 3.21Å; W311-A315 WeakPolarHBondContact O-CB 3.46Å; W311-A315 PolarHBondContact O-N 3.04Å; W311-V343 HydrophobicContact CH2-CG1 3.87Å; W311-V343 HydrophobicContact CZ2-CG1 3.26Å; W311-V343 PolarHBondContact NE1-O 2.87Å; W311-M347 HydrophobicContact CD2-CE 3.83Å; W311-M347 HydrophobicContact CE3-CE 4.06Å; W311-M347 HydrophobicContact CH2-CE 3.73Å; W311-M347 HydrophobicContact CZ2-CB 3.87Å; W311-M347 HydrophobicContact CZ2-CE 3.46Å; W311-M347 VanDerWaalsContact CZ2-CE 3.46Å; W311-M347 HydrophobicContact CZ2-CG 4.33Å; W311-M347 HydrophobicContact CZ3-CE 4.02Å; W311-M350 HydrophobicContact CG-SD 4.35Å
312	L	95.3	Very high	93.4	Very high	17 Å²	17	25.9 Å²	25.9	9%	0.089	13%	0.133	C	C	.	.	H	α-helix	trans	-65.9	-35.5	179.6	-68.3	175.9	0	0	0	112.9	F196 A276 L279 I308 G316 Y339 V343	F196-L312 HydrophobicContact CZ-CD1 4.38Å; A276-L312 HydrophobicContact CB-CB 3.92Å; L279-L312 HydrophobicContact CD1-CD1 4.16Å; I308-L312 HydrophobicContact CG2-CD1 3.62Å; I308-L312 HydrophobicContact CG2-CG 4.22Å; I308-L312 WeakPolarHBondContact O-CB 3.1Å; I308-L312 VanDerWaalsContact O-CG 3.31Å; I308-L312 WeakPolarHBondContact O-CG 3.44Å; I308-L312 PolarHBondContact O-N 2.75Å; L312-G316 PolarHBondContact O-N 3.04Å; L312-G316 VanDerWaalsContact O-N 3.08Å; L312-Y339 WeakPolarHBondContact CA-OH 3.49Å; L312-Y339 WeakPolarHBondContact CB-OH 3.36Å; L312-Y339 HydrophobicContact CD2-CE1 4.44Å; L312-Y339 WeakPolarHBondContact CD2-OH 2.92Å; L312-Y339 PolarHBondContact O-OH 3.45Å; L312-V343 HydrophobicContact CD2-CG2 4.23Å
313	T	94.7	Very high	93.3	Very high	17 Å²	17	24.4 Å²	24.4	10%	0.104	12%	0.124	C	C	.	.	H	α-helix	trans	-69.4	-44.8	176.4	-57.6	0	0	0	0	111.2	F273 L274 L277 S309 T310 W311 A315 G316 F317	F273-T313 HydrophobicContact CD2-CG2 3.9Å; F273-T313 WeakPolarHBondContact CD2-O 3.43Å; F273-T313 HydrophobicContact CE2-CG2 4.1Å; L274-T313 HydrophobicContact CD2-CG2 3.95Å; L277-T313 HydrophobicContact CD1-CG2 4.17Å; L277-T313 HydrophobicContact CD2-CG2 3.99Å; L277-T313 VanDerWaalsContact CD2-OG1 3.31Å; L277-T313 WeakPolarHBondContact CD2-OG1 3.43Å; L277-T313 HydrophobicContact CG-CG2 3.89Å; L277-T313 WeakPolarHBondContact CG-OG1 3.23Å; S309-T313 VanDerWaalsContact O-CB 3.23Å; S309-T313 WeakPolarHBondContact O-CB 3.34Å; S309-T313 PolarHBondContact O-N 3.29Å; S309-T313 PolarHBondContact O-OG1 2.96Å; T310-T313 PolarHBondContact O-N 2.66Å; W311-T313 PolarHBondContact O-N 2.98Å; T313-A315 VanDerWaalsContact C-N 3.32Å; T313-A315 PolarHBondContact O-N 3.44Å; T313-G316 PolarHBondContact O-N 3.04Å; T313-F317 PolarHBondContact O-N 2.79Å
314	A	94.9	Very high	93	Very high	11 Å²	11	25 Å²	25	9%	0.091	13%	0.13	C	C	.	.	H	α-helix	trans	-62.2	-40.3	175.4	0	0	0	0	0	111.6	T310 W311 G316 F317 I318 L346 F368 F372	T310-A314 VanDerWaalsContact O-CB 3.26Å; T310-A314 WeakPolarHBondContact O-CB 3.4Å; T310-A314 PolarHBondContact O-N 3Å; W311-A314 PolarHBondContact O-N 3.21Å; A314-G316 VanDerWaalsContact C-N 3.3Å; A314-G316 PolarHBondContact O-N 3.34Å; A314-F317 PolarHBondContact O-N 2.69Å; A314-I318 PolarHBondContact O-N 2.96Å; A314-L346 HydrophobicContact CB-CD1 3.45Å; A314-L346 VanDerWaalsContact CB-CD1 3.45Å; A314-F368 HydrophobicContact CB-CE1 4.41Å; A314-F368 HydrophobicContact CB-CZ 3.89Å; A314-F372 HydrophobicContact CB-CD2 3.76Å; A314-F372 HydrophobicContact CB-CE2 3.51Å; A314-F372 HydrophobicContact CB-CZ 4.45Å
315	A	95.4	Very high	92.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.3	-38.9	176.1	0	0	0	0	0	111.5	W311 T313 I318 H319 Y339 V343 L346	W311-A315 WeakPolarHBondContact O-CB 3.46Å; W311-A315 PolarHBondContact O-N 3.04Å; T313-A315 VanDerWaalsContact C-N 3.32Å; T313-A315 PolarHBondContact O-N 3.44Å; A315-I318 WeakPolarHBondContact O-CG2 3.32Å; A315-H319 WeakPolarHBondContact O-CB 3.44Å; A315-H319 PolarHBondContact O-N 2.57Å; A315-Y339 HydrophobicContact CB-CE2 4.1Å; A315-V343 HydrophobicContact CB-CB 4.3Å; A315-V343 HydrophobicContact CB-CG2 3.52Å; A315-L346 HydrophobicContact CB-CD1 4.14Å; A315-L346 VanDerWaalsContact N-CD1 3.25Å
316	G	94.1	Very high	92.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-69.3	-33.4	175.6	0	0	0	0	0	113.9	F273 L312 T313 A314 L320	F273-G316 WeakPolarHBondContact CD1-O 3.47Å; L312-G316 PolarHBondContact O-N 3.04Å; L312-G316 VanDerWaalsContact O-N 3.08Å; T313-G316 PolarHBondContact O-N 3.04Å; A314-G316 VanDerWaalsContact C-N 3.3Å; A314-G316 PolarHBondContact O-N 3.34Å; G316-L320 PolarHBondContact O-N 3.43Å
317	F	94.8	Very high	91.9	Very high	80 Å²	80	23 Å²	23	35%	0.351	12%	0.124	S	C	.	.	H	α-helix	trans	-65.7	-52.4	173.5	-175.3	-87	0	0	0	111.5	F273 T313 A314 H319 L320 V321 F368	F273-F317 HydrophobicContact CE2-CB 4Å; F273-F317 HydrophobicContact CE2-CD2 4.48Å; F273-F317 HydrophobicContact CZ-CB 3.98Å; F273-F317 AromaticContact CZ-CD2 3.96Å; F273-F317 HydrophobicContact CZ-CD2 3.96Å; F273-F317 HydrophobicContact CZ-CG 4.46Å; T313-F317 PolarHBondContact O-N 2.79Å; A314-F317 PolarHBondContact O-N 2.69Å; F317-H319 VanDerWaalsContact C-N 3.3Å; F317-H319 PolarHBondContact O-N 3.28Å; F317-L320 PolarHBondContact O-N 2.9Å; F317-V321 HydrophobicContact CD1-CG2 4.11Å; F317-V321 HydrophobicContact CE1-CG2 3.7Å; F317-V321 HydrophobicContact CZ-CG2 4.01Å; F317-V321 WeakPolarHBondContact O-CG2 3.06Å; F317-V321 PolarHBondContact O-N 3.25Å; F317-F368 HydrophobicContact CB-CE2 4.44Å; F317-F368 HydrophobicContact CB-CZ 4.28Å; F317-F368 HydrophobicContact CD1-CB 4.3Å; F317-F368 AromaticContact CD1-CD1 3.98Å; F317-F368 HydrophobicContact CD1-CD1 3.98Å; F317-F368 AromaticContact CD1-CD2 3.36Å; F317-F368 HydrophobicContact CD1-CD2 3.36Å; F317-F368 HydrophobicContact CD1-CE1 4.11Å; F317-F368 AromaticContact CD1-CE2 3.52Å; F317-F368 HydrophobicContact CD1-CE2 3.52Å; F317-F368 AromaticContact CD1-CG 3.59Å; F317-F368 HydrophobicContact CD1-CG 3.59Å; F317-F368 AromaticContact CD1-CZ 3.89Å; F317-F368 HydrophobicContact CD1-CZ 3.89Å; F317-F368 HydrophobicContact CE1-CB 3.91Å; F317-F368 HydrophobicContact CE1-CD1 4.44Å; F317-F368 AromaticContact CE1-CD2 3.4Å; F317-F368 HydrophobicContact CE1-CD2 3.4Å; F317-F368 HydrophobicContact CE1-CE2 4Å; F317-F368 AromaticContact CE1-CG 3.65Å; F317-F368 HydrophobicContact CE1-CG 3.65Å; F317-F368 HydrophobicContact CG-CD2 4.3Å; F317-F368 HydrophobicContact CG-CE2 4.06Å; F317-F368 HydrophobicContact CG-CZ 4.36Å; F317-F368 HydrophobicContact CZ-CD2 4.36Å
318	I	94.5	Very high	91.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.6	-34	178.8	-169.5	62.8	0	0	0	111.8	A314 A315 V321 E322 C342 L346 A360 F368	A314-I318 PolarHBondContact O-N 2.96Å; A315-I318 WeakPolarHBondContact O-CG2 3.32Å; I318-V321 PolarHBondContact O-N 3.4Å; I318-E322 HydrophobicContact CD1-CG 3.85Å; I318-E322 HydrophobicContact CG1-CG 4.04Å; I318-E322 PolarHBondContact O-N 3.08Å; I318-C342 HydrophobicContact CG2-CB 3.87Å; I318-L346 HydrophobicContact CG2-CD1 4.34Å; I318-L346 HydrophobicContact CG2-CD2 4.35Å; I318-L346 HydrophobicContact CG2-CG 4.34Å; I318-A360 HydrophobicContact CD1-CB 4.22Å; I318-F368 HydrophobicContact CB-CD1 4.14Å; I318-F368 HydrophobicContact CB-CE1 4.19Å; I318-F368 HydrophobicContact CD1-CD1 4.28Å
319	H	94.2	Very high	91	Very high	7 Å²	7	30 Å²	30	3%	0.032	15%	0.149	C	C	.	.	H	α-helix	trans	-61.3	-42.1	171.7	-179.2	-100.4	0	0	0	112.8	A315 F317 N323 L337 T338 Y339 C342	A315-H319 WeakPolarHBondContact O-CB 3.44Å; A315-H319 PolarHBondContact O-N 2.57Å; F317-H319 VanDerWaalsContact C-N 3.3Å; F317-H319 PolarHBondContact O-N 3.28Å; H319-N323 PolarHBondContact CD2-ND2 3Å; H319-N323 PolarHBondContact NE2-ND2 2.89Å; H319-N323 WeakPolarHBondContact O-CB 3.3Å; H319-N323 PolarHBondContact O-N 3.12Å; H319-N323 PolarHBondContact O-ND2 3.08Å; H319-L337 PolarHBondContact CD2-O 2.87Å; H319-L337 PolarHBondContact NE2-O 3.48Å; H319-L337 VanDerWaalsContact NE2-O 3.17Å; H319-T338 VanDerWaalsContact CD2-C 3.4Å; H319-Y339 HydrophobicContact CB-CD2 4.27Å; H319-Y339 WeakPolarHBondContact CD2-CA 3.42Å; H319-Y339 PolarHBondContact CD2-N 3.46Å; H319-Y339 PolarHBondContact NE2-N 2.93Å; H319-Y339 VanDerWaalsContact NE2-N 3.15Å; H319-C342 VanDerWaalsContact CA-SG 3.59Å; H319-C342 HydrophobicContact CB-CB 4.11Å
320	L	91.4	Very high	90.4	Very high	23 Å²	23	36 Å²	36	12%	0.12	18%	0.182	C	C	.	.	H	α-helix	trans	-65	-43.8	174.7	179.8	65.7	0	0	0	111	L271 F273 G316 F317 S324	L271-L320 HydrophobicContact CD2-CD2 4.16Å; F273-L320 HydrophobicContact CE1-CB 4.29Å; F273-L320 HydrophobicContact CE1-CD2 4.01Å; G316-L320 PolarHBondContact O-N 3.43Å; F317-L320 PolarHBondContact O-N 2.9Å; L320-S324 WeakPolarHBondContact O-CB 3.38Å; L320-S324 PolarHBondContact O-N 2.71Å; L320-S324 VanDerWaalsContact O-N 3.13Å; L320-S324 PolarHBondContact O-OG 2.9Å
321	V	92.2	Very high	89.9	Confident	18 Å²	18	37.1 Å²	37.1	11%	0.109	18%	0.183	C	C	.	.	H	α-helix	trans	-68.3	-53.6	-175.4	171.2	0	0	0	0	112.2	F317 I318 N323 S324 G325 T362 L364	F317-V321 HydrophobicContact CD1-CG2 4.11Å; F317-V321 HydrophobicContact CE1-CG2 3.7Å; F317-V321 HydrophobicContact CZ-CG2 4.01Å; F317-V321 WeakPolarHBondContact O-CG2 3.06Å; F317-V321 PolarHBondContact O-N 3.25Å; I318-V321 PolarHBondContact O-N 3.4Å; V321-N323 PolarHBondContact O-N 3.23Å; V321-S324 PolarHBondContact O-N 3.38Å; V321-G325 PolarHBondContact O-N 2.9Å; V321-T362 WeakPolarHBondContact CG1-OG1 3.34Å; V321-L364 HydrophobicContact CG1-CB 3.57Å
322	E	91.9	Very high	89.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.4	-42.7	-176.9	-70.8	-68.1	124.2	0	0	112.1	I318 S324 N334 Q335 L337 A360 K361 T362	I318-E322 HydrophobicContact CD1-CG 3.85Å; I318-E322 HydrophobicContact CG1-CG 4.04Å; I318-E322 PolarHBondContact O-N 3.08Å; E322-S324 VanDerWaalsContact C-N 3.32Å; E322-S324 PolarHBondContact O-N 2.92Å; E322-N334 CarbonylContact O-C 3.59Å; E322-N334 WeakPolarHBondContact O-CA 3.19Å; E322-Q335 CarbonylContact C-O 3.51Å; E322-Q335 HydrophobicContact CB-CB 4.41Å; E322-Q335 PolarHBondContact O-N 3.23Å; E322-L337 HydrophobicContact CB-CD1 4.32Å; E322-L337 HydrophobicContact CG-CD1 4.32Å; E322-A360 WeakPolarHBondContact OE1-CB 3.49Å; E322-K361 PolarHBondContact OE1-N 3.08Å; E322-K361 PolarHBondContact OE2-N 3.33Å; E322-T362 WeakPolarHBondContact OE1-CB 3.4Å; E322-T362 PolarHBondContact OE1-N 3.3Å; E322-T362 PolarHBondContact OE1-OG1 3.47Å; E322-T362 PolarHBondContact OE2-N 2.97Å
323	N	89.3	Confident	88.8	Confident	30 Å²	30	43.8 Å²	43.8	16%	0.16	22%	0.217	C	C	.	.	H	α-helix	trans	-70.8	-26.4	177.6	-73.5	-69.5	0	0	0	113.2	I203 H319 V321 N334 Q335 A336 L337	I203-N323 VanDerWaalsContact CD1-C 3.4Å; I203-N323 HydrophobicContact CD1-CB 3.62Å; I203-N323 WeakPolarHBondContact CD1-O 3.17Å; I203-N323 HydrophobicContact CG1-CB 4.25Å; H319-N323 PolarHBondContact CD2-ND2 3Å; H319-N323 PolarHBondContact NE2-ND2 2.89Å; H319-N323 WeakPolarHBondContact O-CB 3.3Å; H319-N323 PolarHBondContact O-N 3.12Å; H319-N323 PolarHBondContact O-ND2 3.08Å; V321-N323 PolarHBondContact O-N 3.23Å; N323-N334 WeakPolarHBondContact O-CB 3.15Å; N323-N334 PolarHBondContact O-ND2 2.93Å; N323-Q335 PolarHBondContact OD1-O 3.13Å; N323-A336 WeakPolarHBondContact OD1-CA 3.29Å; N323-L337 PolarHBondContact ND2-O 3.19Å; N323-L337 PolarHBondContact OD1-N 3.45Å; N323-L337 VanDerWaalsContact OD1-N 3.15Å; N323-L337 PolarHBondContact OD1-O 3.33Å
324	S	86.3	Confident	88.4	Confident	25 Å²	25	46.9 Å²	46.9	18%	0.175	23%	0.233	C	C	.	.	H	α-helix	trans	-78.4	-39.4	178.8	-63.7	0	0	0	0	112.4	L320 V321 E322 F331	L320-S324 WeakPolarHBondContact O-CB 3.38Å; L320-S324 PolarHBondContact O-N 2.71Å; L320-S324 VanDerWaalsContact O-N 3.13Å; L320-S324 PolarHBondContact O-OG 2.9Å; V321-S324 PolarHBondContact O-N 3.38Å; E322-S324 VanDerWaalsContact C-N 3.32Å; E322-S324 PolarHBondContact O-N 2.92Å; S324-F331 WeakPolarHBondContact O-CB 3.39Å; S324-F331 VanDerWaalsContact O-CD1 3.29Å; S324-F331 WeakPolarHBondContact O-CD1 3.3Å
325	G	85.9	Confident	88	Confident	3 Å²	3	47.4 Å²	47.4	3%	0.031	23%	0.234	C	C	.	.			trans	84.7	165.7	-169.8	0	0	0	0	0	113.6	V321 F331 N333	V321-G325 PolarHBondContact O-N 2.9Å; G325-F331 WeakPolarHBondContact O-CD1 3.48Å; G325-N333 WeakPolarHBondContact CA-OD1 3.22Å
326	D	86.8	Confident	87.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.269	C	S	.	.			trans	-75.3	133.7	177	-69.2	-46	0	0	0	110.9	W328 E329 F331 N333 T363 L364	D326-W328 VanDerWaalsContact C-N 3.27Å; D326-W328 HydrophobicContact CB-CD2 4.06Å; D326-W328 HydrophobicContact CB-CG 4.4Å; D326-W328 HydrophobicContact CB-CZ2 4.11Å; D326-W328 PolarHBondContact O-N 3.25Å; D326-E329 HydrophobicContact CB-CG 4.41Å; D326-E329 PolarHBondContact O-N 3.5Å; D326-F331 PolarHBondContact O-N 3.45Å; D326-F331 VanDerWaalsContact O-N 3.15Å; D326-N333 PolarHBondContact N-OD1 2.93Å; D326-N333 PolarHBondContact OD2-ND2 3.37Å; D326-T363 PolarHBondContact OD1-N 3.23Å; D326-T363 WeakPolarHBondContact OD2-CB 3.24Å; D326-T363 PolarHBondContact OD2-N 2.94Å; D326-T363 PolarHBondContact OD2-OG1 3.01Å; D326-L364 WeakPolarHBondContact OD1-CB 3.34Å; D326-L364 WeakPolarHBondContact OD1-CG 3.45Å; D326-L364 PolarHBondContact OD1-N 3.06Å
327	P	82.9	Confident	87.5	Confident	65 Å²	65	52.3 Å²	52.3	42%	0.422	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-61.1	-28	-179.1	-26.1	33.9	0	0	0	115.4	N330 F331	P327-N330 PolarHBondContact O-N 2.79Å; P327-F331 HydrophobicContact CB-CE1 4.08Å; P327-F331 HydrophobicContact CB-CZ 3.92Å; P327-F331 HydrophobicContact CG-CE1 3.85Å; P327-F331 HydrophobicContact CG-CZ 4.09Å
328	W	84	Confident	87.4	Confident	141 Å²	141	52 Å²	52	53%	0.534	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-78.3	-24.8	-179.8	43.2	93	0	0	0	113.7	D326 N330 T363 L364	D326-W328 VanDerWaalsContact C-N 3.27Å; D326-W328 HydrophobicContact CB-CD2 4.06Å; D326-W328 HydrophobicContact CB-CG 4.4Å; D326-W328 HydrophobicContact CB-CZ2 4.11Å; D326-W328 PolarHBondContact O-N 3.25Å; W328-N330 PolarHBondContact O-N 3.14Å; W328-T363 HydrophobicContact CZ2-CG2 4Å; W328-L364 HydrophobicContact CH2-CD1 4.15Å; W328-L364 HydrophobicContact CH2-CD2 3.76Å; W328-L364 HydrophobicContact CH2-CG 3.65Å; W328-L364 HydrophobicContact CZ2-CG 4.28Å; W328-L364 HydrophobicContact CZ3-CD1 4.4Å; W328-L364 HydrophobicContact CZ3-CD2 4.43Å; W328-L364 HydrophobicContact CZ3-CG 4.37Å
329	E	81.3	Confident	87.4	Confident	99 Å²	99	52 Å²	52	46%	0.463	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-86.8	22.2	172.1	-59.3	-55.2	147.5	0	0	111.8	D326 F331 Q332 N333	D326-E329 HydrophobicContact CB-CG 4.41Å; D326-E329 PolarHBondContact O-N 3.5Å; E329-F331 PolarHBondContact O-N 2.81Å; E329-F331 VanDerWaalsContact O-N 3.08Å; E329-Q332 WeakPolarHBondContact O-CB 3.46Å; E329-Q332 WeakPolarHBondContact O-CG 3.13Å; E329-Q332 PolarHBondContact O-N 2.84Å; E329-N333 HydrophobicContact CB-CB 4.37Å
330	N	81.6	Confident	87.5	Confident	127 Å²	127	58.3 Å²	58.3	68%	0.679	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	32.8	-172.3	-61.6	-73.5	0	0	0	113.4	P327 W328 Q332	P327-N330 PolarHBondContact O-N 2.79Å; W328-N330 PolarHBondContact O-N 3.14Å; N330-Q332 PolarHBondContact O-N 3.29Å
331	F	81.1	Confident	87.6	Confident	64 Å²	64	60.9 Å²	60.9	28%	0.281	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	19	-175.3	-52.6	-79	0	0	0	115.3	S324 G325 D326 P327 E329	S324-F331 WeakPolarHBondContact O-CB 3.39Å; S324-F331 VanDerWaalsContact O-CD1 3.29Å; S324-F331 WeakPolarHBondContact O-CD1 3.3Å; G325-F331 WeakPolarHBondContact O-CD1 3.48Å; D326-F331 PolarHBondContact O-N 3.45Å; D326-F331 VanDerWaalsContact O-N 3.15Å; P327-F331 HydrophobicContact CB-CE1 4.08Å; P327-F331 HydrophobicContact CB-CZ 3.92Å; P327-F331 HydrophobicContact CG-CE1 3.85Å; P327-F331 HydrophobicContact CG-CZ 4.09Å; E329-F331 PolarHBondContact O-N 2.81Å; E329-F331 VanDerWaalsContact O-N 3.08Å
332	Q	79.5	Confident	87.8	Confident	160 Å²	160	60 Å²	60	75%	0.748	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-21.2	-179	-64.8	-172.6	2.8	0	0	114.3	E329 N330 N334	E329-Q332 WeakPolarHBondContact O-CB 3.46Å; E329-Q332 WeakPolarHBondContact O-CG 3.13Å; E329-Q332 PolarHBondContact O-N 2.84Å; N330-Q332 PolarHBondContact O-N 3.29Å; Q332-N334 PolarHBondContact O-N 3.46Å
333	N	87.4	Confident	88	Confident	49 Å²	49	60.6 Å²	60.6	26%	0.262	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	28.6	-177.1	72.9	-18.5	0	0	0	113.4	G325 D326 E329	G325-N333 WeakPolarHBondContact CA-OD1 3.22Å; D326-N333 PolarHBondContact N-OD1 2.93Å; D326-N333 PolarHBondContact OD2-ND2 3.37Å; E329-N333 HydrophobicContact CB-CB 4.37Å
334	N	86	Confident	88.3	Confident	82 Å²	82	63.6 Å²	63.6	44%	0.439	32%	0.32	S	S	.	.			trans	-72.2	146.5	-178.3	69.7	-31.1	0	0	0	112.4	E322 N323 Q332	E322-N334 CarbonylContact O-C 3.59Å; E322-N334 WeakPolarHBondContact O-CA 3.19Å; N323-N334 WeakPolarHBondContact O-CB 3.15Å; N323-N334 PolarHBondContact O-ND2 2.93Å; Q332-N334 PolarHBondContact O-N 3.46Å
335	Q	87.8	Confident	88.7	Confident	23 Å²	23	62.8 Å²	62.8	11%	0.107	31%	0.314	C	S	.	.			trans	-117.3	115.9	175.1	-174.5	172.8	-77.2	0	0	108.9	E322 N323 L337 Y359	E322-Q335 CarbonylContact C-O 3.51Å; E322-Q335 HydrophobicContact CB-CB 4.41Å; E322-Q335 PolarHBondContact O-N 3.23Å; N323-Q335 PolarHBondContact OD1-O 3.13Å; Q335-L337 VanDerWaalsContact C-N 3.34Å; Q335-L337 HydrophobicContact CG-CD2 4.29Å; Q335-L337 HydrophobicContact CG-CG 4.02Å; Q335-L337 PolarHBondContact O-N 2.86Å; Q335-Y359 PolarHBondContact NE2-O 2.7Å
336	A	87.1	Confident	89.1	Confident	89 Å²	89	62.7 Å²	62.7	74%	0.736	31%	0.312	S	S	*	.			trans	-69	88.2	175.2	0	0	0	0	0	110.3	N323	N323-A336 WeakPolarHBondContact OD1-CA 3.29Å
337	L	90.8	Very high	89.5	Confident	13 Å²	13	65.3 Å²	65.3	7%	0.068	33%	0.325	C	S	.	.			trans	-106.8	134.7	172.1	-72.4	-176	0	0	0	109.4	H319 E322 N323 Q335 E341 V358	H319-L337 PolarHBondContact CD2-O 2.87Å; H319-L337 PolarHBondContact NE2-O 3.48Å; H319-L337 VanDerWaalsContact NE2-O 3.17Å; E322-L337 HydrophobicContact CB-CD1 4.32Å; E322-L337 HydrophobicContact CG-CD1 4.32Å; N323-L337 PolarHBondContact ND2-O 3.19Å; N323-L337 PolarHBondContact OD1-N 3.45Å; N323-L337 VanDerWaalsContact OD1-N 3.15Å; N323-L337 PolarHBondContact OD1-O 3.33Å; Q335-L337 VanDerWaalsContact C-N 3.34Å; Q335-L337 HydrophobicContact CG-CD2 4.29Å; Q335-L337 HydrophobicContact CG-CG 4.02Å; Q335-L337 PolarHBondContact O-N 2.86Å; L337-E341 HydrophobicContact CD2-CB 4.27Å; L337-V358 HydrophobicContact CD1-CG1 4.27Å; L337-V358 HydrophobicContact CD2-CG1 4.03Å
338	T	94.1	Very high	90	Very high	73 Å²	73	62.9 Å²	62.9	45%	0.448	31%	0.309	S	S	.	.			trans	-71.3	156.3	166.2	67.6	0	0	0	0	111.2	H319 W340 E341 C342	H319-T338 VanDerWaalsContact CD2-C 3.4Å; T338-W340 PolarHBondContact O-N 3.21Å; T338-E341 VanDerWaalsContact CB-OE2 3.28Å; T338-E341 WeakPolarHBondContact CB-OE2 3.28Å; T338-E341 WeakPolarHBondContact CG2-OE2 3.24Å; T338-E341 PolarHBondContact N-OE2 3.09Å; T338-E341 PolarHBondContact O-N 3.03Å; T338-E341 VanDerWaalsContact O-N 3.14Å; T338-E341 WeakPolarHBondContact OG1-CG 3.37Å; T338-E341 PolarHBondContact OG1-N 2.93Å; T338-E341 PolarHBondContact OG1-OE2 3.39Å; T338-C342 PolarHBondContact O-N 3.23Å
339	Y	94.4	Very high	90.5	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.008	29%	0.291	C	S	.	.	H	α-helix	trans	-54.6	-36.8	176.5	179.4	-104.3	0	0	0	112.4	Y195 F196 S199 L312 A315 H319 C342 V343	Y195-Y339 HydrophobicContact CE1-CD2 4.03Å; Y195-Y339 AromaticContact CE1-CE2 3.69Å; Y195-Y339 HydrophobicContact CE1-CE2 3.69Å; Y195-Y339 AromaticContact CE1-CZ 4Å; Y195-Y339 VanDerWaalsContact OH-CD2 3.3Å; Y195-Y339 WeakPolarHBondContact OH-CD2 3.38Å; Y195-Y339 WeakPolarHBondContact OH-CE2 3.47Å; F196-Y339 HydrophobicContact CD1-CD1 4.01Å; F196-Y339 AromaticContact CD1-CE1 3.62Å; F196-Y339 HydrophobicContact CD1-CE1 3.62Å; F196-Y339 HydrophobicContact CE1-CD1 4.22Å; F196-Y339 AromaticContact CE1-CE1 3.37Å; F196-Y339 HydrophobicContact CE1-CE1 3.37Å; F196-Y339 AromaticContact CE1-CZ 3.74Å; F196-Y339 HydrophobicContact CZ-CE1 4.34Å; S199-Y339 WeakPolarHBondContact OG-CB 3.25Å; L312-Y339 WeakPolarHBondContact CA-OH 3.49Å; L312-Y339 WeakPolarHBondContact CB-OH 3.36Å; L312-Y339 HydrophobicContact CD2-CE1 4.44Å; L312-Y339 WeakPolarHBondContact CD2-OH 2.92Å; L312-Y339 PolarHBondContact O-OH 3.45Å; A315-Y339 HydrophobicContact CB-CE2 4.1Å; H319-Y339 HydrophobicContact CB-CD2 4.27Å; H319-Y339 WeakPolarHBondContact CD2-CA 3.42Å; H319-Y339 PolarHBondContact CD2-N 3.46Å; H319-Y339 PolarHBondContact NE2-N 2.93Å; H319-Y339 VanDerWaalsContact NE2-N 3.15Å; Y339-C342 WeakPolarHBondContact O-CB 3.44Å; Y339-C342 PolarHBondContact O-N 2.71Å; Y339-V343 HydrophobicContact CD1-CG2 3.95Å; Y339-V343 HydrophobicContact CE1-CG2 3.49Å; Y339-V343 VanDerWaalsContact CE1-CG2 3.49Å; Y339-V343 HydrophobicContact CE2-CG2 4.29Å; Y339-V343 WeakPolarHBondContact O-CG2 3.32Å; Y339-V343 PolarHBondContact O-N 2.86Å
340	W	95.1	Very high	91	Very high	139 Å²	139	52.8 Å²	52.8	53%	0.527	27%	0.27	S	S	.	.	H	α-helix	trans	-72.7	-31.7	-178.6	-56.5	115.1	0	0	0	113.3	F196 T338 V343 Y344	F196-W340 HydrophobicContact CB-CZ2 4.13Å; F196-W340 HydrophobicContact CD1-CH2 4.18Å; F196-W340 HydrophobicContact CD1-CZ2 4.35Å; F196-W340 HydrophobicContact CD2-CH2 4.06Å; F196-W340 HydrophobicContact CD2-CZ2 4.33Å; F196-W340 HydrophobicContact CE1-CH2 4.33Å; F196-W340 HydrophobicContact CE2-CH2 4.2Å; F196-W340 HydrophobicContact CG-CH2 4.06Å; F196-W340 HydrophobicContact CG-CZ2 4.04Å; F196-W340 HydrophobicContact CZ-CH2 4.32Å; T338-W340 PolarHBondContact O-N 3.21Å; W340-V343 HydrophobicContact CE3-CB 4.38Å; W340-V343 HydrophobicContact CE3-CG1 4.47Å; W340-V343 HydrophobicContact CE3-CG2 4.19Å; W340-V343 HydrophobicContact CZ3-CG2 4.46Å; W340-V343 PolarHBondContact O-N 3.34Å; W340-Y344 WeakPolarHBondContact O-CB 3.32Å; W340-Y344 PolarHBondContact O-N 3.11Å
341	E	95	Very high	91.4	Very high	76 Å²	76	48.2 Å²	48.2	36%	0.355	25%	0.248	S	C	.	.	H	α-helix	trans	-67.8	-35.9	169.6	-71.1	160.8	120.8	0	0	111.6	L337 T338 Y344 L345	L337-E341 HydrophobicContact CD2-CB 4.27Å; T338-E341 VanDerWaalsContact CB-OE2 3.28Å; T338-E341 WeakPolarHBondContact CB-OE2 3.28Å; T338-E341 WeakPolarHBondContact CG2-OE2 3.24Å; T338-E341 PolarHBondContact N-OE2 3.09Å; T338-E341 PolarHBondContact O-N 3.03Å; T338-E341 VanDerWaalsContact O-N 3.14Å; T338-E341 WeakPolarHBondContact OG1-CG 3.37Å; T338-E341 PolarHBondContact OG1-N 2.93Å; T338-E341 PolarHBondContact OG1-OE2 3.39Å; E341-Y344 PolarHBondContact O-N 3.2Å; E341-L345 VanDerWaalsContact O-CB 3.3Å; E341-L345 WeakPolarHBondContact O-CB 3.4Å; E341-L345 PolarHBondContact O-N 3.28Å
342	C	94.9	Very high	92	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-40.7	171.6	-67.6	0	0	0	0	112.6	I318 H319 T338 Y339 Y344 L345 L346	I318-C342 HydrophobicContact CG2-CB 3.87Å; H319-C342 VanDerWaalsContact CA-SG 3.59Å; H319-C342 HydrophobicContact CB-CB 4.11Å; T338-C342 PolarHBondContact O-N 3.23Å; Y339-C342 WeakPolarHBondContact O-CB 3.44Å; Y339-C342 PolarHBondContact O-N 2.71Å; C342-Y344 VanDerWaalsContact C-N 3.35Å; C342-L345 PolarHBondContact O-N 3.18Å; C342-L346 WeakPolarHBondContact O-CG 3.48Å; C342-L346 PolarHBondContact O-N 2.73Å; C342-L346 VanDerWaalsContact O-N 3.11Å
343	V	95.9	Very high	92.7	Very high	13 Å²	13	45.9 Å²	45.9	8%	0.079	25%	0.25	C	C	.	.	H	α-helix	trans	-60.6	-44.1	173.4	168	0	0	0	0	110.9	W311 L312 A315 Y339 W340 M347	W311-V343 HydrophobicContact CH2-CG1 3.87Å; W311-V343 HydrophobicContact CZ2-CG1 3.26Å; W311-V343 PolarHBondContact NE1-O 2.87Å; L312-V343 HydrophobicContact CD2-CG2 4.23Å; A315-V343 HydrophobicContact CB-CB 4.3Å; A315-V343 HydrophobicContact CB-CG2 3.52Å; Y339-V343 HydrophobicContact CD1-CG2 3.95Å; Y339-V343 HydrophobicContact CE1-CG2 3.49Å; Y339-V343 VanDerWaalsContact CE1-CG2 3.49Å; Y339-V343 HydrophobicContact CE2-CG2 4.29Å; Y339-V343 WeakPolarHBondContact O-CG2 3.32Å; Y339-V343 PolarHBondContact O-N 2.86Å; W340-V343 HydrophobicContact CE3-CB 4.38Å; W340-V343 HydrophobicContact CE3-CG1 4.47Å; W340-V343 HydrophobicContact CE3-CG2 4.19Å; W340-V343 HydrophobicContact CZ3-CG2 4.46Å; W340-V343 PolarHBondContact O-N 3.34Å; V343-M347 PolarHBondContact O-N 3.34Å; V343-M347 VanDerWaalsContact O-N 3.16Å
344	Y	96.1	Very high	92.9	Very high	92 Å²	92	46.1 Å²	46.1	36%	0.361	26%	0.263	S	S	.	.	H	α-helix	trans	-61.4	-52.5	174.4	173.6	-99.7	0	0	0	112.3	W340 E341 C342 L346 M347 V348 Y355 D357 V358	W340-Y344 WeakPolarHBondContact O-CB 3.32Å; W340-Y344 PolarHBondContact O-N 3.11Å; E341-Y344 PolarHBondContact O-N 3.2Å; C342-Y344 VanDerWaalsContact C-N 3.35Å; Y344-L346 VanDerWaalsContact C-N 3.29Å; Y344-L346 PolarHBondContact O-N 2.82Å; Y344-M347 PolarHBondContact O-N 3.43Å; Y344-V348 HydrophobicContact CD1-CG2 4.29Å; Y344-V348 HydrophobicContact CD2-CG2 4.11Å; Y344-V348 HydrophobicContact CE1-CG2 3.88Å; Y344-V348 HydrophobicContact CE2-CG2 3.69Å; Y344-V348 HydrophobicContact CG-CG2 4.39Å; Y344-V348 WeakPolarHBondContact O-CG2 3.5Å; Y344-V348 PolarHBondContact O-N 2.67Å; Y344-Y355 VanDerWaalsContact OH-CD2 3.31Å; Y344-Y355 WeakPolarHBondContact OH-CD2 3.29Å; Y344-D357 PolarHBondContact OH-OD2 2.66Å; Y344-V358 HydrophobicContact CD1-CG2 4.3Å; Y344-V358 HydrophobicContact CE1-CG2 4.43Å
345	L	95.1	Very high	93.2	Very high	9 Å²	9	49.8 Å²	49.8	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-49.9	-48.2	177.3	168.4	61.5	0	0	0	111.7	E341 C342 T349 V358 M369	E341-L345 VanDerWaalsContact O-CB 3.3Å; E341-L345 WeakPolarHBondContact O-CB 3.4Å; E341-L345 PolarHBondContact O-N 3.28Å; C342-L345 PolarHBondContact O-N 3.18Å; L345-T349 VanDerWaalsContact O-CB 3.3Å; L345-T349 WeakPolarHBondContact O-CB 3.41Å; L345-T349 PolarHBondContact O-N 3.23Å; L345-T349 PolarHBondContact O-OG1 2.96Å; L345-V358 HydrophobicContact CB-CG1 4.1Å; L345-V358 WeakPolarHBondContact CD1-O 3.42Å; L345-V358 HydrophobicContact CD2-CG1 4.38Å; L345-M369 HydrophobicContact CD1-CE 4.02Å; L345-M369 HydrophobicContact CD2-CE 4.38Å; L345-M369 HydrophobicContact CD2-SD 4.48Å; L345-M369 HydrophobicContact CG-CE 4.08Å
346	L	95.1	Very high	93.4	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-70.1	-35.3	-179.3	-64.3	-162.4	0	0	0	112.8	A314 A315 I318 C342 Y344 T349 M350 M369 F372	A314-L346 HydrophobicContact CB-CD1 3.45Å; A314-L346 VanDerWaalsContact CB-CD1 3.45Å; A315-L346 HydrophobicContact CB-CD1 4.14Å; A315-L346 VanDerWaalsContact N-CD1 3.25Å; I318-L346 HydrophobicContact CG2-CD1 4.34Å; I318-L346 HydrophobicContact CG2-CD2 4.35Å; I318-L346 HydrophobicContact CG2-CG 4.34Å; C342-L346 WeakPolarHBondContact O-CG 3.48Å; C342-L346 PolarHBondContact O-N 2.73Å; C342-L346 VanDerWaalsContact O-N 3.11Å; Y344-L346 VanDerWaalsContact C-N 3.29Å; Y344-L346 PolarHBondContact O-N 2.82Å; L346-T349 PolarHBondContact O-N 2.81Å; L346-M350 WeakPolarHBondContact O-CB 3.46Å; L346-M350 VanDerWaalsContact O-CG 3.23Å; L346-M350 WeakPolarHBondContact O-CG 3.47Å; L346-M350 PolarHBondContact O-N 2.99Å; L346-M369 HydrophobicContact CD2-CE 3.93Å; L346-M369 HydrophobicContact CD2-SD 3.48Å; L346-M369 WeakPolarHBondContact CD2-SD 3.41Å; L346-F372 HydrophobicContact CB-CE1 3.88Å; L346-F372 HydrophobicContact CB-CZ 3.96Å; L346-F372 HydrophobicContact CD1-CD2 4.44Å; L346-F372 HydrophobicContact CD1-CE1 4.18Å; L346-F372 HydrophobicContact CD1-CE2 4.04Å; L346-F372 HydrophobicContact CD1-CZ 3.9Å; L346-F372 HydrophobicContact CD2-CD1 3.82Å; L346-F372 HydrophobicContact CD2-CE1 3.81Å; L346-F372 HydrophobicContact CD2-CG 4.39Å; L346-F372 HydrophobicContact CD2-CZ 4.37Å; L346-F372 HydrophobicContact CG-CE1 4.16Å; L346-F372 HydrophobicContact CG-CZ 4.31Å
347	M	93.6	Very high	93.7	Very high	55 Å²	55	51.4 Å²	51.4	27%	0.271	28%	0.281	S	S	.	.	H	α-helix	trans	-66.2	-44.3	175.3	-177.1	53.9	61.8	0	0	111.9	F307 W311 V343 Y344 T349 M350 S351	F307-M347 HydrophobicContact CE1-CE 4.21Å; F307-M347 HydrophobicContact CZ-CE 4.3Å; W311-M347 HydrophobicContact CD2-CE 3.83Å; W311-M347 HydrophobicContact CE3-CE 4.06Å; W311-M347 HydrophobicContact CH2-CE 3.73Å; W311-M347 HydrophobicContact CZ2-CB 3.87Å; W311-M347 HydrophobicContact CZ2-CE 3.46Å; W311-M347 VanDerWaalsContact CZ2-CE 3.46Å; W311-M347 HydrophobicContact CZ2-CG 4.33Å; W311-M347 HydrophobicContact CZ3-CE 4.02Å; V343-M347 PolarHBondContact O-N 3.34Å; V343-M347 VanDerWaalsContact O-N 3.16Å; Y344-M347 PolarHBondContact O-N 3.43Å; M347-T349 VanDerWaalsContact C-N 3.26Å; M347-T349 PolarHBondContact O-N 3.43Å; M347-M350 HydrophobicContact CE-SD 3.89Å; M347-M350 HydrophobicContact SD-CG 4.27Å; M347-M350 HydrophobicContact SD-SD 4.16Å; M347-S351 WeakPolarHBondContact O-CB 3.39Å; M347-S351 PolarHBondContact O-N 2.93Å; M347-S351 VanDerWaalsContact O-N 3.16Å; M347-S351 PolarHBondContact O-OG 2.69Å
348	V	94.7	Very high	93.8	Very high	14 Å²	14	52 Å²	52	9%	0.085	29%	0.285	C	S	.	.	H	α-helix	trans	-63.8	-31.8	174.3	170.3	0	0	0	0	111.8	Y344 S351 V353 G354 Y355	Y344-V348 HydrophobicContact CD1-CG2 4.29Å; Y344-V348 HydrophobicContact CD2-CG2 4.11Å; Y344-V348 HydrophobicContact CE1-CG2 3.88Å; Y344-V348 HydrophobicContact CE2-CG2 3.69Å; Y344-V348 HydrophobicContact CG-CG2 4.39Å; Y344-V348 WeakPolarHBondContact O-CG2 3.5Å; Y344-V348 PolarHBondContact O-N 2.67Å; V348-S351 PolarHBondContact O-OG 3.05Å; V348-V353 HydrophobicContact CG1-CB 4.33Å; V348-V353 PolarHBondContact O-N 2.84Å; V348-G354 PolarHBondContact O-N 3.47Å; V348-G354 VanDerWaalsContact O-N 3.13Å; V348-Y355 HydrophobicContact CG1-CD2 3.69Å; V348-Y355 HydrophobicContact CG1-CE2 4.39Å; V348-Y355 HydrophobicContact CG1-CG 4.34Å; V348-Y355 HydrophobicContact CG2-CD2 3.96Å; V348-Y355 HydrophobicContact CG2-CE2 4.18Å
349	T	93.8	Very high	93.7	Very high	24 Å²	24	53.8 Å²	53.8	15%	0.147	28%	0.284	C	S	.	.	H	α-helix	trans	-77.8	-47.9	177.9	-57.8	0	0	0	0	112.4	L345 L346 M347 S351 T352 M369 I373	L345-T349 VanDerWaalsContact O-CB 3.3Å; L345-T349 WeakPolarHBondContact O-CB 3.41Å; L345-T349 PolarHBondContact O-N 3.23Å; L345-T349 PolarHBondContact O-OG1 2.96Å; L346-T349 PolarHBondContact O-N 2.81Å; M347-T349 VanDerWaalsContact C-N 3.26Å; M347-T349 PolarHBondContact O-N 3.43Å; T349-S351 VanDerWaalsContact C-N 3.31Å; T349-S351 PolarHBondContact O-N 3.39Å; T349-T352 WeakPolarHBondContact O-CA 3.42Å; T349-T352 PolarHBondContact O-N 3.4Å; T349-M369 HydrophobicContact CG2-CE 3.8Å; T349-M369 WeakPolarHBondContact OG1-CE 3.31Å; T349-I373 HydrophobicContact CG2-CD1 4.08Å; T349-I373 HydrophobicContact CG2-CG1 3.46Å; T349-I373 VanDerWaalsContact CG2-CG1 3.46Å
350	M	91.4	Very high	93.7	Very high	5 Å²	5	54.1 Å²	54.1	3%	0.025	29%	0.287	C	S	.	.	H	α-helix	trans	-70.9	-26.2	-176.6	71.3	-163.7	-64.9	0	0	113.2	F307 W311 L346 M347 F372 F380	F307-M350 HydrophobicContact CD2-CE 4.32Å; F307-M350 HydrophobicContact CE1-CE 4.41Å; F307-M350 HydrophobicContact CE2-CE 3.51Å; F307-M350 HydrophobicContact CZ-CE 3.56Å; F307-M350 HydrophobicContact CZ-SD 4.4Å; W311-M350 HydrophobicContact CG-SD 4.35Å; L346-M350 WeakPolarHBondContact O-CB 3.46Å; L346-M350 VanDerWaalsContact O-CG 3.23Å; L346-M350 WeakPolarHBondContact O-CG 3.47Å; L346-M350 PolarHBondContact O-N 2.99Å; M347-M350 HydrophobicContact CE-SD 3.89Å; M347-M350 HydrophobicContact SD-CG 4.27Å; M347-M350 HydrophobicContact SD-SD 4.16Å; M350-F372 HydrophobicContact CB-CE1 4.19Å; M350-F372 HydrophobicContact CB-CZ 4.41Å; M350-F380 HydrophobicContact CE-CD2 4.33Å; M350-F380 HydrophobicContact CG-CD2 3.99Å; M350-F380 WeakPolarHBondContact O-CB 3.44Å; M350-F380 WeakPolarHBondContact O-CG 3.27Å
351	S	91.3	Very high	93.5	Very high	31 Å²	31	52.4 Å²	52.4	22%	0.217	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	4.3	169	59.7	0	0	0	0	113.8	M347 V348 T349 V353	M347-S351 WeakPolarHBondContact O-CB 3.39Å; M347-S351 PolarHBondContact O-N 2.93Å; M347-S351 VanDerWaalsContact O-N 3.16Å; M347-S351 PolarHBondContact O-OG 2.69Å; V348-S351 PolarHBondContact O-OG 3.05Å; T349-S351 VanDerWaalsContact C-N 3.31Å; T349-S351 PolarHBondContact O-N 3.39Å; S351-V353 PolarHBondContact O-N 3.19Å; S351-V353 VanDerWaalsContact O-N 3.16Å
352	T	92.9	Very high	93.4	Very high	100 Å²	100	48.8 Å²	48.8	61%	0.613	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	24	179.8	67.3	0	0	0	0	115.6	T349 L377	T349-T352 WeakPolarHBondContact O-CA 3.42Å; T349-T352 PolarHBondContact O-N 3.4Å; T352-L377 HydrophobicContact CG2-CD1 3.75Å; T352-L377 HydrophobicContact CG2-CG 4.22Å
353	V	94.6	Very high	93.3	Very high	75 Å²	75	52.3 Å²	52.3	46%	0.455	29%	0.289	S	S	.	.			trans	-80.6	-42.9	-179.6	177	0	0	0	0	111.4	V348 S351 Y355	V348-V353 HydrophobicContact CG1-CB 4.33Å; V348-V353 PolarHBondContact O-N 2.84Å; S351-V353 PolarHBondContact O-N 3.19Å; S351-V353 VanDerWaalsContact O-N 3.16Å; V353-Y355 HydrophobicContact CG1-CD1 4.07Å; V353-Y355 HydrophobicContact CG1-CD2 4.05Å; V353-Y355 HydrophobicContact CG1-CE1 3.67Å; V353-Y355 HydrophobicContact CG1-CE2 3.64Å; V353-Y355 HydrophobicContact CG1-CG 4.25Å; V353-Y355 VanDerWaalsContact CG1-CZ 3.43Å; V353-Y355 PolarHBondContact O-N 3.05Å
354	G	91.4	Very high	93	Very high	53 Å²	53	54.7 Å²	54.7	55%	0.546	30%	0.3	S	S	.	.			trans	58.1	46.8	165.1	0	0	0	0	0	117	V348 G356	V348-G354 PolarHBondContact O-N 3.47Å; V348-G354 VanDerWaalsContact O-N 3.13Å; G354-G356 VanDerWaalsContact C-N 3.25Å; G354-G356 PolarHBondContact O-N 3.23Å; G354-G356 VanDerWaalsContact O-N 3.15Å
355	Y	93.2	Very high	92.9	Very high	160 Å²	160	50.3 Å²	50.3	63%	0.627	28%	0.283	S	S	*	.			trans	-53.8	-33.4	-177	-66.5	-61.8	0	0	0	115.3	Y344 V348 V353 D357	Y344-Y355 VanDerWaalsContact OH-CD2 3.31Å; Y344-Y355 WeakPolarHBondContact OH-CD2 3.29Å; V348-Y355 HydrophobicContact CG1-CD2 3.69Å; V348-Y355 HydrophobicContact CG1-CE2 4.39Å; V348-Y355 HydrophobicContact CG1-CG 4.34Å; V348-Y355 HydrophobicContact CG2-CD2 3.96Å; V348-Y355 HydrophobicContact CG2-CE2 4.18Å; V353-Y355 HydrophobicContact CG1-CD1 4.07Å; V353-Y355 HydrophobicContact CG1-CD2 4.05Å; V353-Y355 HydrophobicContact CG1-CE1 3.67Å; V353-Y355 HydrophobicContact CG1-CE2 3.64Å; V353-Y355 HydrophobicContact CG1-CG 4.25Å; V353-Y355 VanDerWaalsContact CG1-CZ 3.43Å; V353-Y355 PolarHBondContact O-N 3.05Å; Y355-D357 VanDerWaalsContact C-N 3.3Å; Y355-D357 WeakPolarHBondContact CB-OD1 3.47Å; Y355-D357 PolarHBondContact O-N 3.05Å
356	G	91.1	Very high	92.8	Very high	48 Å²	48	56.5 Å²	56.5	50%	0.495	31%	0.306	S	S	.	.	S	Bend	trans	77.9	10	178	0	0	0	0	0	115.2	G354 Y359	G354-G356 VanDerWaalsContact C-N 3.25Å; G354-G356 PolarHBondContact O-N 3.23Å; G354-G356 VanDerWaalsContact O-N 3.15Å; G356-Y359 WeakPolarHBondContact O-CD1 3.23Å
357	D	92.9	Very high	92.8	Very high	98 Å²	98	61.1 Å²	61.1	52%	0.524	33%	0.33	S	S	.	.	S	Bend	trans	-71	-46.5	171.3	59.9	-27.9	0	0	0	111.8	Y344 Y355	Y344-D357 PolarHBondContact OH-OD2 2.66Å; Y355-D357 VanDerWaalsContact C-N 3.3Å; Y355-D357 WeakPolarHBondContact CB-OD1 3.47Å; Y355-D357 PolarHBondContact O-N 3.05Å
358	V	92.7	Very high	92.9	Very high	26 Å²	26	60.6 Å²	60.6	16%	0.158	33%	0.326	C	S	.	.	S	Bend	trans	-107.9	134.9	167.6	-174.6	0	0	0	0	108.5	L337 Y344 L345	L337-V358 HydrophobicContact CD1-CG1 4.27Å; L337-V358 HydrophobicContact CD2-CG1 4.03Å; Y344-V358 HydrophobicContact CD1-CG2 4.3Å; Y344-V358 HydrophobicContact CE1-CG2 4.43Å; L345-V358 HydrophobicContact CB-CG1 4.1Å; L345-V358 WeakPolarHBondContact CD1-O 3.42Å; L345-V358 HydrophobicContact CD2-CG1 4.38Å
359	Y	93.1	Very high	92.9	Very high	110 Å²	110	60.9 Å²	60.9	43%	0.431	33%	0.327	S	S	.	.			trans	-157.5	161.5	175.8	60	-87.6	0	0	0	111.8	Q335 G356 K361	Q335-Y359 PolarHBondContact NE2-O 2.7Å; G356-Y359 WeakPolarHBondContact O-CD1 3.23Å; Y359-K361 HydrophobicContact CD2-CG 4.15Å; Y359-K361 HydrophobicContact CE2-CD 4.36Å; Y359-K361 HydrophobicContact CE2-CG 3.66Å
360	A	93.6	Very high	92.9	Very high	9 Å²	9	63.9 Å²	63.9	7%	0.074	35%	0.345	C	S	.	.			trans	-76.4	123.7	176.5	0	0	0	0	0	111.7	I318 E322 R366 M369	I318-A360 HydrophobicContact CD1-CB 4.22Å; E322-A360 WeakPolarHBondContact OE1-CB 3.49Å; A360-R366 HydrophobicContact CB-CG 4.26Å; A360-R366 WeakPolarHBondContact O-CG 3.46Å; A360-R366 PolarHBondContact O-NE 3.08Å; A360-M369 HydrophobicContact CB-CG 4.04Å
361	K	90.9	Very high	93	Very high	102 Å²	102	70 Å²	70	44%	0.443	37%	0.372	S	S	.	.			trans	-95.6	-31.6	174.4	-75.8	-175.8	-162.5	128.3	0	112.7	E322 Y359	E322-K361 PolarHBondContact OE1-N 3.08Å; E322-K361 PolarHBondContact OE2-N 3.33Å; Y359-K361 HydrophobicContact CD2-CG 4.15Å; Y359-K361 HydrophobicContact CE2-CD 4.36Å; Y359-K361 HydrophobicContact CE2-CG 3.66Å
362	T	93.2	Very high	93.1	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	37%	0.365	C	S	.	.	S	Bend	trans	-68.3	153.8	179.6	71.4	0	0	0	0	111.5	V321 E322 G365 R366	V321-T362 WeakPolarHBondContact CG1-OG1 3.34Å; E322-T362 WeakPolarHBondContact OE1-CB 3.4Å; E322-T362 PolarHBondContact OE1-N 3.3Å; E322-T362 PolarHBondContact OE1-OG1 3.47Å; E322-T362 PolarHBondContact OE2-N 2.97Å; T362-G365 PolarHBondContact O-N 3.47Å; T362-G365 WeakPolarHBondContact OG1-CA 3.23Å; T362-G365 PolarHBondContact OG1-N 3.37Å; T362-R366 VanDerWaalsContact O-CG 3.31Å; T362-R366 WeakPolarHBondContact O-CG 3.33Å; T362-R366 PolarHBondContact O-N 2.9Å
363	T	91.7	Very high	93.2	Very high	75 Å²	75	68.3 Å²	68.3	46%	0.46	36%	0.355	S	S	.	.	H	α-helix	trans	-69.4	-43.6	179.5	-45.3	0	0	0	0	110.3	D326 W328 R366 L367	D326-T363 PolarHBondContact OD1-N 3.23Å; D326-T363 WeakPolarHBondContact OD2-CB 3.24Å; D326-T363 PolarHBondContact OD2-N 2.94Å; D326-T363 PolarHBondContact OD2-OG1 3.01Å; W328-T363 HydrophobicContact CZ2-CG2 4Å; T363-R366 PolarHBondContact O-N 3.21Å; T363-L367 WeakPolarHBondContact O-CB 3.37Å; T363-L367 PolarHBondContact O-N 2.97Å
364	L	91.2	Very high	93.1	Very high	63 Å²	63	70.8 Å²	70.8	33%	0.33	37%	0.365	S	S	.	.	H	α-helix	trans	-61.4	-41.9	172.6	-73.4	171.3	0	0	0	112.1	V321 D326 W328 L367 F368	V321-L364 HydrophobicContact CG1-CB 3.57Å; D326-L364 WeakPolarHBondContact OD1-CB 3.34Å; D326-L364 WeakPolarHBondContact OD1-CG 3.45Å; D326-L364 PolarHBondContact OD1-N 3.06Å; W328-L364 HydrophobicContact CH2-CD1 4.15Å; W328-L364 HydrophobicContact CH2-CD2 3.76Å; W328-L364 HydrophobicContact CH2-CG 3.65Å; W328-L364 HydrophobicContact CZ2-CG 4.28Å; W328-L364 HydrophobicContact CZ3-CD1 4.4Å; W328-L364 HydrophobicContact CZ3-CD2 4.43Å; W328-L364 HydrophobicContact CZ3-CG 4.37Å; L364-L367 PolarHBondContact O-N 3.18Å; L364-F368 PolarHBondContact O-N 3.1Å
365	G	93.3	Very high	93	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-64.1	-45.5	178.6	0	0	0	0	0	112	T362 L367 F368 M369	T362-G365 PolarHBondContact O-N 3.47Å; T362-G365 WeakPolarHBondContact OG1-CA 3.23Å; T362-G365 PolarHBondContact OG1-N 3.37Å; G365-L367 PolarHBondContact O-N 3.47Å; G365-F368 WeakPolarHBondContact O-CB 3.44Å; G365-F368 PolarHBondContact O-N 3.06Å; G365-M369 VanDerWaalsContact O-CG 3.27Å; G365-M369 WeakPolarHBondContact O-CG 3.4Å; G365-M369 PolarHBondContact O-N 3.06Å
366	R	93.8	Very high	92.8	Very high	139 Å²	139	62.3 Å²	62.3	53%	0.525	33%	0.326	S	S	.	.	H	α-helix	trans	-61.1	-42.6	174	-72.2	170.5	-179.5	-177.9	1.5	112.7	A360 T362 T363 F368 M369 V370	A360-R366 HydrophobicContact CB-CG 4.26Å; A360-R366 WeakPolarHBondContact O-CG 3.46Å; A360-R366 PolarHBondContact O-NE 3.08Å; T362-R366 VanDerWaalsContact O-CG 3.31Å; T362-R366 WeakPolarHBondContact O-CG 3.33Å; T362-R366 PolarHBondContact O-N 2.9Å; T363-R366 PolarHBondContact O-N 3.21Å; R366-F368 VanDerWaalsContact C-N 3.34Å; R366-F368 PolarHBondContact O-N 2.74Å; R366-M369 PolarHBondContact O-N 3.13Å; R366-V370 PolarHBondContact O-N 2.77Å; R366-V370 VanDerWaalsContact O-N 3.1Å
367	L	94.6	Very high	92.8	Very high	97 Å²	97	64 Å²	64	51%	0.508	32%	0.323	S	S	.	.	H	α-helix	trans	-60.7	-43.8	175.5	-178.8	62.5	0	0	0	111.4	T363 L364 G365 V370 F371	T363-L367 WeakPolarHBondContact O-CB 3.37Å; T363-L367 PolarHBondContact O-N 2.97Å; L364-L367 PolarHBondContact O-N 3.18Å; G365-L367 PolarHBondContact O-N 3.47Å; L367-V370 PolarHBondContact O-N 2.79Å; L367-F371 HydrophobicContact CD1-CD2 4.43Å; L367-F371 HydrophobicContact CD1-CE2 3.79Å; L367-F371 HydrophobicContact CG-CD2 4.44Å; L367-F371 HydrophobicContact CG-CE2 4.05Å; L367-F371 VanDerWaalsContact O-CD2 3.26Å; L367-F371 WeakPolarHBondContact O-CD2 3.32Å; L367-F371 PolarHBondContact O-N 2.82Å
368	F	95.4	Very high	92.6	Very high	43 Å²	43	62 Å²	62	19%	0.189	32%	0.321	C	S	.	.	H	α-helix	trans	-61.5	-44.5	173.8	176.4	-101.1	0	0	0	112.3	A314 F317 I318 L364 G365 R366 V370 F371 F372	A314-F368 HydrophobicContact CB-CE1 4.41Å; A314-F368 HydrophobicContact CB-CZ 3.89Å; F317-F368 HydrophobicContact CB-CE2 4.44Å; F317-F368 HydrophobicContact CB-CZ 4.28Å; F317-F368 HydrophobicContact CD1-CB 4.3Å; F317-F368 AromaticContact CD1-CD1 3.98Å; F317-F368 HydrophobicContact CD1-CD1 3.98Å; F317-F368 AromaticContact CD1-CD2 3.36Å; F317-F368 HydrophobicContact CD1-CD2 3.36Å; F317-F368 HydrophobicContact CD1-CE1 4.11Å; F317-F368 AromaticContact CD1-CE2 3.52Å; F317-F368 HydrophobicContact CD1-CE2 3.52Å; F317-F368 AromaticContact CD1-CG 3.59Å; F317-F368 HydrophobicContact CD1-CG 3.59Å; F317-F368 AromaticContact CD1-CZ 3.89Å; F317-F368 HydrophobicContact CD1-CZ 3.89Å; F317-F368 HydrophobicContact CE1-CB 3.91Å; F317-F368 HydrophobicContact CE1-CD1 4.44Å; F317-F368 AromaticContact CE1-CD2 3.4Å; F317-F368 HydrophobicContact CE1-CD2 3.4Å; F317-F368 HydrophobicContact CE1-CE2 4Å; F317-F368 AromaticContact CE1-CG 3.65Å; F317-F368 HydrophobicContact CE1-CG 3.65Å; F317-F368 HydrophobicContact CG-CD2 4.3Å; F317-F368 HydrophobicContact CG-CE2 4.06Å; F317-F368 HydrophobicContact CG-CZ 4.36Å; F317-F368 HydrophobicContact CZ-CD2 4.36Å; I318-F368 HydrophobicContact CB-CD1 4.14Å; I318-F368 HydrophobicContact CB-CE1 4.19Å; I318-F368 HydrophobicContact CD1-CD1 4.28Å; L364-F368 PolarHBondContact O-N 3.1Å; G365-F368 WeakPolarHBondContact O-CB 3.44Å; G365-F368 PolarHBondContact O-N 3.06Å; R366-F368 VanDerWaalsContact C-N 3.34Å; R366-F368 PolarHBondContact O-N 2.74Å; F368-V370 VanDerWaalsContact C-N 3.28Å; F368-V370 PolarHBondContact O-N 3.07Å; F368-F371 PolarHBondContact O-N 3.32Å; F368-F371 VanDerWaalsContact O-N 3.15Å; F368-F372 HydrophobicContact CD1-CB 4.45Å; F368-F372 HydrophobicContact CE1-CB 4.1Å; F368-F372 HydrophobicContact CE1-CD2 4.46Å; F368-F372 HydrophobicContact CE1-CG 4.39Å; F368-F372 HydrophobicContact CZ-CB 4.32Å; F368-F372 HydrophobicContact CZ-CD2 4.3Å; F368-F372 WeakPolarHBondContact O-CB 3.25Å; F368-F372 PolarHBondContact O-N 3.09Å
369	M	93.8	Very high	92.5	Very high	21 Å²	21	63 Å²	63	10%	0.103	32%	0.324	C	S	.	.	H	α-helix	trans	-59.9	-35.6	178.8	-69.7	-62.8	-71.8	0	0	112.4	L345 L346 T349 A360 G365 R366 F372 I373	L345-M369 HydrophobicContact CD1-CE 4.02Å; L345-M369 HydrophobicContact CD2-CE 4.38Å; L345-M369 HydrophobicContact CD2-SD 4.48Å; L345-M369 HydrophobicContact CG-CE 4.08Å; L346-M369 HydrophobicContact CD2-CE 3.93Å; L346-M369 HydrophobicContact CD2-SD 3.48Å; L346-M369 WeakPolarHBondContact CD2-SD 3.41Å; T349-M369 HydrophobicContact CG2-CE 3.8Å; T349-M369 WeakPolarHBondContact OG1-CE 3.31Å; A360-M369 HydrophobicContact CB-CG 4.04Å; G365-M369 VanDerWaalsContact O-CG 3.27Å; G365-M369 WeakPolarHBondContact O-CG 3.4Å; G365-M369 PolarHBondContact O-N 3.06Å; R366-M369 PolarHBondContact O-N 3.13Å; M369-F372 PolarHBondContact O-N 3.11Å; M369-I373 WeakPolarHBondContact O-CB 3.41Å; M369-I373 WeakPolarHBondContact O-CD1 3.43Å; M369-I373 WeakPolarHBondContact O-CG1 3.04Å; M369-I373 PolarHBondContact O-N 3.34Å
370	V	94.5	Very high	92.4	Very high	86 Å²	86	60.5 Å²	60.5	52%	0.521	32%	0.316	S	S	.	.	H	α-helix	trans	-61.6	-47.7	174	172	0	0	0	0	111.5	R366 L367 F368 L374	R366-V370 PolarHBondContact O-N 2.77Å; R366-V370 VanDerWaalsContact O-N 3.1Å; L367-V370 PolarHBondContact O-N 2.79Å; F368-V370 VanDerWaalsContact C-N 3.28Å; F368-V370 PolarHBondContact O-N 3.07Å; V370-L374 PolarHBondContact O-N 3.14Å
371	F	93.6	Very high	92.2	Very high	134 Å²	134	63.2 Å²	63.2	59%	0.588	34%	0.338	S	S	*	.	H	α-helix	trans	-67.2	-38.6	176	-69.8	-67.1	0	0	0	112.4	L367 F368 L374 G375	L367-F371 HydrophobicContact CD1-CD2 4.43Å; L367-F371 HydrophobicContact CD1-CE2 3.79Å; L367-F371 HydrophobicContact CG-CD2 4.44Å; L367-F371 HydrophobicContact CG-CE2 4.05Å; L367-F371 VanDerWaalsContact O-CD2 3.26Å; L367-F371 WeakPolarHBondContact O-CD2 3.32Å; L367-F371 PolarHBondContact O-N 2.82Å; F368-F371 PolarHBondContact O-N 3.32Å; F368-F371 VanDerWaalsContact O-N 3.15Å; F371-L374 PolarHBondContact O-N 3.17Å; F371-G375 PolarHBondContact O-N 3.5Å; F371-G375 VanDerWaalsContact O-N 3.12Å
372	F	94.3	Very high	92.2	Very high	17 Å²	17	61.2 Å²	61.2	8%	0.075	34%	0.337	C	S	.	.	H	α-helix	trans	-67.5	-34.8	178.1	-177.2	-95.5	0	0	0	112.5	A314 L346 M350 F368 M369 G376	A314-F372 HydrophobicContact CB-CD2 3.76Å; A314-F372 HydrophobicContact CB-CE2 3.51Å; A314-F372 HydrophobicContact CB-CZ 4.45Å; L346-F372 HydrophobicContact CB-CE1 3.88Å; L346-F372 HydrophobicContact CB-CZ 3.96Å; L346-F372 HydrophobicContact CD1-CD2 4.44Å; L346-F372 HydrophobicContact CD1-CE1 4.18Å; L346-F372 HydrophobicContact CD1-CE2 4.04Å; L346-F372 HydrophobicContact CD1-CZ 3.9Å; L346-F372 HydrophobicContact CD2-CD1 3.82Å; L346-F372 HydrophobicContact CD2-CE1 3.81Å; L346-F372 HydrophobicContact CD2-CG 4.39Å; L346-F372 HydrophobicContact CD2-CZ 4.37Å; L346-F372 HydrophobicContact CG-CE1 4.16Å; L346-F372 HydrophobicContact CG-CZ 4.31Å; M350-F372 HydrophobicContact CB-CE1 4.19Å; M350-F372 HydrophobicContact CB-CZ 4.41Å; F368-F372 HydrophobicContact CD1-CB 4.45Å; F368-F372 HydrophobicContact CE1-CB 4.1Å; F368-F372 HydrophobicContact CE1-CD2 4.46Å; F368-F372 HydrophobicContact CE1-CG 4.39Å; F368-F372 HydrophobicContact CZ-CB 4.32Å; F368-F372 HydrophobicContact CZ-CD2 4.3Å; F368-F372 WeakPolarHBondContact O-CB 3.25Å; F368-F372 PolarHBondContact O-N 3.09Å; M369-F372 PolarHBondContact O-N 3.11Å; F372-G376 VanDerWaalsContact O-CA 3.23Å; F372-G376 WeakPolarHBondContact O-CA 3.48Å; F372-G376 PolarHBondContact O-N 3.23Å
373	I	94	Very high	92.1	Very high	78 Å²	78	64 Å²	64	40%	0.4	35%	0.348	S	S	.	.	H	α-helix	trans	-62.2	-46.7	173.5	-74.3	160.9	0	0	0	110.3	T349 M369 L377	T349-I373 HydrophobicContact CG2-CD1 4.08Å; T349-I373 HydrophobicContact CG2-CG1 3.46Å; T349-I373 VanDerWaalsContact CG2-CG1 3.46Å; M369-I373 WeakPolarHBondContact O-CB 3.41Å; M369-I373 WeakPolarHBondContact O-CD1 3.43Å; M369-I373 WeakPolarHBondContact O-CG1 3.04Å; M369-I373 PolarHBondContact O-N 3.34Å; I373-L377 WeakPolarHBondContact O-CB 3.38Å; I373-L377 PolarHBondContact O-N 2.94Å
374	L	91.7	Very high	92	Very high	127 Å²	127	62.1 Å²	62.1	67%	0.665	34%	0.336	S	S	*	.	H	α-helix	trans	-61.9	-47.1	-179.6	-67.8	172	0	0	0	112.6	V370 F371	V370-L374 PolarHBondContact O-N 3.14Å; F371-L374 PolarHBondContact O-N 3.17Å
375	G	90.8	Very high	92	Very high	35 Å²	35	62.7 Å²	62.7	36%	0.361	34%	0.344	S	S	.	.	H	α-helix	trans	-76.7	-41.4	178.6	0	0	0	0	0	113.8	F371 A378 M379	F371-G375 PolarHBondContact O-N 3.5Å; F371-G375 VanDerWaalsContact O-N 3.12Å; G375-A378 PolarHBondContact O-N 3.31Å; G375-M379 WeakPolarHBondContact O-CG 3.37Å; G375-M379 PolarHBondContact O-N 3.37Å
376	G	89.3	Confident	91.8	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-67.6	-40.3	-176.2	0	0	0	0	0	113.2	F372 M379 F380	F372-G376 VanDerWaalsContact O-CA 3.23Å; F372-G376 WeakPolarHBondContact O-CA 3.48Å; F372-G376 PolarHBondContact O-N 3.23Å; G376-M379 PolarHBondContact O-N 3.03Å; G376-F380 VanDerWaalsContact O-CB 3.29Å; G376-F380 WeakPolarHBondContact O-CB 3.42Å; G376-F380 PolarHBondContact O-N 3.05Å
377	L	90	Very high	91.6	Very high	83 Å²	83	59.9 Å²	59.9	44%	0.435	34%	0.337	S	S	.	.	H	α-helix	trans	-63.6	-43.2	174.5	-171.5	158.5	0	0	0	110.8	T352 I373 F380 A381	T352-L377 HydrophobicContact CG2-CD1 3.75Å; T352-L377 HydrophobicContact CG2-CG 4.22Å; I373-L377 WeakPolarHBondContact O-CB 3.38Å; I373-L377 PolarHBondContact O-N 2.94Å; L377-F380 PolarHBondContact O-N 3.08Å; L377-A381 VanDerWaalsContact O-CB 3.23Å; L377-A381 WeakPolarHBondContact O-CB 3.41Å; L377-A381 PolarHBondContact O-N 3.48Å
378	A	90.1	Very high	91.3	Very high	58 Å²	58	60.5 Å²	60.5	48%	0.479	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-40.5	177.1	0	0	0	0	0	112.8	G375 S382	G375-A378 PolarHBondContact O-N 3.31Å; A378-S382 WeakPolarHBondContact O-CB 3.4Å; A378-S382 PolarHBondContact O-N 3.14Å; A378-S382 PolarHBondContact O-OG 3.36Å
379	M	89.9	Confident	90.8	Very high	45 Å²	45	64.7 Å²	64.7	22%	0.222	36%	0.36	C	S	.	.	H	α-helix	trans	-68.2	-43.6	174	-71.6	-174.6	-63.2	0	0	112.3	T310 G375 G376 S382 Y383	T310-M379 HydrophobicContact CG2-CE 3.84Å; T310-M379 HydrophobicContact CG2-SD 4.12Å; G375-M379 WeakPolarHBondContact O-CG 3.37Å; G375-M379 PolarHBondContact O-N 3.37Å; G376-M379 PolarHBondContact O-N 3.03Å; M379-S382 PolarHBondContact O-N 3.24Å; M379-S382 PolarHBondContact O-OG 2.83Å; M379-Y383 WeakPolarHBondContact O-CB 3.43Å; M379-Y383 PolarHBondContact O-N 3.16Å
380	F	90.4	Very high	90.4	Very high	59 Å²	59	65.4 Å²	65.4	26%	0.259	36%	0.364	S	S	.	.	H	α-helix	trans	-64.7	-46.9	-179.5	-171.2	-89.1	0	0	0	111.4	F307 M350 G376 L377 S382 V384	F307-F380 HydrophobicContact CE2-CD2 4.27Å; F307-F380 HydrophobicContact CZ-CD2 4.32Å; M350-F380 HydrophobicContact CE-CD2 4.33Å; M350-F380 HydrophobicContact CG-CD2 3.99Å; M350-F380 WeakPolarHBondContact O-CB 3.44Å; M350-F380 WeakPolarHBondContact O-CG 3.27Å; G376-F380 VanDerWaalsContact O-CB 3.29Å; G376-F380 WeakPolarHBondContact O-CB 3.42Å; G376-F380 PolarHBondContact O-N 3.05Å; L377-F380 PolarHBondContact O-N 3.08Å; F380-S382 PolarHBondContact O-N 3.11Å; F380-V384 HydrophobicContact CD1-CG2 4.46Å; F380-V384 HydrophobicContact CD2-CG2 3.77Å; F380-V384 HydrophobicContact CE2-CG2 3.86Å; F380-V384 HydrophobicContact CG-CG2 4.09Å; F380-V384 HydrophobicContact CZ-CG2 4.24Å; F380-V384 WeakPolarHBondContact O-CB 3.47Å; F380-V384 WeakPolarHBondContact O-CG2 3.34Å; F380-V384 PolarHBondContact O-N 3.3Å
381	A	88.8	Confident	89.9	Confident	65 Å²	65	65.5 Å²	65.5	54%	0.537	36%	0.36	S	S	.	.	H	α-helix	trans	-67	-19.4	-179.7	0	0	0	0	0	114.3	L377 P385	L377-A381 VanDerWaalsContact O-CB 3.23Å; L377-A381 WeakPolarHBondContact O-CB 3.41Å; L377-A381 PolarHBondContact O-N 3.48Å; A381-P385 WeakPolarHBondContact O-CG 3.2Å
382	S	91	Very high	89	Confident	60 Å²	60	61.8 Å²	61.8	42%	0.42	36%	0.36	S	S	.	.	H	α-helix	trans	-100.5	-50.2	177.9	53.9	0	0	0	0	113	A378 M379 F380	A378-S382 WeakPolarHBondContact O-CB 3.4Å; A378-S382 PolarHBondContact O-N 3.14Å; A378-S382 PolarHBondContact O-OG 3.36Å; M379-S382 PolarHBondContact O-N 3.24Å; M379-S382 PolarHBondContact O-OG 2.83Å; F380-S382 PolarHBondContact O-N 3.11Å
383	Y	91.4	Very high	87.9	Confident	58 Å²	58	66.3 Å²	66.3	23%	0.227	39%	0.385	C	S	.	.	H	α-helix	trans	-76.9	-35.2	-172.6	-68.4	2.9	0	0	0	112.8	L303 I306 F307 M379 E386 I387	L303-Y383 HydrophobicContact CD2-CD1 3.73Å; L303-Y383 HydrophobicContact CD2-CD2 4.28Å; L303-Y383 HydrophobicContact CD2-CE1 3.88Å; L303-Y383 HydrophobicContact CD2-CE2 4.41Å; L303-Y383 HydrophobicContact CD2-CG 3.94Å; I306-Y383 HydrophobicContact CB-CE2 4.3Å; I306-Y383 HydrophobicContact CG2-CE2 3.92Å; F307-Y383 HydrophobicContact CB-CD2 4.33Å; F307-Y383 HydrophobicContact CD2-CD2 4.45Å; M379-Y383 WeakPolarHBondContact O-CB 3.43Å; M379-Y383 PolarHBondContact O-N 3.16Å; Y383-E386 PolarHBondContact O-N 2.81Å; Y383-I387 WeakPolarHBondContact O-CB 3.41Å; Y383-I387 WeakPolarHBondContact O-CD1 3.5Å; Y383-I387 WeakPolarHBondContact O-CG1 3.05Å; Y383-I387 PolarHBondContact O-N 2.86Å
384	V	89.4	Confident	86.8	Confident	37 Å²	37	72.6 Å²	72.6	22%	0.224	40%	0.404	C	S	.	.	H	α-helix	trans	-67.2	-46.8	-176.2	178.5	0	0	0	0	112.1	F307 F380 E386 I387 I388	F307-V384 HydrophobicContact CE2-CG2 4.02Å; F307-V384 HydrophobicContact CZ-CG2 4.36Å; F380-V384 HydrophobicContact CD1-CG2 4.46Å; F380-V384 HydrophobicContact CD2-CG2 3.77Å; F380-V384 HydrophobicContact CE2-CG2 3.86Å; F380-V384 HydrophobicContact CG-CG2 4.09Å; F380-V384 HydrophobicContact CZ-CG2 4.24Å; F380-V384 WeakPolarHBondContact O-CB 3.47Å; F380-V384 WeakPolarHBondContact O-CG2 3.34Å; F380-V384 PolarHBondContact O-N 3.3Å; V384-E386 VanDerWaalsContact C-N 3.34Å; V384-E386 PolarHBondContact O-N 3.19Å; V384-I387 PolarHBondContact O-N 2.85Å; V384-I388 HydrophobicContact CG1-CD1 3.84Å; V384-I388 VanDerWaalsContact O-CG1 3.28Å; V384-I388 WeakPolarHBondContact O-CG1 3.31Å; V384-I388 PolarHBondContact O-N 2.57Å
385	P	91.6	Very high	85.9	Confident	74 Å²	74	73.3 Å²	73.3	48%	0.481	40%	0.402	S	S	.	.	H	α-helix	trans	-59.6	-41.6	173.4	-25	36.1	0	0	0	113.1	A381 I388 E389	A381-P385 WeakPolarHBondContact O-CG 3.2Å; P385-I388 PolarHBondContact O-N 2.96Å; P385-E389 PolarHBondContact O-N 2.86Å
386	E	89.8	Confident	85.4	Confident	61 Å²	61	78.1 Å²	78.1	29%	0.285	41%	0.413	S	S	.	.	H	α-helix	trans	-68.4	-37.2	-178.9	-172.2	165.8	-117.9	0	0	112.5	K299 L303 Y383 V384 E389 L390	K299-E386 VanDerWaalsContact CE-CD 3.42Å; K299-E386 VanDerWaalsContact CE-OE1 3.23Å; K299-E386 WeakPolarHBondContact CE-OE1 3.2Å; K299-E386 WeakPolarHBondContact CE-OE2 3.15Å; K299-E386 VanDerWaalsContact NZ-CD 3.28Å; K299-E386 IonicContact NZ-OE1 3.03Å; K299-E386 PolarHBondContact NZ-OE1 3.29Å; K299-E386 IonicContact NZ-OE2 3.73Å; L303-E386 HydrophobicContact CD1-CB 4.32Å; L303-E386 HydrophobicContact CD1-CG 3.79Å; L303-E386 VanDerWaalsContact CD1-OE2 3.26Å; L303-E386 WeakPolarHBondContact CD1-OE2 3.41Å; Y383-E386 PolarHBondContact O-N 2.81Å; V384-E386 VanDerWaalsContact C-N 3.34Å; V384-E386 PolarHBondContact O-N 3.19Å; E386-E389 PolarHBondContact O-N 2.82Å; E386-L390 HydrophobicContact CG-CD1 4.28Å; E386-L390 WeakPolarHBondContact O-CB 3.37Å; E386-L390 VanDerWaalsContact O-CG 3.25Å; E386-L390 WeakPolarHBondContact O-CG 3.42Å; E386-L390 PolarHBondContact O-N 3.42Å
387	I	89.7	Confident	85.4	Confident	20 Å²	20	80.1 Å²	80.1	10%	0.103	42%	0.42	C	S	.	.	H	α-helix	trans	-63.6	-43.3	170.9	-72.7	164	0	0	0	110.7	L300 L303 L304 Y383 V384 L390 I391	L300-I387 HydrophobicContact CD1-CB 4.41Å; L300-I387 HydrophobicContact CD1-CG1 4.3Å; L300-I387 HydrophobicContact CD1-CG2 4Å; L303-I387 HydrophobicContact CB-CD1 4.09Å; L303-I387 HydrophobicContact CB-CG1 3.94Å; L303-I387 HydrophobicContact CD1-CG1 4.29Å; L304-I387 HydrophobicContact CD2-CD1 3.97Å; L304-I387 HydrophobicContact CD2-CG2 4.23Å; L304-I387 HydrophobicContact CG-CD1 4.27Å; Y383-I387 WeakPolarHBondContact O-CB 3.41Å; Y383-I387 WeakPolarHBondContact O-CD1 3.5Å; Y383-I387 WeakPolarHBondContact O-CG1 3.05Å; Y383-I387 PolarHBondContact O-N 2.86Å; V384-I387 PolarHBondContact O-N 2.85Å; I387-L390 PolarHBondContact O-N 3.13Å; I387-I391 HydrophobicContact CG2-CD1 3.75Å; I387-I391 WeakPolarHBondContact O-CB 3.45Å; I387-I391 VanDerWaalsContact O-CG1 3.29Å; I387-I391 WeakPolarHBondContact O-CG1 3.08Å; I387-I391 PolarHBondContact O-N 3.04Å
388	I	86.9	Confident	85.1	Confident	110 Å²	110	77.6 Å²	77.6	56%	0.564	41%	0.414	S	S	*	.	H	α-helix	trans	-63.7	-43.4	177.9	-70.6	166.9	0	0	0	110.9	V384 P385 I391 G392	V384-I388 HydrophobicContact CG1-CD1 3.84Å; V384-I388 VanDerWaalsContact O-CG1 3.28Å; V384-I388 WeakPolarHBondContact O-CG1 3.31Å; V384-I388 PolarHBondContact O-N 2.57Å; P385-I388 PolarHBondContact O-N 2.96Å; I388-I391 PolarHBondContact O-N 2.88Å; I388-G392 WeakPolarHBondContact O-CA 3.4Å; I388-G392 PolarHBondContact O-N 2.95Å
389	E	85.8	Confident	85.1	Confident	130 Å²	130	77.4 Å²	77.4	61%	0.607	42%	0.419	S	S	*	.	H	α-helix	trans	-61.9	-48.4	176.8	-167.7	-170.3	154.4	0	0	111.5	P385 E386 I391 G392 N393	P385-E389 PolarHBondContact O-N 2.86Å; E386-E389 PolarHBondContact O-N 2.82Å; E389-I391 VanDerWaalsContact C-N 3.28Å; E389-I391 PolarHBondContact O-N 2.84Å; E389-G392 PolarHBondContact O-N 3.25Å; E389-G392 VanDerWaalsContact O-N 3.16Å; E389-N393 WeakPolarHBondContact O-CB 3.37Å; E389-N393 PolarHBondContact O-N 3.29Å
390	L	86	Confident	85.2	Confident	36 Å²	36	78.6 Å²	78.6	19%	0.188	43%	0.431	C	S	.	.	H	α-helix	trans	-62.4	-31.5	179.8	-72.7	169.8	0	0	0	113.3	N296 K299 L300 L303 E386 I387	N296-L390 HydrophobicContact CB-CD2 4.04Å; K299-L390 HydrophobicContact CB-CD1 4.35Å; K299-L390 HydrophobicContact CD-CD1 4.24Å; K299-L390 HydrophobicContact CG-CD1 4.15Å; L300-L390 HydrophobicContact CB-CB 4.49Å; L300-L390 HydrophobicContact CB-CD1 4.19Å; L300-L390 HydrophobicContact CD1-CB 4.26Å; L303-L390 HydrophobicContact CD1-CD1 3.96Å; E386-L390 HydrophobicContact CG-CD1 4.28Å; E386-L390 WeakPolarHBondContact O-CB 3.37Å; E386-L390 VanDerWaalsContact O-CG 3.25Å; E386-L390 WeakPolarHBondContact O-CG 3.42Å; E386-L390 PolarHBondContact O-N 3.42Å; I387-L390 PolarHBondContact O-N 3.13Å
391	I	84.3	Confident	85.4	Confident	88 Å²	88	76 Å²	76	45%	0.451	42%	0.42	S	S	.	.	H	α-helix	trans	-81.1	-36.8	174.4	-67.3	169.6	0	0	0	111.5	L300 I387 I388 E389	L300-I391 HydrophobicContact CD1-CD1 4.25Å; L300-I391 HydrophobicContact CD1-CG1 4.04Å; L300-I391 HydrophobicContact CD2-CG1 4.05Å; I387-I391 HydrophobicContact CG2-CD1 3.75Å; I387-I391 WeakPolarHBondContact O-CB 3.45Å; I387-I391 VanDerWaalsContact O-CG1 3.29Å; I387-I391 WeakPolarHBondContact O-CG1 3.08Å; I387-I391 PolarHBondContact O-N 3.04Å; I388-I391 PolarHBondContact O-N 2.88Å; E389-I391 VanDerWaalsContact C-N 3.28Å; E389-I391 PolarHBondContact O-N 2.84Å
392	G	74.2	Confident	85.4	Confident	57 Å²	57	77.6 Å²	77.6	59%	0.588	43%	0.427	S	S	*	.	H	α-helix	trans	-75.5	-21.2	-176.1	0	0	0	0	0	114.7	I388 E389 R394	I388-G392 WeakPolarHBondContact O-CA 3.4Å; I388-G392 PolarHBondContact O-N 2.95Å; E389-G392 PolarHBondContact O-N 3.25Å; E389-G392 VanDerWaalsContact O-N 3.16Å; G392-R394 PolarHBondContact O-N 3.42Å
393	N	71.1	Confident	85.1	Confident	111 Å²	111	77.5 Å²	77.5	59%	0.594	43%	0.43	S	S	*	.			trans	-74.1	42.5	-178.1	-150	-26.4	0	0	0	113.9	E389	E389-N393 WeakPolarHBondContact O-CB 3.37Å; E389-N393 PolarHBondContact O-N 3.29Å
394	R	69.9	Low	84.9	Confident	211 Å²	211	78 Å²	78	80%	0.796	44%	0.439	S	S	*	.			trans	-81.9	121.8	170.8	-66.2	-177.5	179	-161	-2.1	109	G392 K396	G392-R394 PolarHBondContact O-N 3.42Å; R394-K396 PolarHBondContact O-N 3.44Å
395	K	72.8	Confident	84.5	Confident	142 Å²	142	82.4 Å²	82.4	62%	0.617	47%	0.471	S	S	*	.			trans	-62.3	103.1	173.7	-70	-169.2	174.1	-167.1	0	110.7	Y397 G398	K395-Y397 PolarHBondContact O-N 2.87Å; K395-Y397 VanDerWaalsContact O-N 3.16Å; K395-G398 PolarHBondContact O-N 3.44Å
396	K	81.8	Confident	84	Confident	136 Å²	136	82.8 Å²	82.8	59%	0.591	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-37.8	176.8	179.5	177.5	173.6	-175	0	113.3	R394 E453	R394-K396 PolarHBondContact O-N 3.44Å; K396-E453 IonicContact NZ-OE1 2.65Å; K396-E453 PolarHBondContact NZ-OE1 2.79Å; K396-E453 IonicContact NZ-OE2 3.96Å; K396-E453 PolarHBondContact NZ-OE2 2.66Å
397	Y	87.9	Confident	83.8	Confident	41 Å²	41	85.3 Å²	85.3	16%	0.161	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	31.8	-179.6	-60.8	-70	0	0	0	113	K395 P448 E453 F465 Q467	K395-Y397 PolarHBondContact O-N 2.87Å; K395-Y397 VanDerWaalsContact O-N 3.16Å; Y397-P448 HydrophobicContact CD2-CG 4.28Å; Y397-P448 HydrophobicContact CE2-CG 3.65Å; Y397-E453 VanDerWaalsContact OH-CG 3.3Å; Y397-E453 WeakPolarHBondContact OH-CG 3.44Å; Y397-E453 PolarHBondContact OH-OE1 2.86Å; Y397-E453 PolarHBondContact OH-OE2 2.97Å; Y397-F465 HydrophobicContact CD1-CB 4.45Å; Y397-F465 AromaticContact CD1-CD1 3.64Å; Y397-F465 HydrophobicContact CD1-CD1 3.64Å; Y397-F465 HydrophobicContact CD1-CE1 4.46Å; Y397-F465 WeakPolarHBondContact CD1-O 3.35Å; Y397-F465 HydrophobicContact CD2-CD1 4.2Å; Y397-F465 HydrophobicContact CD2-CE1 4.29Å; Y397-F465 HydrophobicContact CE1-CD1 4.24Å; Y397-F465 AromaticContact CG-CD1 3.61Å; Y397-F465 HydrophobicContact CG-CD1 3.61Å; Y397-F465 AromaticContact CG-CE1 3.99Å; Y397-F465 HydrophobicContact CG-CE1 3.99Å; Y397-Q467 PolarHBondContact O-N 3.26Å
398	G	84	Confident	83.9	Confident	30 Å²	30	89.2 Å²	89.2	31%	0.309	51%	0.512	S	S	.	.			trans	-77.3	-157	165.3	0	0	0	0	0	112.2	K395 Y466	K395-G398 PolarHBondContact O-N 3.44Å; G398-Y466 VanDerWaalsContact O-CD1 3.31Å; G398-Y466 WeakPolarHBondContact O-CD1 3.47Å; G398-Y466 VanDerWaalsContact O-CE1 3.32Å; G398-Y466 WeakPolarHBondContact O-CE1 3.19Å
399	G	90	Very high	84.3	Confident	55 Å²	55	84.2 Å²	84.2	57%	0.567	49%	0.486	S	S	*	.	S	Bend	trans	73	-174.8	-175.9	0	0	0	0	0	113.3	R478	G399-R478 WeakPolarHBondContact O-CD 3.23Å; G399-R478 WeakPolarHBondContact O-CG 3.27Å; G399-R478 PolarHBondContact O-NH1 3.4Å
400	S	91.8	Very high	84.8	Confident	69 Å²	69	78 Å²	78	48%	0.483	46%	0.457	S	S	.	.			trans	-133.7	146.1	-176.9	58.3	0	0	0	0	111.3	Y466 R478	S400-Y466 VanDerWaalsContact C-OH 3.25Å; S400-Y466 PolarHBondContact O-OH 3.15Å; S400-R478 CarbonylContact C-O 3.37Å; S400-R478 VanDerWaalsContact CA-O 3.3Å; S400-R478 WeakPolarHBondContact CA-O 3.21Å; S400-R478 WeakPolarHBondContact CB-O 3.33Å
401	Y	94.8	Very high	85.4	Confident	5 Å²	5	76.3 Å²	76.3	2%	0.02	45%	0.448	C	S	.	.			trans	-60.9	138.8	174.6	173.4	-111.8	0	0	0	111.5	A403 H409 E439 V441 E464 Y466 R478 K480	Y401-A403 HydrophobicContact CD1-CB 4.35Å; Y401-A403 VanDerWaalsContact CE1-CA 3.48Å; Y401-A403 HydrophobicContact CE1-CB 3.77Å; Y401-H409 AromaticContact CD1-CD2 3.83Å; Y401-H409 AromaticContact CD1-CE1 3.99Å; Y401-H409 AromaticContact CD1-NE2 3.65Å; Y401-H409 HydrophobicContact CE1-CB 4.12Å; Y401-H409 AromaticContact CE1-CD2 3.48Å; Y401-H409 VanDerWaalsContact CE1-CD2 3.48Å; Y401-H409 WeakPolarHBondContact CE1-CD2 3.27Å; Y401-H409 AromaticContact CE1-CE1 3.45Å; Y401-H409 VanDerWaalsContact CE1-CE1 3.45Å; Y401-H409 WeakPolarHBondContact CE1-CE1 3.37Å; Y401-H409 AromaticContact CE1-CG 3.42Å; Y401-H409 VanDerWaalsContact CE1-CG 3.42Å; Y401-H409 AromaticContact CE1-ND1 3.41Å; Y401-H409 WeakPolarHBondContact CE1-ND1 3.3Å; Y401-H409 AromaticContact CE1-NE2 3.48Å; Y401-H409 WeakPolarHBondContact CE1-NE2 3.44Å; Y401-H409 AromaticContact CZ-CG 3.7Å; Y401-H409 AromaticContact CZ-ND1 3.97Å; Y401-H409 WeakPolarHBondContact OH-CB 3.41Å; Y401-E439 PolarHBondContact OH-OE2 3.42Å; Y401-V441 HydrophobicContact CD1-CG2 4.49Å; Y401-V441 HydrophobicContact CD2-CG2 3.75Å; Y401-V441 HydrophobicContact CE2-CG2 3.93Å; Y401-V441 HydrophobicContact CG-CG2 4.06Å; Y401-E464 WeakPolarHBondContact CD2-OE2 3.41Å; Y401-Y466 VanDerWaalsContact CA-OH 3.28Å; Y401-Y466 WeakPolarHBondContact CA-OH 3.14Å; Y401-Y466 PolarHBondContact N-OH 3.01Å; Y401-R478 PolarHBondContact N-O 3.02Å; Y401-K480 HydrophobicContact CD1-CB 3.96Å; Y401-K480 HydrophobicContact CD1-CG 3.96Å
402	S	90.2	Very high	86	Confident	99 Å²	99	72.1 Å²	72.1	69%	0.692	43%	0.427	S	S	*	.			trans	-109.4	85	-176.8	-168.6	0	0	0	0	110.3	V404	S402-V404 PolarHBondContact O-N 3.13Å
403	A	84.4	Confident	87.1	Confident	57 Å²	57	69.4 Å²	69.4	47%	0.471	40%	0.399	S	S	.	.			trans	-53	111.8	-174.5	0	0	0	0	0	113.2	Y401	Y401-A403 HydrophobicContact CD1-CB 4.35Å; Y401-A403 VanDerWaalsContact CE1-CA 3.48Å; Y401-A403 HydrophobicContact CE1-CB 3.77Å
404	V	86.6	Confident	88.3	Confident	69 Å²	69	64.5 Å²	64.5	42%	0.418	37%	0.374	S	S	.	.			trans	-78.7	120.8	-179	-178.6	0	0	0	0	110.3	S402 G406 R407	S402-V404 PolarHBondContact O-N 3.13Å; V404-G406 PolarHBondContact O-N 3.08Å; V404-R407 HydrophobicContact CB-CB 4.29Å; V404-R407 HydrophobicContact CB-CG 4.42Å; V404-R407 HydrophobicContact CG1-CG 4.21Å; V404-R407 PolarHBondContact O-N 3.38Å
405	S	80.9	Confident	89.5	Confident	129 Å²	129	56.9 Å²	56.9	90%	0.902	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	123.8	-178.9	-168.2	0	0	0	0	111.8
406	G	81.9	Confident	90.6	Very high	82 Å²	82	50.5 Å²	50.5	85%	0.845	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.2	-8.4	-178.4	0	0	0	0	0	115.2	V404	V404-G406 PolarHBondContact O-N 3.08Å
407	R	85.3	Confident	91.1	Very high	114 Å²	114	46.3 Å²	46.3	43%	0.43	31%	0.306	S	S	.	.			trans	-97.8	153.5	165.2	-65.3	-171.1	170	179.5	-6.2	110.2	V404 N437 E439	V404-R407 HydrophobicContact CB-CB 4.29Å; V404-R407 HydrophobicContact CB-CG 4.42Å; V404-R407 HydrophobicContact CG1-CG 4.21Å; V404-R407 PolarHBondContact O-N 3.38Å; R407-N437 HydrophobicContact CG-CB 4.41Å; R407-E439 WeakPolarHBondContact CD-OE1 3.47Å; R407-E439 IonicContact CZ-OE1 3.97Å; R407-E439 IonicContact NE-OE1 3.65Å; R407-E439 IonicContact NH1-OE1 2.77Å; R407-E439 PolarHBondContact NH1-OE1 3.13Å
408	K	91.7	Very high	91.2	Very high	103 Å²	103	47.5 Å²	47.5	45%	0.448	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	158.9	167.9	-73.3	-178.8	166.4	-153.7	0	109	N437 V438 E439 D485	K408-N437 PolarHBondContact N-O 3.29Å; K408-V438 CarbonylContact O-C 3.57Å; K408-V438 WeakPolarHBondContact O-CA 3.34Å; K408-E439 PolarHBondContact O-N 3.12Å; K408-D485 HydrophobicContact CB-CB 4.41Å; K408-D485 HydrophobicContact CD-CB 4.08Å; K408-D485 WeakPolarHBondContact CD-OD2 3.23Å; K408-D485 WeakPolarHBondContact CE-OD1 3.32Å; K408-D485 IonicContact NZ-OD1 3.96Å; K408-D485 PolarHBondContact NZ-OD1 3.4Å; K408-D485 IonicContact NZ-OD2 2.27Å; K408-D485 PolarHBondContact NZ-OD2 3.33Å
409	H	95.1	Very high	91.2	Very high	4 Å²	4	50 Å²	50	2%	0.019	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	155.1	164.5	70.5	-64.8	0	0	0	111.9	Y401 E439 V441 V479 K480 A484 D485	Y401-H409 AromaticContact CD1-CD2 3.83Å; Y401-H409 AromaticContact CD1-CE1 3.99Å; Y401-H409 AromaticContact CD1-NE2 3.65Å; Y401-H409 HydrophobicContact CE1-CB 4.12Å; Y401-H409 AromaticContact CE1-CD2 3.48Å; Y401-H409 VanDerWaalsContact CE1-CD2 3.48Å; Y401-H409 WeakPolarHBondContact CE1-CD2 3.27Å; Y401-H409 AromaticContact CE1-CE1 3.45Å; Y401-H409 VanDerWaalsContact CE1-CE1 3.45Å; Y401-H409 WeakPolarHBondContact CE1-CE1 3.37Å; Y401-H409 AromaticContact CE1-CG 3.42Å; Y401-H409 VanDerWaalsContact CE1-CG 3.42Å; Y401-H409 AromaticContact CE1-ND1 3.41Å; Y401-H409 WeakPolarHBondContact CE1-ND1 3.3Å; Y401-H409 AromaticContact CE1-NE2 3.48Å; Y401-H409 WeakPolarHBondContact CE1-NE2 3.44Å; Y401-H409 AromaticContact CZ-CG 3.7Å; Y401-H409 AromaticContact CZ-ND1 3.97Å; Y401-H409 WeakPolarHBondContact OH-CB 3.41Å; H409-E439 CarbonylContact C-O 3.41Å; H409-E439 WeakPolarHBondContact CA-O 3.36Å; H409-E439 HydrophobicContact CB-CB 4.17Å; H409-E439 WeakPolarHBondContact CB-O 3.26Å; H409-V441 HydrophobicContact CB-CG2 4.22Å; H409-V479 PolarHBondContact NE2-O 3.11Å; H409-K480 PolarHBondContact CE1-O 2.9Å; H409-K480 PolarHBondContact NE2-O 3.08Å; H409-A484 WeakPolarHBondContact O-CA 3.19Å; H409-D485 PolarHBondContact O-N 3.38Å
410	I	96.6	Very high	91.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	149.1	167.4	56.5	162.9	0	0	0	109.7	V412 F424 F428 V438 E439 I440 V441 A486 L488 Y1055	I410-V412 HydrophobicContact CD1-CG2 3.93Å; I410-V412 HydrophobicContact CG1-CG2 4.41Å; I410-F424 HydrophobicContact CD1-CE1 4.39Å; I410-F424 HydrophobicContact CD1-CZ 3.86Å; I410-F428 HydrophobicContact CD1-CD2 4.32Å; I410-F428 HydrophobicContact CD1-CE1 4.21Å; I410-F428 HydrophobicContact CD1-CE2 3.55Å; I410-F428 HydrophobicContact CD1-CZ 3.48Å; I410-F428 VanDerWaalsContact CD1-CZ 3.48Å; I410-F428 HydrophobicContact CG1-CZ 4.23Å; I410-V438 HydrophobicContact CG1-CG1 4.23Å; I410-V438 HydrophobicContact CG2-CG1 4.03Å; I410-E439 PolarHBondContact N-O 2.98Å; I410-I440 HydrophobicContact CD1-CG1 4.34Å; I410-I440 HydrophobicContact CD1-CG2 4.27Å; I410-I440 HydrophobicContact CG1-CB 4.47Å; I410-I440 HydrophobicContact CG1-CG1 4.29Å; I410-I440 HydrophobicContact CG1-CG2 4.31Å; I410-V441 PolarHBondContact O-N 3.24Å; I410-A486 WeakPolarHBondContact CA-O 3.33Å; I410-A486 HydrophobicContact CG2-CB 4.25Å; I410-L488 HydrophobicContact CB-CD1 4.31Å; I410-L488 HydrophobicContact CD1-CD1 4.18Å; I410-L488 HydrophobicContact CD1-CD2 4.35Å; I410-L488 HydrophobicContact CG2-CD1 4.38Å; I410-Y1055 HydrophobicContact CG2-CD2 4.21Å; I410-Y1055 HydrophobicContact CG2-CE1 4.42Å; I410-Y1055 HydrophobicContact CG2-CE2 3.52Å
411	V	97.9	Very high	91.3	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	118.4	172.6	177	0	0	0	0	109	V441 L443 V479 I481 A484 A486 C487 L488	V411-V441 CarbonylContact C-O 3.58Å; V411-V441 WeakPolarHBondContact CA-O 3.35Å; V411-L443 HydrophobicContact CG1-CB 4.32Å; V411-V479 HydrophobicContact CG1-CG2 3.94Å; V411-V479 HydrophobicContact CG2-CB 4.17Å; V411-V479 HydrophobicContact CG2-CG2 3.88Å; V411-I481 HydrophobicContact CB-CD1 3.67Å; V411-I481 HydrophobicContact CG1-CD1 4.05Å; V411-I481 HydrophobicContact CG2-CD1 3.66Å; V411-A484 HydrophobicContact CG2-CB 4.01Å; V411-A486 PolarHBondContact N-O 3.04Å; V411-A486 VanDerWaalsContact N-O 3.1Å; V411-C487 CarbonylContact O-C 3.27Å; V411-C487 VanDerWaalsContact O-CA 3.26Å; V411-C487 WeakPolarHBondContact O-CA 3.4Å; V411-C487 PolarHBondContact O-SG 2.85Å; V411-L488 PolarHBondContact O-N 3.46Å
412	V	98	Very high	91	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	128.8	177.7	-173.1	0	0	0	0	109.3	I410 F424 I440 V441 F442 L443 L488 L490	I410-V412 HydrophobicContact CD1-CG2 3.93Å; I410-V412 HydrophobicContact CG1-CG2 4.41Å; V412-F424 HydrophobicContact CG2-CE1 3.92Å; V412-F424 HydrophobicContact CG2-CZ 4.15Å; V412-I440 HydrophobicContact CG2-CG2 3.68Å; V412-V441 PolarHBondContact N-O 3.44Å; V412-F442 HydrophobicContact CB-CD1 3.71Å; V412-F442 HydrophobicContact CB-CE1 3.72Å; V412-F442 HydrophobicContact CB-CG 4.4Å; V412-F442 HydrophobicContact CB-CZ 4.43Å; V412-F442 HydrophobicContact CG1-CD1 3.84Å; V412-F442 HydrophobicContact CG1-CE1 3.57Å; V412-F442 HydrophobicContact CG1-CZ 4.49Å; V412-F442 HydrophobicContact CG2-CE1 4.26Å; V412-F442 CarbonylContact O-C 2.95Å; V412-F442 WeakPolarHBondContact O-CA 3.46Å; V412-L443 PolarHBondContact O-N 2.86Å; V412-L488 WeakPolarHBondContact CA-O 3.42Å; V412-L488 HydrophobicContact CG2-CB 4.38Å; V412-L490 HydrophobicContact CG1-CD1 3.9Å; V412-L490 HydrophobicContact CG1-CG 4.21Å
413	C	97	Very high	90.9	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	-173.5	-178.5	71.4	0	0	0	0	111.8	L443 V470 L488 I489 L490	C413-L443 HydrophobicContact CB-CB 4.46Å; C413-V470 HydrophobicContact CB-CG2 3.41Å; C413-V470 VanDerWaalsContact CB-CG2 3.41Å; C413-V470 VanDerWaalsContact SG-CG2 3.55Å; C413-L488 PolarHBondContact N-O 3Å; C413-I489 WeakPolarHBondContact O-CA 3.19Å; C413-L490 PolarHBondContact O-N 2.98Å
414	G	95.3	Very high	91.2	Very high	7 Å²	7	40.6 Å²	40.6	7%	0.072	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.1	-138.4	-171.4	0	0	0	0	0	111.4	I416 H444 L490	G414-I416 PolarHBondContact O-N 3.46Å; G414-H444 PolarHBondContact O-CD2 3.19Å; G414-H444 VanDerWaalsContact O-CD2 3.24Å; G414-L490 CarbonylContact C-O 3.59Å; G414-L490 WeakPolarHBondContact CA-O 3.42Å
415	H	95.1	Very high	91.4	Very high	52 Å²	52	37.6 Å²	37.6	24%	0.241	22%	0.219	C	C	.	.	S	Bend	trans	-81.7	97.1	-175.8	-171.9	73.6	0	0	0	112.5	T417 S420 L490 N492	H415-T417 VanDerWaalsContact NE2-CG2 3.29Å; H415-T417 WeakPolarHBondContact NE2-CG2 3.24Å; H415-S420 PolarHBondContact O-OG 3.01Å; H415-L490 PolarHBondContact N-O 2.94Å; H415-N492 HydrophobicContact CB-CB 4.16Å
416	I	95.6	Very high	91.6	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.041	20%	0.198	C	C	.	.			trans	-104.4	107.1	-175.7	-72.2	163.4	0	0	0	109.8	G414 V421 F442 H444 L452 F465	G414-I416 PolarHBondContact O-N 3.46Å; I416-V421 HydrophobicContact CG2-CG2 3.82Å; I416-F442 HydrophobicContact CD1-CB 4.37Å; I416-F442 HydrophobicContact CD1-CD1 3.84Å; I416-F442 HydrophobicContact CG1-CD1 4.11Å; I416-F442 HydrophobicContact CG2-CD1 4.34Å; I416-H444 HydrophobicContact CB-CB 4.23Å; I416-H444 HydrophobicContact CD1-CB 3.86Å; I416-H444 HydrophobicContact CG2-CB 4.47Å; I416-L452 HydrophobicContact CG2-CD2 4.12Å; I416-F465 HydrophobicContact CG2-CE2 4.44Å
417	T	92.3	Very high	91.8	Very high	48 Å²	48	33.3 Å²	33.3	29%	0.294	16%	0.161	S	C	.	.			trans	-132.7	173.6	178	59.3	0	0	0	0	110.6	H415 E419 S420 V421	H415-T417 VanDerWaalsContact NE2-CG2 3.29Å; H415-T417 WeakPolarHBondContact NE2-CG2 3.24Å; T417-E419 VanDerWaalsContact C-N 3.34Å; T417-E419 PolarHBondContact O-N 2.96Å; T417-S420 PolarHBondContact N-OG 3.25Å; T417-S420 VanDerWaalsContact N-OG 3.13Å; T417-S420 PolarHBondContact OG1-N 3.45Å; T417-S420 PolarHBondContact OG1-OG 3.11Å; T417-V421 VanDerWaalsContact O-CB 3.3Å; T417-V421 WeakPolarHBondContact O-CB 3.14Å; T417-V421 VanDerWaalsContact O-CG2 3.23Å; T417-V421 WeakPolarHBondContact O-CG2 3.45Å; T417-V421 PolarHBondContact O-N 3.47Å; T417-V421 VanDerWaalsContact O-N 3.08Å
418	L	90.2	Very high	92	Very high	65 Å²	65	28.3 Å²	28.3	34%	0.34	14%	0.143	S	C	.	.	H	α-helix	trans	-58.4	-45.4	178.1	-178.2	65.8	0	0	0	111.9	S422 E451 L455	L418-S422 WeakPolarHBondContact O-CB 3.01Å; L418-S422 PolarHBondContact O-N 3.02Å; L418-E451 HydrophobicContact CD1-CB 4.05Å; L418-E451 HydrophobicContact CD2-CB 3.8Å; L418-E451 HydrophobicContact CD2-CG 4.44Å; L418-E451 HydrophobicContact CG-CB 4.5Å; L418-L455 HydrophobicContact CD1-CD2 4.13Å
419	E	85.6	Confident	91.8	Very high	84 Å²	84	25.5 Å²	25.5	39%	0.393	13%	0.133	S	C	.	.	H	α-helix	trans	-64.1	-54.2	179.9	-173.5	-166.7	150.5	0	0	111.7	T417 V421 S422 N423 Y494	T417-E419 VanDerWaalsContact C-N 3.34Å; T417-E419 PolarHBondContact O-N 2.96Å; E419-V421 VanDerWaalsContact C-N 3.3Å; E419-V421 PolarHBondContact O-N 2.83Å; E419-S422 PolarHBondContact O-N 3.46Å; E419-N423 PolarHBondContact O-N 3.17Å; E419-Y494 WeakPolarHBondContact OE1-CE2 3.49Å; E419-Y494 PolarHBondContact OE1-OH 2.86Å
420	S	90.1	Very high	91.3	Very high	10 Å²	10	27.2 Å²	27.2	7%	0.07	14%	0.14	C	C	.	.	H	α-helix	trans	-64.2	-35.5	-176.2	71.2	0	0	0	0	112.3	H415 T417 F424	H415-S420 PolarHBondContact O-OG 3.01Å; T417-S420 PolarHBondContact N-OG 3.25Å; T417-S420 VanDerWaalsContact N-OG 3.13Å; T417-S420 PolarHBondContact OG1-N 3.45Å; T417-S420 PolarHBondContact OG1-OG 3.11Å; S420-F424 VanDerWaalsContact O-CB 3.23Å; S420-F424 WeakPolarHBondContact O-CB 3.36Å; S420-F424 PolarHBondContact O-N 3.32Å
421	V	92.3	Very high	90.4	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-75.4	-39.9	174.7	177.2	0	0	0	0	111.9	I416 T417 E419 F424 L425 F442 L452 L455 F456	I416-V421 HydrophobicContact CG2-CG2 3.82Å; T417-V421 VanDerWaalsContact O-CB 3.3Å; T417-V421 WeakPolarHBondContact O-CB 3.14Å; T417-V421 VanDerWaalsContact O-CG2 3.23Å; T417-V421 WeakPolarHBondContact O-CG2 3.45Å; T417-V421 PolarHBondContact O-N 3.47Å; T417-V421 VanDerWaalsContact O-N 3.08Å; E419-V421 VanDerWaalsContact C-N 3.3Å; E419-V421 PolarHBondContact O-N 2.83Å; V421-F424 PolarHBondContact O-N 3.14Å; V421-L425 HydrophobicContact CG1-CD1 3.6Å; V421-L425 HydrophobicContact CG1-CG 3.9Å; V421-L425 WeakPolarHBondContact O-CB 3.23Å; V421-L425 VanDerWaalsContact O-CG 3.27Å; V421-L425 WeakPolarHBondContact O-CG 3.42Å; V421-L425 PolarHBondContact O-N 2.91Å; V421-F442 HydrophobicContact CG1-CE1 4.21Å; V421-F442 HydrophobicContact CG1-CE2 4.38Å; V421-F442 HydrophobicContact CG1-CZ 3.8Å; V421-F442 HydrophobicContact CG2-CD1 4.31Å; V421-F442 HydrophobicContact CG2-CE1 3.72Å; V421-F442 HydrophobicContact CG2-CZ 4.18Å; V421-L452 HydrophobicContact CB-CD1 3.86Å; V421-L452 HydrophobicContact CG1-CD1 3.83Å; V421-L452 HydrophobicContact CG2-CD1 4.03Å; V421-L455 HydrophobicContact CB-CD2 4.37Å; V421-L455 HydrophobicContact CG1-CD2 3.83Å; V421-F456 HydrophobicContact CG1-CE1 3.92Å
422	S	89.6	Confident	89.3	Confident	36 Å²	36	37.1 Å²	37.1	25%	0.252	19%	0.186	S	C	.	.	H	α-helix	trans	-58.6	-52.1	178	174.3	0	0	0	0	111.3	L418 E419 L425 K426	L418-S422 WeakPolarHBondContact O-CB 3.01Å; L418-S422 PolarHBondContact O-N 3.02Å; E419-S422 PolarHBondContact O-N 3.46Å; S422-L425 PolarHBondContact O-N 3.2Å; S422-K426 WeakPolarHBondContact O-CG 3.45Å; S422-K426 PolarHBondContact O-N 3.18Å
423	N	87.2	Confident	88.2	Confident	36 Å²	36	39.2 Å²	39.2	19%	0.193	19%	0.194	C	C	.	.	H	α-helix	trans	-63.5	-45.8	-179.7	-65.5	-5.4	0	0	0	110.9	E419 L425 K426 D427 D1048	E419-N423 PolarHBondContact O-N 3.17Å; N423-L425 PolarHBondContact O-N 3.38Å; N423-K426 PolarHBondContact O-N 2.83Å; N423-D427 PolarHBondContact O-N 3.23Å; N423-D1048 HydrophobicContact CB-CB 4.33Å
424	F	90.8	Very high	87	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.018	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-45.2	177.1	178	-103.7	0	0	0	113	I410 V412 S420 V421 F428 I440 F442 L488	I410-F424 HydrophobicContact CD1-CE1 4.39Å; I410-F424 HydrophobicContact CD1-CZ 3.86Å; V412-F424 HydrophobicContact CG2-CE1 3.92Å; V412-F424 HydrophobicContact CG2-CZ 4.15Å; S420-F424 VanDerWaalsContact O-CB 3.23Å; S420-F424 WeakPolarHBondContact O-CB 3.36Å; S420-F424 PolarHBondContact O-N 3.32Å; V421-F424 PolarHBondContact O-N 3.14Å; F424-F428 HydrophobicContact CE1-CB 4.23Å; F424-F428 HydrophobicContact CE1-CD2 4.25Å; F424-F428 HydrophobicContact CE1-CG 4.23Å; F424-F428 HydrophobicContact CE2-CB 4.28Å; F424-F428 AromaticContact CE2-CD2 3.73Å; F424-F428 HydrophobicContact CE2-CD2 3.73Å; F424-F428 HydrophobicContact CE2-CE2 4.5Å; F424-F428 HydrophobicContact CE2-CG 4.32Å; F424-F428 HydrophobicContact CZ-CB 4.05Å; F424-F428 AromaticContact CZ-CD2 3.39Å; F424-F428 HydrophobicContact CZ-CD2 3.39Å; F424-F428 AromaticContact CZ-CE2 3.97Å; F424-F428 HydrophobicContact CZ-CE2 3.97Å; F424-F428 AromaticContact CZ-CG 3.82Å; F424-F428 HydrophobicContact CZ-CG 3.82Å; F424-F428 WeakPolarHBondContact O-CB 3.47Å; F424-F428 PolarHBondContact O-N 2.89Å; F424-I440 HydrophobicContact CE1-CD1 4.28Å; F424-I440 HydrophobicContact CE1-CG2 4.11Å; F424-F442 HydrophobicContact CD1-CZ 4.22Å; F424-F442 HydrophobicContact CE1-CZ 4.49Å; F424-L488 HydrophobicContact CE2-CD2 3.47Å; F424-L488 VanDerWaalsContact CE2-CD2 3.47Å; F424-L488 HydrophobicContact CZ-CD2 3.7Å
425	L	90.9	Very high	85.2	Confident	6 Å²	6	50.3 Å²	50.3	3%	0.031	25%	0.252	C	S	.	.	H	α-helix	trans	-70.3	-35.9	-179.8	-68.8	-177.8	0	0	0	112.5	V421 S422 N423 D427 L429 I440 F442 L455 V463	V421-L425 HydrophobicContact CG1-CD1 3.6Å; V421-L425 HydrophobicContact CG1-CG 3.9Å; V421-L425 WeakPolarHBondContact O-CB 3.23Å; V421-L425 VanDerWaalsContact O-CG 3.27Å; V421-L425 WeakPolarHBondContact O-CG 3.42Å; V421-L425 PolarHBondContact O-N 2.91Å; S422-L425 PolarHBondContact O-N 3.2Å; N423-L425 PolarHBondContact O-N 3.38Å; L425-D427 PolarHBondContact O-N 3.4Å; L425-L429 HydrophobicContact CD2-CD1 3.93Å; L425-L429 HydrophobicContact CD2-CG 4.44Å; L425-L429 WeakPolarHBondContact O-CB 3.35Å; L425-L429 PolarHBondContact O-N 3Å; L425-I440 HydrophobicContact CD2-CD1 3.53Å; L425-F442 HydrophobicContact CD2-CE2 4.33Å; L425-F442 HydrophobicContact CD2-CZ 4.25Å; L425-L455 HydrophobicContact CD1-CD1 4.47Å; L425-L455 HydrophobicContact CD1-CD2 4.27Å; L425-L455 HydrophobicContact CD1-CG 4.13Å; L425-V463 HydrophobicContact CD1-CG2 4.27Å; L425-V463 HydrophobicContact CD2-CG2 3.89Å
426	K	86.3	Confident	83.9	Confident	108 Å²	108	51.8 Å²	51.8	47%	0.47	27%	0.265	S	S	.	.	H	α-helix	trans	-54.2	-50	173.2	-82.9	-175.3	177.5	-173	0	111.5	S422 N423 H430 E1029	S422-K426 WeakPolarHBondContact O-CG 3.45Å; S422-K426 PolarHBondContact O-N 3.18Å; N423-K426 PolarHBondContact O-N 2.83Å; K426-H430 WeakPolarHBondContact O-CB 3.45Å; K426-E1029 IonicContact NZ-OE1 3.38Å; K426-E1029 PolarHBondContact NZ-OE1 3.08Å
427	D	84.9	Confident	83.1	Confident	14 Å²	14	56.2 Å²	56.2	8%	0.075	29%	0.288	C	S	.	.	H	α-helix	trans	-79.6	-32.9	-178.1	-86.3	-62.2	0	0	0	113.9	N423 L425 R433 M578 S1049	N423-D427 PolarHBondContact O-N 3.23Å; L425-D427 PolarHBondContact O-N 3.4Å; D427-R433 VanDerWaalsContact O-CZ 3.29Å; D427-R433 PolarHBondContact O-NE 3.09Å; D427-R433 PolarHBondContact O-NH2 3.27Å; D427-M578 PolarHBondContact OD1-N 3.44Å; D427-S1049 VanDerWaalsContact OD2-CA 3.3Å; D427-S1049 WeakPolarHBondContact OD2-CA 3.41Å; D427-S1049 WeakPolarHBondContact OD2-CB 3.15Å; D427-S1049 PolarHBondContact OD2-OG 2.75Å
428	F	88.9	Confident	82.9	Confident	9 Å²	9	54.4 Å²	54.4	4%	0.039	28%	0.277	C	S	.	.	H	α-helix	trans	-80.7	-41.3	-175.5	-165.6	-79.3	0	0	0	112.5	I410 F424 H430 V438 I440 Y1055 F1056	I410-F428 HydrophobicContact CD1-CD2 4.32Å; I410-F428 HydrophobicContact CD1-CE1 4.21Å; I410-F428 HydrophobicContact CD1-CE2 3.55Å; I410-F428 HydrophobicContact CD1-CZ 3.48Å; I410-F428 VanDerWaalsContact CD1-CZ 3.48Å; I410-F428 HydrophobicContact CG1-CZ 4.23Å; F424-F428 HydrophobicContact CE1-CB 4.23Å; F424-F428 HydrophobicContact CE1-CD2 4.25Å; F424-F428 HydrophobicContact CE1-CG 4.23Å; F424-F428 HydrophobicContact CE2-CB 4.28Å; F424-F428 AromaticContact CE2-CD2 3.73Å; F424-F428 HydrophobicContact CE2-CD2 3.73Å; F424-F428 HydrophobicContact CE2-CE2 4.5Å; F424-F428 HydrophobicContact CE2-CG 4.32Å; F424-F428 HydrophobicContact CZ-CB 4.05Å; F424-F428 AromaticContact CZ-CD2 3.39Å; F424-F428 HydrophobicContact CZ-CD2 3.39Å; F424-F428 AromaticContact CZ-CE2 3.97Å; F424-F428 HydrophobicContact CZ-CE2 3.97Å; F424-F428 AromaticContact CZ-CG 3.82Å; F424-F428 HydrophobicContact CZ-CG 3.82Å; F424-F428 WeakPolarHBondContact O-CB 3.47Å; F424-F428 PolarHBondContact O-N 2.89Å; F428-H430 VanDerWaalsContact C-N 3.33Å; F428-V438 HydrophobicContact CE1-CB 4.35Å; F428-V438 HydrophobicContact CE1-CG1 4.36Å; F428-V438 HydrophobicContact CZ-CB 4.48Å; F428-V438 HydrophobicContact CZ-CG1 4.15Å; F428-I440 HydrophobicContact CD1-CD1 3.58Å; F428-I440 HydrophobicContact CD1-CG1 4.24Å; F428-I440 HydrophobicContact CE1-CD1 3.92Å; F428-I440 HydrophobicContact CE1-CG1 4.06Å; F428-I440 HydrophobicContact CG-CD1 4.28Å; F428-Y1055 AromaticContact CE2-CD1 3.43Å; F428-Y1055 HydrophobicContact CE2-CD1 3.43Å; F428-Y1055 VanDerWaalsContact CE2-CD1 3.43Å; F428-Y1055 AromaticContact CE2-CE1 3.79Å; F428-Y1055 HydrophobicContact CE2-CE1 3.79Å; F428-Y1055 HydrophobicContact CE2-CG 4.14Å; F428-Y1055 AromaticContact CZ-CD1 3.8Å; F428-Y1055 HydrophobicContact CZ-CD1 3.8Å; F428-Y1055 AromaticContact CZ-CE1 3.63Å; F428-Y1055 HydrophobicContact CZ-CE1 3.63Å; F428-F1056 HydrophobicContact CD1-CZ 4.49Å; F428-F1056 AromaticContact CD2-CE2 3.97Å; F428-F1056 HydrophobicContact CD2-CE2 3.97Å; F428-F1056 HydrophobicContact CD2-CZ 4.46Å; F428-F1056 HydrophobicContact CE1-CZ 4.13Å; F428-F1056 AromaticContact CE2-CE2 3.91Å; F428-F1056 HydrophobicContact CE2-CE2 3.91Å; F428-F1056 HydrophobicContact CE2-CZ 4.09Å; F428-F1056 HydrophobicContact CG-CE2 4.32Å; F428-F1056 HydrophobicContact CZ-CE2 4.21Å; F428-F1056 AromaticContact CZ-CZ 3.92Å; F428-F1056 HydrophobicContact CZ-CZ 3.92Å
429	L	88.6	Confident	83.1	Confident	44 Å²	44	52.4 Å²	52.4	23%	0.23	27%	0.266	C	S	.	.	S	Bend	trans	-97	22.9	179.9	-61	176.5	0	0	0	112.5	L425 I440 H459 Q462 V463	L425-L429 HydrophobicContact CD2-CD1 3.93Å; L425-L429 HydrophobicContact CD2-CG 4.44Å; L425-L429 WeakPolarHBondContact O-CB 3.35Å; L425-L429 PolarHBondContact O-N 3Å; L429-I440 HydrophobicContact CD1-CD1 4.12Å; L429-I440 HydrophobicContact CD2-CD1 3.95Å; L429-I440 HydrophobicContact CG-CD1 3.98Å; L429-H459 HydrophobicContact CD1-CB 4.41Å; L429-Q462 HydrophobicContact CD1-CB 4.24Å; L429-Q462 HydrophobicContact CD2-CB 4.43Å; L429-V463 HydrophobicContact CD1-CG2 4.23Å
430	H	84.6	Confident	83.6	Confident	40 Å²	40	48.4 Å²	48.4	19%	0.185	25%	0.248	C	C	.	.			trans	-68.2	132.1	-178.4	-161.5	-94.8	0	0	0	112.3	K426 F428 D432 R433 M578 R579 S580	K426-H430 WeakPolarHBondContact O-CB 3.45Å; F428-H430 VanDerWaalsContact C-N 3.33Å; H430-D432 IonicContact CE1-OD2 3.3Å; H430-D432 PolarHBondContact CE1-OD2 2.91Å; H430-D432 PolarHBondContact ND1-N 3.27Å; H430-D432 IonicContact ND1-OD2 3.71Å; H430-D432 PolarHBondContact O-N 2.93Å; H430-D432 VanDerWaalsContact O-N 3.07Å; H430-R433 PolarHBondContact O-N 3.06Å; H430-R433 VanDerWaalsContact O-N 3.12Å; H430-M578 HydrophobicContact CB-CB 3.69Å; H430-M578 HydrophobicContact CB-CG 4.21Å; H430-M578 PolarHBondContact NE2-O 2.61Å; H430-R579 PolarHBondContact CE1-O 3.13Å; H430-S580 WeakPolarHBondContact CE1-CA 3.31Å; H430-S580 PolarHBondContact CE1-N 3.26Å; H430-S580 PolarHBondContact NE2-N 2.91Å; H430-S580 PolarHBondContact NE2-OG 2.95Å; H430-S580 VanDerWaalsContact NE2-OG 3.12Å
431	K	77.8	Confident	83.9	Confident	142 Å²	142	48 Å²	48	62%	0.617	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-23.7	-177.7	59	167.4	-157.1	-162.7	0	115.5	S580	K431-S580 VanDerWaalsContact CE-OG 3.24Å; K431-S580 WeakPolarHBondContact CE-OG 3.38Å; K431-S580 PolarHBondContact NZ-OG 3.16Å
432	D	73.8	Confident	84.2	Confident	66 Å²	66	48 Å²	48	35%	0.353	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-2.4	-174	-60.6	-36.3	0	0	0	111.7	H430 M578	H430-D432 IonicContact CE1-OD2 3.3Å; H430-D432 PolarHBondContact CE1-OD2 2.91Å; H430-D432 PolarHBondContact ND1-N 3.27Å; H430-D432 IonicContact ND1-OD2 3.71Å; H430-D432 PolarHBondContact O-N 2.93Å; H430-D432 VanDerWaalsContact O-N 3.07Å; D432-M578 HydrophobicContact CB-CE 4.25Å
433	R	76.3	Confident	84.6	Confident	44 Å²	44	46.4 Å²	46.4	17%	0.166	23%	0.233	C	C	.	.	S	Bend	trans	-75	139.3	160.2	-60	-170.8	-176	-77.8	1.8	109.8	D427 H430 M578 S1052	D427-R433 VanDerWaalsContact O-CZ 3.29Å; D427-R433 PolarHBondContact O-NE 3.09Å; D427-R433 PolarHBondContact O-NH2 3.27Å; H430-R433 PolarHBondContact O-N 3.06Å; H430-R433 VanDerWaalsContact O-N 3.12Å; R433-M578 HydrophobicContact CG-CE 4.03Å; R433-M578 HydrophobicContact CG-CG 4.22Å; R433-M578 HydrophobicContact CG-SD 4.13Å; R433-S1052 PolarHBondContact NH2-OG 2.75Å
434	D	69.9	Low	85	Confident	75 Å²	75	46 Å²	46	40%	0.401	23%	0.23	S	C	.	.			trans	-56.5	142.4	168.1	-69.8	-32.2	0	0	0	110.2	V436 K672	D434-V436 WeakPolarHBondContact O-CG2 3.35Å; D434-V436 PolarHBondContact O-N 2.98Å; D434-K672 WeakPolarHBondContact OD1-CE 3.27Å; D434-K672 IonicContact OD1-NZ 3.36Å; D434-K672 PolarHBondContact OD1-NZ 2.71Å
435	D	59.5	Low	85.1	Confident	165 Å²	165	50.3 Å²	50.3	88%	0.882	25%	0.253	S	S	*	.			trans	-57.3	82.2	-172.5	-71.7	-63.4	0	0	0	115	N437	D435-N437 PolarHBondContact O-N 3.2Å
436	V	66	Low	85.2	Confident	84 Å²	84	55.2 Å²	55.2	51%	0.509	28%	0.278	S	S	.	.			trans	-86.4	112.4	173.9	-153.3	0	0	0	0	109.5	D434 V438 F1056	D434-V436 WeakPolarHBondContact O-CG2 3.35Å; D434-V436 PolarHBondContact O-N 2.98Å; V436-V438 HydrophobicContact CB-CG2 4.08Å; V436-V438 HydrophobicContact CG1-CG2 3.59Å; V436-V438 PolarHBondContact O-N 3.24Å; V436-F1056 HydrophobicContact CB-CE1 4.14Å; V436-F1056 HydrophobicContact CG1-CE1 4.46Å; V436-F1056 HydrophobicContact CG2-CD1 4.39Å; V436-F1056 HydrophobicContact CG2-CE1 3.76Å
437	N	78.8	Confident	85.5	Confident	100 Å²	100	53.3 Å²	53.3	54%	0.535	28%	0.279	S	S	.	.			trans	-71.9	75.5	177.2	-75.3	-88.2	0	0	0	111.3	R407 K408 D435	R407-N437 HydrophobicContact CG-CB 4.41Å; K408-N437 PolarHBondContact N-O 3.29Å; D435-N437 PolarHBondContact O-N 3.2Å
438	V	89.5	Confident	85.9	Confident	10 Å²	10	53.3 Å²	53.3	6%	0.061	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124.6	176.5	-170.1	0	0	0	0	109.7	K408 I410 F428 V436	K408-V438 CarbonylContact O-C 3.57Å; K408-V438 WeakPolarHBondContact O-CA 3.34Å; I410-V438 HydrophobicContact CG1-CG1 4.23Å; I410-V438 HydrophobicContact CG2-CG1 4.03Å; F428-V438 HydrophobicContact CE1-CB 4.35Å; F428-V438 HydrophobicContact CE1-CG1 4.36Å; F428-V438 HydrophobicContact CZ-CB 4.48Å; F428-V438 HydrophobicContact CZ-CG1 4.15Å; V436-V438 HydrophobicContact CB-CG2 4.08Å; V436-V438 HydrophobicContact CG1-CG2 3.59Å; V436-V438 PolarHBondContact O-N 3.24Å
439	E	93.3	Very high	86.1	Confident	23 Å²	23	56.5 Å²	56.5	11%	0.107	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	147.7	172.4	-69.8	170.7	-168	0	0	110.8	Y401 R407 K408 H409 I410	Y401-E439 PolarHBondContact OH-OE2 3.42Å; R407-E439 WeakPolarHBondContact CD-OE1 3.47Å; R407-E439 IonicContact CZ-OE1 3.97Å; R407-E439 IonicContact NE-OE1 3.65Å; R407-E439 IonicContact NH1-OE1 2.77Å; R407-E439 PolarHBondContact NH1-OE1 3.13Å; K408-E439 PolarHBondContact O-N 3.12Å; H409-E439 CarbonylContact C-O 3.41Å; H409-E439 WeakPolarHBondContact CA-O 3.36Å; H409-E439 HydrophobicContact CB-CB 4.17Å; H409-E439 WeakPolarHBondContact CB-O 3.26Å; I410-E439 PolarHBondContact N-O 2.98Å
440	I	95.8	Very high	86.4	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.005	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	112.2	-172.4	-50.5	176.3	0	0	0	108.9	I410 V412 F424 L425 F428 L429 F442 Q462 V463 E464	I410-I440 HydrophobicContact CD1-CG1 4.34Å; I410-I440 HydrophobicContact CD1-CG2 4.27Å; I410-I440 HydrophobicContact CG1-CB 4.47Å; I410-I440 HydrophobicContact CG1-CG1 4.29Å; I410-I440 HydrophobicContact CG1-CG2 4.31Å; V412-I440 HydrophobicContact CG2-CG2 3.68Å; F424-I440 HydrophobicContact CE1-CD1 4.28Å; F424-I440 HydrophobicContact CE1-CG2 4.11Å; L425-I440 HydrophobicContact CD2-CD1 3.53Å; F428-I440 HydrophobicContact CD1-CD1 3.58Å; F428-I440 HydrophobicContact CD1-CG1 4.24Å; F428-I440 HydrophobicContact CE1-CD1 3.92Å; F428-I440 HydrophobicContact CE1-CG1 4.06Å; F428-I440 HydrophobicContact CG-CD1 4.28Å; L429-I440 HydrophobicContact CD1-CD1 4.12Å; L429-I440 HydrophobicContact CD2-CD1 3.95Å; L429-I440 HydrophobicContact CG-CD1 3.98Å; I440-F442 HydrophobicContact CB-CE2 4.35Å; I440-F442 HydrophobicContact CG2-CD2 4.03Å; I440-F442 HydrophobicContact CG2-CE2 3.45Å; I440-F442 VanDerWaalsContact CG2-CE2 3.45Å; I440-F442 HydrophobicContact CG2-CZ 3.81Å; I440-Q462 PolarHBondContact N-O 2.85Å; I440-V463 HydrophobicContact CB-CG2 4.28Å; I440-V463 HydrophobicContact CD1-CG2 4.31Å; I440-V463 WeakPolarHBondContact O-CA 3.5Å; I440-E464 PolarHBondContact O-N 2.72Å
441	V	97.3	Very high	86.7	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.006	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	104.1	-176.4	-175.7	0	0	0	0	109.6	Y401 H409 I410 V411 V412 Y466 V479	Y401-V441 HydrophobicContact CD1-CG2 4.49Å; Y401-V441 HydrophobicContact CD2-CG2 3.75Å; Y401-V441 HydrophobicContact CE2-CG2 3.93Å; Y401-V441 HydrophobicContact CG-CG2 4.06Å; H409-V441 HydrophobicContact CB-CG2 4.22Å; I410-V441 PolarHBondContact O-N 3.24Å; V411-V441 CarbonylContact C-O 3.58Å; V411-V441 WeakPolarHBondContact CA-O 3.35Å; V412-V441 PolarHBondContact N-O 3.44Å; V441-Y466 HydrophobicContact CG1-CD2 3.66Å; V441-Y466 HydrophobicContact CG1-CE2 3.95Å; V441-V479 HydrophobicContact CG1-CB 3.95Å; V441-V479 HydrophobicContact CG1-CG1 3.93Å
442	F	97.8	Very high	87.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	132.3	177.4	-71.9	-87.3	0	0	0	111.5	V412 I416 V421 F424 L425 I440 F456 V463 E464 F465 Y466	V412-F442 HydrophobicContact CB-CD1 3.71Å; V412-F442 HydrophobicContact CB-CE1 3.72Å; V412-F442 HydrophobicContact CB-CG 4.4Å; V412-F442 HydrophobicContact CB-CZ 4.43Å; V412-F442 HydrophobicContact CG1-CD1 3.84Å; V412-F442 HydrophobicContact CG1-CE1 3.57Å; V412-F442 HydrophobicContact CG1-CZ 4.49Å; V412-F442 HydrophobicContact CG2-CE1 4.26Å; V412-F442 CarbonylContact O-C 2.95Å; V412-F442 WeakPolarHBondContact O-CA 3.46Å; I416-F442 HydrophobicContact CD1-CB 4.37Å; I416-F442 HydrophobicContact CD1-CD1 3.84Å; I416-F442 HydrophobicContact CG1-CD1 4.11Å; I416-F442 HydrophobicContact CG2-CD1 4.34Å; V421-F442 HydrophobicContact CG1-CE1 4.21Å; V421-F442 HydrophobicContact CG1-CE2 4.38Å; V421-F442 HydrophobicContact CG1-CZ 3.8Å; V421-F442 HydrophobicContact CG2-CD1 4.31Å; V421-F442 HydrophobicContact CG2-CE1 3.72Å; V421-F442 HydrophobicContact CG2-CZ 4.18Å; F424-F442 HydrophobicContact CD1-CZ 4.22Å; F424-F442 HydrophobicContact CE1-CZ 4.49Å; L425-F442 HydrophobicContact CD2-CE2 4.33Å; L425-F442 HydrophobicContact CD2-CZ 4.25Å; I440-F442 HydrophobicContact CB-CE2 4.35Å; I440-F442 HydrophobicContact CG2-CD2 4.03Å; I440-F442 HydrophobicContact CG2-CE2 3.45Å; I440-F442 VanDerWaalsContact CG2-CE2 3.45Å; I440-F442 HydrophobicContact CG2-CZ 3.81Å; F442-F456 HydrophobicContact CB-CZ 4.45Å; F442-F456 AromaticContact CD2-CE1 3.71Å; F442-F456 HydrophobicContact CD2-CE1 3.71Å; F442-F456 HydrophobicContact CD2-CZ 4.12Å; F442-F456 AromaticContact CE2-CE1 3.86Å; F442-F456 HydrophobicContact CE2-CE1 3.86Å; F442-F456 HydrophobicContact CG-CE1 4.22Å; F442-F456 HydrophobicContact CG-CZ 4.2Å; F442-F456 HydrophobicContact CZ-CE1 4.48Å; F442-V463 HydrophobicContact CD2-CG1 3.62Å; F442-V463 HydrophobicContact CE2-CG1 3.53Å; F442-E464 PolarHBondContact N-O 3.01Å; F442-F465 HydrophobicContact CB-CB 4.42Å; F442-F465 HydrophobicContact CB-CD2 3.67Å; F442-F465 HydrophobicContact CB-CE2 4.42Å; F442-F465 HydrophobicContact CB-CG 4.44Å; F442-Y466 PolarHBondContact O-N 2.93Å
443	L	97.6	Very high	88.4	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	108.5	176.3	-179.1	59	0	0	0	110.9	V411 V412 C413 V470 D475 V479	V411-L443 HydrophobicContact CG1-CB 4.32Å; V412-L443 PolarHBondContact O-N 2.86Å; C413-L443 HydrophobicContact CB-CB 4.46Å; L443-V470 HydrophobicContact CD2-CG2 4.34Å; L443-D475 HydrophobicContact CD1-CB 4.32Å; L443-D475 HydrophobicContact CD2-CB 4.4Å; L443-V479 HydrophobicContact CB-CG1 4.26Å; L443-V479 HydrophobicContact CD1-CG1 4.06Å; L443-V479 HydrophobicContact CD2-CG1 4.19Å; L443-V479 HydrophobicContact CD2-CG2 4.05Å; L443-V479 HydrophobicContact CG-CG1 4.39Å
444	H	96.8	Very high	89.2	Confident	27 Å²	27	56.1 Å²	56.1	13%	0.125	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	148.5	-178.4	-164.9	-127.3	0	0	0	112.1	G414 I416 I446 F465 Y466 Q467 G468	G414-H444 PolarHBondContact O-CD2 3.19Å; G414-H444 VanDerWaalsContact O-CD2 3.24Å; I416-H444 HydrophobicContact CB-CB 4.23Å; I416-H444 HydrophobicContact CD1-CB 3.86Å; I416-H444 HydrophobicContact CG2-CB 4.47Å; H444-I446 PolarHBondContact ND1-O 2.74Å; H444-I446 VanDerWaalsContact ND1-O 3.08Å; H444-F465 HydrophobicContact CB-CE2 3.75Å; H444-F465 HydrophobicContact CB-CZ 3.85Å; H444-Y466 PolarHBondContact N-O 3.13Å; H444-Q467 CarbonylContact O-C 3.58Å; H444-Q467 WeakPolarHBondContact O-CA 3.09Å; H444-G468 CarbonylContact C-O 3.44Å; H444-G468 PolarHBondContact O-N 2.83Å; H444-G468 VanDerWaalsContact O-O 3.13Å
445	N	93.5	Very high	90.3	Very high	96 Å²	96	53.4 Å²	53.4	51%	0.513	29%	0.293	S	S	.	.	S	Bend	trans	-80.8	-34.3	-176.4	59.3	-20.6	0	0	0	112.7	Q467 G468	N445-Q467 VanDerWaalsContact O-CG 3.29Å; N445-Q467 WeakPolarHBondContact O-CG 3.49Å; N445-Q467 PolarHBondContact O-NE2 2.84Å; N445-G468 WeakPolarHBondContact CA-O 3.29Å; N445-G468 PolarHBondContact N-O 2.69Å
446	I	92.9	Very high	92	Very high	108 Å²	108	46.3 Å²	46.3	55%	0.554	25%	0.254	S	S	*	.	S	Bend	trans	-83.1	135	174.2	-49	175.2	0	0	0	109	H444	H444-I446 PolarHBondContact ND1-O 2.74Å; H444-I446 VanDerWaalsContact ND1-O 3.08Å
447	S	91.3	Very high	93.2	Very high	68 Å²	68	48.4 Å²	48.4	48%	0.476	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-64.9	145.8	173.3	47.9	0	0	0	0	111.8
448	P	94.1	Very high	93.8	Very high	14 Å²	14	53.2 Å²	53.2	9%	0.091	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-62.8	150.8	179.1	28.4	-36.1	0	0	0	111.6	Y397 L452 E453 F456 F465	Y397-P448 HydrophobicContact CD2-CG 4.28Å; Y397-P448 HydrophobicContact CE2-CG 3.65Å; P448-L452 HydrophobicContact CB-CB 4.02Å; P448-L452 HydrophobicContact CB-CD2 3.85Å; P448-L452 HydrophobicContact CB-CG 3.9Å; P448-E453 HydrophobicContact CB-CG 4.3Å; P448-E453 HydrophobicContact CG-CG 3.89Å; P448-F456 HydrophobicContact CB-CE2 4.11Å; P448-F456 HydrophobicContact CG-CE2 4.45Å; P448-F465 HydrophobicContact CG-CD1 4.39Å; P448-F465 HydrophobicContact CG-CE1 4.36Å
449	N	93.5	Very high	93.8	Very high	77 Å²	77	55 Å²	55	41%	0.412	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-76.1	172	167.3	79.3	-14.8	0	0	0	110.6	E451 L452 E453	N449-E451 PolarHBondContact ND2-OE2 3.3Å; N449-E451 PolarHBondContact O-N 2.59Å; N449-E451 PolarHBondContact OD1-N 2.88Å; N449-L452 PolarHBondContact O-N 2.87Å; N449-L452 WeakPolarHBondContact OD1-CB 3.36Å; N449-L452 PolarHBondContact OD1-N 3.07Å; N449-E453 PolarHBondContact O-N 3.49Å
450	L	93.6	Very high	93.4	Very high	145 Å²	145	61.8 Å²	61.8	76%	0.759	30%	0.304	S	S	*	.	H	α-helix	trans	-63.3	-27.9	-175.2	-63.8	176.5	0	0	0	113.5	A454	L450-A454 PolarHBondContact O-N 2.64Å
451	E	92.7	Very high	93	Very high	112 Å²	112	67 Å²	67	52%	0.523	34%	0.336	S	S	.	.	H	α-helix	trans	-74.7	-45.1	178.4	-61.1	155	163.7	0	0	111	L418 N449 E453 A454 L455	L418-E451 HydrophobicContact CD1-CB 4.05Å; L418-E451 HydrophobicContact CD2-CB 3.8Å; L418-E451 HydrophobicContact CD2-CG 4.44Å; L418-E451 HydrophobicContact CG-CB 4.5Å; N449-E451 PolarHBondContact ND2-OE2 3.3Å; N449-E451 PolarHBondContact O-N 2.59Å; N449-E451 PolarHBondContact OD1-N 2.88Å; E451-E453 VanDerWaalsContact C-N 3.32Å; E451-A454 CarbonylContact O-C 3.59Å; E451-A454 WeakPolarHBondContact O-CA 3.45Å; E451-A454 WeakPolarHBondContact O-CB 3.41Å; E451-A454 PolarHBondContact O-N 3.24Å; E451-L455 PolarHBondContact O-N 2.88Å
452	L	92.9	Very high	92.6	Very high	6 Å²	6	70.5 Å²	70.5	3%	0.031	35%	0.352	C	S	.	.	H	α-helix	trans	-67.2	-34.2	174.4	-175.6	57.9	0	0	0	111.2	I416 V421 P448 N449 A454 L455 F456	I416-L452 HydrophobicContact CG2-CD2 4.12Å; V421-L452 HydrophobicContact CB-CD1 3.86Å; V421-L452 HydrophobicContact CG1-CD1 3.83Å; V421-L452 HydrophobicContact CG2-CD1 4.03Å; P448-L452 HydrophobicContact CB-CB 4.02Å; P448-L452 HydrophobicContact CB-CD2 3.85Å; P448-L452 HydrophobicContact CB-CG 3.9Å; N449-L452 PolarHBondContact O-N 2.87Å; N449-L452 WeakPolarHBondContact OD1-CB 3.36Å; N449-L452 PolarHBondContact OD1-N 3.07Å; L452-A454 VanDerWaalsContact C-N 3.32Å; L452-A454 PolarHBondContact O-N 2.92Å; L452-L455 HydrophobicContact CD1-CD2 4.21Å; L452-L455 PolarHBondContact O-N 2.78Å; L452-F456 HydrophobicContact CD1-CD1 4.31Å; L452-F456 HydrophobicContact CD1-CE1 3.76Å; L452-F456 HydrophobicContact CD1-CE2 4.03Å; L452-F456 HydrophobicContact CD1-CZ 3.6Å; L452-F456 HydrophobicContact CD2-CE2 4.14Å; L452-F456 HydrophobicContact CD2-CZ 4.06Å; L452-F456 HydrophobicContact CG-CD2 4.24Å; L452-F456 HydrophobicContact CG-CE1 4.31Å; L452-F456 HydrophobicContact CG-CE2 3.64Å; L452-F456 HydrophobicContact CG-CZ 3.69Å; L452-F456 WeakPolarHBondContact O-CD2 3.41Å; L452-F456 VanDerWaalsContact O-CG 3.27Å; L452-F456 WeakPolarHBondContact O-CG 3.32Å; L452-F456 PolarHBondContact O-N 3.26Å
453	E	93.1	Very high	92.4	Very high	21 Å²	21	70.9 Å²	70.9	10%	0.098	36%	0.355	C	S	.	.	H	α-helix	trans	-60	-39.6	166.2	-80.9	-152.9	-154.8	0	0	112.9	K396 Y397 P448 N449 E451 K457	K396-E453 IonicContact NZ-OE1 2.65Å; K396-E453 PolarHBondContact NZ-OE1 2.79Å; K396-E453 IonicContact NZ-OE2 3.96Å; K396-E453 PolarHBondContact NZ-OE2 2.66Å; Y397-E453 VanDerWaalsContact OH-CG 3.3Å; Y397-E453 WeakPolarHBondContact OH-CG 3.44Å; Y397-E453 PolarHBondContact OH-OE1 2.86Å; Y397-E453 PolarHBondContact OH-OE2 2.97Å; P448-E453 HydrophobicContact CB-CG 4.3Å; P448-E453 HydrophobicContact CG-CG 3.89Å; N449-E453 PolarHBondContact O-N 3.49Å; E451-E453 VanDerWaalsContact C-N 3.32Å; E453-K457 WeakPolarHBondContact O-CB 3.3Å; E453-K457 WeakPolarHBondContact O-CD 3.48Å; E453-K457 WeakPolarHBondContact O-CG 3.48Å; E453-K457 PolarHBondContact O-N 3.07Å; E453-K457 IonicContact OE2-NZ 2.72Å; E453-K457 PolarHBondContact OE2-NZ 3.44Å
454	A	93.5	Very high	92.2	Very high	43 Å²	43	74.5 Å²	74.5	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-69.6	-38.3	177.1	0	0	0	0	0	111.3	L450 E451 L452 K457 R458	L450-A454 PolarHBondContact O-N 2.64Å; E451-A454 CarbonylContact O-C 3.59Å; E451-A454 WeakPolarHBondContact O-CA 3.45Å; E451-A454 WeakPolarHBondContact O-CB 3.41Å; E451-A454 PolarHBondContact O-N 3.24Å; L452-A454 VanDerWaalsContact C-N 3.32Å; L452-A454 PolarHBondContact O-N 2.92Å; A454-K457 PolarHBondContact O-N 2.9Å; A454-R458 WeakPolarHBondContact O-CG 3.38Å; A454-R458 PolarHBondContact O-N 2.82Å; A454-R458 VanDerWaalsContact O-N 3.08Å
455	L	93.5	Very high	92.2	Very high	19 Å²	19	73.9 Å²	73.9	10%	0.099	37%	0.368	C	S	.	.	H	α-helix	trans	-62.8	-47.5	174.2	-176.4	58.3	0	0	0	111.6	L418 V421 L425 E451 L452 K457 R458 H459	L418-L455 HydrophobicContact CD1-CD2 4.13Å; V421-L455 HydrophobicContact CB-CD2 4.37Å; V421-L455 HydrophobicContact CG1-CD2 3.83Å; L425-L455 HydrophobicContact CD1-CD1 4.47Å; L425-L455 HydrophobicContact CD1-CD2 4.27Å; L425-L455 HydrophobicContact CD1-CG 4.13Å; E451-L455 PolarHBondContact O-N 2.88Å; L452-L455 HydrophobicContact CD1-CD2 4.21Å; L452-L455 PolarHBondContact O-N 2.78Å; L455-K457 VanDerWaalsContact C-N 3.32Å; L455-K457 PolarHBondContact O-N 2.76Å; L455-R458 WeakPolarHBondContact O-CB 3.37Å; L455-R458 PolarHBondContact O-N 3.04Å; L455-R458 VanDerWaalsContact O-N 3.13Å; L455-H459 PolarHBondContact O-N 3.15Å
456	F	94.1	Very high	92.3	Very high	16 Å²	16	70.4 Å²	70.4	7%	0.07	35%	0.349	C	S	.	.	H	α-helix	trans	-61.3	-38.5	174.5	-64	-30.4	0	0	0	112.4	V421 F442 P448 L452 R458 H459 F460 V463 F465	V421-F456 HydrophobicContact CG1-CE1 3.92Å; F442-F456 HydrophobicContact CB-CZ 4.45Å; F442-F456 AromaticContact CD2-CE1 3.71Å; F442-F456 HydrophobicContact CD2-CE1 3.71Å; F442-F456 HydrophobicContact CD2-CZ 4.12Å; F442-F456 AromaticContact CE2-CE1 3.86Å; F442-F456 HydrophobicContact CE2-CE1 3.86Å; F442-F456 HydrophobicContact CG-CE1 4.22Å; F442-F456 HydrophobicContact CG-CZ 4.2Å; F442-F456 HydrophobicContact CZ-CE1 4.48Å; P448-F456 HydrophobicContact CB-CE2 4.11Å; P448-F456 HydrophobicContact CG-CE2 4.45Å; L452-F456 HydrophobicContact CD1-CD1 4.31Å; L452-F456 HydrophobicContact CD1-CE1 3.76Å; L452-F456 HydrophobicContact CD1-CE2 4.03Å; L452-F456 HydrophobicContact CD1-CZ 3.6Å; L452-F456 HydrophobicContact CD2-CE2 4.14Å; L452-F456 HydrophobicContact CD2-CZ 4.06Å; L452-F456 HydrophobicContact CG-CD2 4.24Å; L452-F456 HydrophobicContact CG-CE1 4.31Å; L452-F456 HydrophobicContact CG-CE2 3.64Å; L452-F456 HydrophobicContact CG-CZ 3.69Å; L452-F456 WeakPolarHBondContact O-CD2 3.41Å; L452-F456 VanDerWaalsContact O-CG 3.27Å; L452-F456 WeakPolarHBondContact O-CG 3.32Å; L452-F456 PolarHBondContact O-N 3.26Å; F456-R458 VanDerWaalsContact C-N 3.3Å; F456-R458 PolarHBondContact O-N 3.26Å; F456-H459 CarbonylContact O-C 3.55Å; F456-H459 PolarHBondContact O-N 3.29Å; F456-H459 VanDerWaalsContact O-N 3.15Å; F456-F460 PolarHBondContact O-N 2.8Å; F456-V463 HydrophobicContact CD1-CG1 3.44Å; F456-V463 VanDerWaalsContact CD1-CG1 3.44Å; F456-V463 HydrophobicContact CE1-CG1 3.83Å; F456-V463 HydrophobicContact CG-CG1 4.26Å; F456-F465 HydrophobicContact CD2-CB 3.94Å; F456-F465 HydrophobicContact CD2-CD2 4.49Å; F456-F465 HydrophobicContact CD2-CG 4.36Å; F456-F465 HydrophobicContact CE2-CB 3.64Å; F456-F465 AromaticContact CE2-CD2 3.42Å; F456-F465 HydrophobicContact CE2-CD2 3.42Å; F456-F465 VanDerWaalsContact CE2-CD2 3.42Å; F456-F465 HydrophobicContact CE2-CE2 4.3Å; F456-F465 AromaticContact CE2-CG 3.67Å; F456-F465 HydrophobicContact CE2-CG 3.67Å; F456-F465 HydrophobicContact CZ-CB 4.19Å; F456-F465 AromaticContact CZ-CD2 3.66Å; F456-F465 HydrophobicContact CZ-CD2 3.66Å; F456-F465 HydrophobicContact CZ-CG 4.26Å
457	K	92.1	Very high	92.4	Very high	128 Å²	128	67.4 Å²	67.4	56%	0.557	33%	0.332	S	S	*	.	H	α-helix	trans	-65.5	-27.3	175	-74.6	163.3	-166.8	157	0	113.6	E453 A454 L455 H459	E453-K457 WeakPolarHBondContact O-CB 3.3Å; E453-K457 WeakPolarHBondContact O-CD 3.48Å; E453-K457 WeakPolarHBondContact O-CG 3.48Å; E453-K457 PolarHBondContact O-N 3.07Å; E453-K457 IonicContact OE2-NZ 2.72Å; E453-K457 PolarHBondContact OE2-NZ 3.44Å; A454-K457 PolarHBondContact O-N 2.9Å; L455-K457 VanDerWaalsContact C-N 3.32Å; L455-K457 PolarHBondContact O-N 2.76Å; K457-H459 VanDerWaalsContact C-N 3.32Å
458	R	91.9	Very high	92.6	Very high	200 Å²	200	64.6 Å²	64.6	76%	0.755	31%	0.314	S	S	*	.	H	α-helix	trans	-68.1	-32	172.6	-69.6	169.6	-176	-177.8	0.8	112.1	A454 L455 F456	A454-R458 WeakPolarHBondContact O-CG 3.38Å; A454-R458 PolarHBondContact O-N 2.82Å; A454-R458 VanDerWaalsContact O-N 3.08Å; L455-R458 WeakPolarHBondContact O-CB 3.37Å; L455-R458 PolarHBondContact O-N 3.04Å; L455-R458 VanDerWaalsContact O-N 3.13Å; F456-R458 VanDerWaalsContact C-N 3.3Å; F456-R458 PolarHBondContact O-N 3.26Å
459	H	89.3	Confident	92.7	Very high	49 Å²	49	66 Å²	66	23%	0.227	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	33.8	-177.8	-64.6	-81	0	0	0	113.2	L429 L455 F456 K457 T461 Q462 V463	L429-H459 HydrophobicContact CD1-CB 4.41Å; L455-H459 PolarHBondContact O-N 3.15Å; F456-H459 CarbonylContact O-C 3.55Å; F456-H459 PolarHBondContact O-N 3.29Å; F456-H459 VanDerWaalsContact O-N 3.15Å; K457-H459 VanDerWaalsContact C-N 3.32Å; H459-T461 PolarHBondContact O-N 2.77Å; H459-Q462 PolarHBondContact ND1-OE1 2.96Å; H459-Q462 PolarHBondContact O-N 2.97Å; H459-V463 HydrophobicContact CB-CB 4.06Å; H459-V463 HydrophobicContact CB-CG2 3.61Å; H459-V463 PolarHBondContact O-N 3.04Å
460	F	85.1	Confident	92.9	Very high	165 Å²	165	62.8 Å²	62.8	72%	0.724	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-27.2	-169	-177.9	-99.6	0	0	0	115.9	F456	F456-F460 PolarHBondContact O-N 2.8Å
461	T	86.3	Confident	93	Very high	109 Å²	109	60.4 Å²	60.4	67%	0.669	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	1.6	179.3	56.3	0	0	0	0	114.3	H459	H459-T461 PolarHBondContact O-N 2.77Å
462	Q	88.5	Confident	93.2	Very high	75 Å²	75	57.6 Å²	57.6	35%	0.35	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.9	-24.1	-172.5	-66.7	166.9	-43.3	0	0	112.4	L429 I440 H459	L429-Q462 HydrophobicContact CD1-CB 4.24Å; L429-Q462 HydrophobicContact CD2-CB 4.43Å; I440-Q462 PolarHBondContact N-O 2.85Å; H459-Q462 PolarHBondContact ND1-OE1 2.96Å; H459-Q462 PolarHBondContact O-N 2.97Å
463	V	93.8	Very high	93.4	Very high	8 Å²	8	60.6 Å²	60.6	5%	0.048	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	121.3	-170.2	179.3	0	0	0	0	111.2	L425 L429 I440 F442 F456 H459	L425-V463 HydrophobicContact CD1-CG2 4.27Å; L425-V463 HydrophobicContact CD2-CG2 3.89Å; L429-V463 HydrophobicContact CD1-CG2 4.23Å; I440-V463 HydrophobicContact CB-CG2 4.28Å; I440-V463 HydrophobicContact CD1-CG2 4.31Å; I440-V463 WeakPolarHBondContact O-CA 3.5Å; F442-V463 HydrophobicContact CD2-CG1 3.62Å; F442-V463 HydrophobicContact CE2-CG1 3.53Å; F456-V463 HydrophobicContact CD1-CG1 3.44Å; F456-V463 VanDerWaalsContact CD1-CG1 3.44Å; F456-V463 HydrophobicContact CE1-CG1 3.83Å; F456-V463 HydrophobicContact CG-CG1 4.26Å; H459-V463 HydrophobicContact CB-CB 4.06Å; H459-V463 HydrophobicContact CB-CG2 3.61Å; H459-V463 PolarHBondContact O-N 3.04Å
464	E	94.4	Very high	93.5	Very high	79 Å²	79	66.6 Å²	66.6	37%	0.369	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	152.5	170.6	-65.3	-163.7	159	0	0	111.2	Y401 I440 F442 Y466	Y401-E464 WeakPolarHBondContact CD2-OE2 3.41Å; I440-E464 PolarHBondContact O-N 2.72Å; F442-E464 PolarHBondContact N-O 3.01Å; E464-Y466 HydrophobicContact CB-CE2 4.23Å; E464-Y466 PolarHBondContact OE2-OH 3.08Å
465	F	96.3	Very high	93.7	Very high	13 Å²	13	65.6 Å²	65.6	6%	0.057	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	131.3	178.9	177.5	-80.6	0	0	0	111.4	Y397 I416 F442 H444 P448 F456 Q467	Y397-F465 HydrophobicContact CD1-CB 4.45Å; Y397-F465 AromaticContact CD1-CD1 3.64Å; Y397-F465 HydrophobicContact CD1-CD1 3.64Å; Y397-F465 HydrophobicContact CD1-CE1 4.46Å; Y397-F465 WeakPolarHBondContact CD1-O 3.35Å; Y397-F465 HydrophobicContact CD2-CD1 4.2Å; Y397-F465 HydrophobicContact CD2-CE1 4.29Å; Y397-F465 HydrophobicContact CE1-CD1 4.24Å; Y397-F465 AromaticContact CG-CD1 3.61Å; Y397-F465 HydrophobicContact CG-CD1 3.61Å; Y397-F465 AromaticContact CG-CE1 3.99Å; Y397-F465 HydrophobicContact CG-CE1 3.99Å; I416-F465 HydrophobicContact CG2-CE2 4.44Å; F442-F465 HydrophobicContact CB-CB 4.42Å; F442-F465 HydrophobicContact CB-CD2 3.67Å; F442-F465 HydrophobicContact CB-CE2 4.42Å; F442-F465 HydrophobicContact CB-CG 4.44Å; H444-F465 HydrophobicContact CB-CE2 3.75Å; H444-F465 HydrophobicContact CB-CZ 3.85Å; P448-F465 HydrophobicContact CG-CD1 4.39Å; P448-F465 HydrophobicContact CG-CE1 4.36Å; F456-F465 HydrophobicContact CD2-CB 3.94Å; F456-F465 HydrophobicContact CD2-CD2 4.49Å; F456-F465 HydrophobicContact CD2-CG 4.36Å; F456-F465 HydrophobicContact CE2-CB 3.64Å; F456-F465 AromaticContact CE2-CD2 3.42Å; F456-F465 HydrophobicContact CE2-CD2 3.42Å; F456-F465 VanDerWaalsContact CE2-CD2 3.42Å; F456-F465 HydrophobicContact CE2-CE2 4.3Å; F456-F465 AromaticContact CE2-CG 3.67Å; F456-F465 HydrophobicContact CE2-CG 3.67Å; F456-F465 HydrophobicContact CZ-CB 4.19Å; F456-F465 AromaticContact CZ-CD2 3.66Å; F456-F465 HydrophobicContact CZ-CD2 3.66Å; F456-F465 HydrophobicContact CZ-CG 4.26Å; F465-Q467 HydrophobicContact CE1-CB 4.23Å
466	Y	96.4	Very high	93.9	Very high	24 Å²	24	64.7 Å²	64.7	9%	0.094	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	129.7	176.7	-70.2	-71.9	0	0	0	111.8	G398 S400 Y401 V441 F442 H444 E464 G468 V479	G398-Y466 VanDerWaalsContact O-CD1 3.31Å; G398-Y466 WeakPolarHBondContact O-CD1 3.47Å; G398-Y466 VanDerWaalsContact O-CE1 3.32Å; G398-Y466 WeakPolarHBondContact O-CE1 3.19Å; S400-Y466 VanDerWaalsContact C-OH 3.25Å; S400-Y466 PolarHBondContact O-OH 3.15Å; Y401-Y466 VanDerWaalsContact CA-OH 3.28Å; Y401-Y466 WeakPolarHBondContact CA-OH 3.14Å; Y401-Y466 PolarHBondContact N-OH 3.01Å; V441-Y466 HydrophobicContact CG1-CD2 3.66Å; V441-Y466 HydrophobicContact CG1-CE2 3.95Å; F442-Y466 PolarHBondContact O-N 2.93Å; H444-Y466 PolarHBondContact N-O 3.13Å; E464-Y466 HydrophobicContact CB-CE2 4.23Å; E464-Y466 PolarHBondContact OE2-OH 3.08Å; Y466-G468 PolarHBondContact O-N 2.9Å; Y466-V479 HydrophobicContact CD2-CG1 4.07Å; Y466-V479 HydrophobicContact CG-CG1 4.39Å
467	Q	95.3	Very high	94	Very high	45 Å²	45	65.3 Å²	65.3	21%	0.21	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	106	177.4	-171.6	-168	21.9	0	0	110.6	Y397 H444 N445 F465 R478	Y397-Q467 PolarHBondContact O-N 3.26Å; H444-Q467 CarbonylContact O-C 3.58Å; H444-Q467 WeakPolarHBondContact O-CA 3.09Å; N445-Q467 VanDerWaalsContact O-CG 3.29Å; N445-Q467 WeakPolarHBondContact O-CG 3.49Å; N445-Q467 PolarHBondContact O-NE2 2.84Å; F465-Q467 HydrophobicContact CE1-CB 4.23Å; Q467-R478 VanDerWaalsContact C-NH2 3.3Å; Q467-R478 PolarHBondContact O-NH2 2.88Å
468	G	94.8	Very high	94.2	Very high	9 Å²	9	61.2 Å²	61.2	9%	0.093	30%	0.304	C	S	.	.			trans	-170.4	177.7	-177.5	0	0	0	0	0	112.8	H444 N445 Y466 D475	H444-G468 CarbonylContact C-O 3.44Å; H444-G468 PolarHBondContact O-N 2.83Å; H444-G468 VanDerWaalsContact O-O 3.13Å; N445-G468 WeakPolarHBondContact CA-O 3.29Å; N445-G468 PolarHBondContact N-O 2.69Å; Y466-G468 PolarHBondContact O-N 2.9Å; G468-D475 WeakPolarHBondContact CA-OD2 3.45Å
469	S	96.1	Very high	94.4	Very high	42 Å²	42	51.7 Å²	51.7	29%	0.294	27%	0.268	S	S	.	.			trans	-116	132.8	177.9	-176.4	0	0	0	0	111.7	L471 N472 D475	S469-L471 PolarHBondContact O-N 3.25Å; S469-L471 VanDerWaalsContact O-N 3.13Å; S469-L471 PolarHBondContact OG-N 2.96Å; S469-N472 WeakPolarHBondContact O-CB 3.43Å; S469-N472 PolarHBondContact O-N 3.03Å; S469-D475 PolarHBondContact N-OD2 2.77Å; S469-D475 WeakPolarHBondContact O-CB 3.5Å
470	V	96.9	Very high	94.8	Very high	10 Å²	10	52.3 Å²	52.3	6%	0.061	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-32.8	172.6	-169.1	0	0	0	0	111.9	C413 L443 N472 L476 R508 S511 I512	C413-V470 HydrophobicContact CB-CG2 3.41Å; C413-V470 VanDerWaalsContact CB-CG2 3.41Å; C413-V470 VanDerWaalsContact SG-CG2 3.55Å; L443-V470 HydrophobicContact CD2-CG2 4.34Å; V470-N472 PolarHBondContact O-N 3.12Å; V470-L476 HydrophobicContact CG1-CD2 4.08Å; V470-L476 WeakPolarHBondContact O-CG 3.37Å; V470-R508 HydrophobicContact CG1-CB 4.32Å; V470-S511 PolarHBondContact O-OG 3.35Å; V470-I512 HydrophobicContact CG1-CD1 3.67Å; V470-I512 HydrophobicContact CG1-CG1 3.49Å; V470-I512 VanDerWaalsContact CG1-CG1 3.49Å
471	L	96.9	Very high	95.3	Very high	95 Å²	95	44.5 Å²	44.5	50%	0.497	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-10.1	-179.5	-55.7	178.8	0	0	0	113.5	S469 M507 S511	S469-L471 PolarHBondContact O-N 3.25Å; S469-L471 VanDerWaalsContact O-N 3.13Å; S469-L471 PolarHBondContact OG-N 2.96Å; L471-M507 HydrophobicContact CD2-CB 4.41Å; L471-M507 WeakPolarHBondContact CD2-O 3.47Å; L471-S511 WeakPolarHBondContact CA-OG 3.46Å
472	N	97	Very high	95.7	Very high	54 Å²	54	42.7 Å²	42.7	29%	0.289	22%	0.22	S	C	.	.			trans	-102.1	115.3	-179.7	173	20.8	0	0	0	110.4	S469 V470 H474 D475 L476	S469-N472 WeakPolarHBondContact O-CB 3.43Å; S469-N472 PolarHBondContact O-N 3.03Å; V470-N472 PolarHBondContact O-N 3.12Å; N472-H474 PolarHBondContact O-N 3.26Å; N472-H474 VanDerWaalsContact O-N 3.1Å; N472-H474 WeakPolarHBondContact OD1-CB 3.33Å; N472-H474 PolarHBondContact OD1-N 2.9Å; N472-H474 VanDerWaalsContact OD1-N 3.13Å; N472-D475 HydrophobicContact CB-CB 4.27Å; N472-D475 VanDerWaalsContact ND2-CG 3.34Å; N472-D475 PolarHBondContact ND2-OD2 2.97Å; N472-D475 PolarHBondContact O-N 3Å; N472-L476 PolarHBondContact O-N 3.48Å
473	P	96.3	Very high	96	Very high	68 Å²	68	42.3 Å²	42.3	44%	0.442	23%	0.225	S	C	.	.	H	α-helix	trans	-63.6	-20.6	-178.6	26.8	-35.3	0	0	0	113.5	A477 Y515	P473-A477 WeakPolarHBondContact O-CB 3.48Å; P473-A477 PolarHBondContact O-N 2.98Å; P473-A477 VanDerWaalsContact O-N 3.12Å; P473-Y515 HydrophobicContact CB-CD2 3.86Å; P473-Y515 HydrophobicContact CB-CE2 4.15Å
474	H	95.9	Very high	96.1	Very high	148 Å²	148	42.6 Å²	42.6	69%	0.685	23%	0.228	S	C	*	.	H	α-helix	trans	-72.6	-30.4	172.5	-64.4	-67.8	0	0	0	113	N472 R478	N472-H474 PolarHBondContact O-N 3.26Å; N472-H474 VanDerWaalsContact O-N 3.1Å; N472-H474 WeakPolarHBondContact OD1-CB 3.33Å; N472-H474 PolarHBondContact OD1-N 2.9Å; N472-H474 VanDerWaalsContact OD1-N 3.13Å; H474-R478 VanDerWaalsContact O-CB 3.27Å; H474-R478 WeakPolarHBondContact O-CB 3.46Å; H474-R478 PolarHBondContact O-N 3.19Å
475	D	96.8	Very high	96.1	Very high	21 Å²	21	41.7 Å²	41.7	11%	0.112	23%	0.226	C	C	.	.	H	α-helix	trans	-77.2	-36.5	174.9	-76.7	-45.9	0	0	0	111.3	L443 G468 S469 N472 R478 V479	L443-D475 HydrophobicContact CD1-CB 4.32Å; L443-D475 HydrophobicContact CD2-CB 4.4Å; G468-D475 WeakPolarHBondContact CA-OD2 3.45Å; S469-D475 PolarHBondContact N-OD2 2.77Å; S469-D475 WeakPolarHBondContact O-CB 3.5Å; N472-D475 HydrophobicContact CB-CB 4.27Å; N472-D475 VanDerWaalsContact ND2-CG 3.34Å; N472-D475 PolarHBondContact ND2-OD2 2.97Å; N472-D475 PolarHBondContact O-N 3Å; D475-R478 WeakPolarHBondContact O-CA 3.35Å; D475-R478 VanDerWaalsContact O-CB 3.3Å; D475-R478 WeakPolarHBondContact O-CB 3.34Å; D475-R478 PolarHBondContact O-N 3Å; D475-R478 IonicContact OD1-CZ 2.66Å; D475-R478 VanDerWaalsContact OD1-CZ 3.25Å; D475-R478 IonicContact OD1-NE 3.85Å; D475-R478 PolarHBondContact OD1-NE 3.37Å; D475-R478 IonicContact OD1-NH2 2.7Å; D475-R478 PolarHBondContact OD1-NH2 3.26Å; D475-V479 PolarHBondContact O-N 3.18Å; D475-V479 VanDerWaalsContact O-N 3.09Å
476	L	97.3	Very high	96.1	Very high	1 Å²	1	41 Å²	41	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-57.2	-48.1	170.8	-68.3	-176.2	0	0	0	112.2	V470 N472 R478 V479 K480 I481 I512 Y515	V470-L476 HydrophobicContact CG1-CD2 4.08Å; V470-L476 WeakPolarHBondContact O-CG 3.37Å; N472-L476 PolarHBondContact O-N 3.48Å; L476-R478 PolarHBondContact O-N 2.97Å; L476-V479 WeakPolarHBondContact O-CG2 3.3Å; L476-V479 PolarHBondContact O-N 3.48Å; L476-K480 PolarHBondContact O-N 2.83Å; L476-I481 HydrophobicContact CB-CG2 3.85Å; L476-I481 HydrophobicContact CD2-CG1 4.47Å; L476-I481 HydrophobicContact CD2-CG2 4.49Å; L476-I481 PolarHBondContact O-N 3.14Å; L476-I512 HydrophobicContact CD2-CG1 4.32Å; L476-Y515 HydrophobicContact CB-CD1 4.23Å; L476-Y515 HydrophobicContact CB-CD2 4.19Å; L476-Y515 HydrophobicContact CB-CE1 4.4Å; L476-Y515 HydrophobicContact CB-CE2 4.35Å; L476-Y515 HydrophobicContact CB-CG 4.14Å; L476-Y515 HydrophobicContact CD1-CD1 4.44Å; L476-Y515 HydrophobicContact CD1-CD2 4.15Å; L476-Y515 HydrophobicContact CD1-CG 3.8Å
477	A	96.8	Very high	96.2	Very high	29 Å²	29	40 Å²	40	24%	0.24	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-16.9	174.3	0	0	0	0	0	114.1	P473 K480 Y515	P473-A477 WeakPolarHBondContact O-CB 3.48Å; P473-A477 PolarHBondContact O-N 2.98Å; P473-A477 VanDerWaalsContact O-N 3.12Å; A477-K480 WeakPolarHBondContact O-CE 3.42Å; A477-K480 PolarHBondContact O-NZ 3.12Å; A477-Y515 HydrophobicContact CB-CE2 4.46Å; A477-Y515 VanDerWaalsContact CB-OH 3.27Å; A477-Y515 WeakPolarHBondContact CB-OH 3.43Å
478	R	96.1	Very high	96.3	Very high	41 Å²	41	37.8 Å²	37.8	16%	0.155	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-28.4	-175.7	-170.8	169.4	71.2	89	-5.1	112.5	G399 S400 Y401 Q467 H474 D475 L476	G399-R478 WeakPolarHBondContact O-CD 3.23Å; G399-R478 WeakPolarHBondContact O-CG 3.27Å; G399-R478 PolarHBondContact O-NH1 3.4Å; S400-R478 CarbonylContact C-O 3.37Å; S400-R478 VanDerWaalsContact CA-O 3.3Å; S400-R478 WeakPolarHBondContact CA-O 3.21Å; S400-R478 WeakPolarHBondContact CB-O 3.33Å; Y401-R478 PolarHBondContact N-O 3.02Å; Q467-R478 VanDerWaalsContact C-NH2 3.3Å; Q467-R478 PolarHBondContact O-NH2 2.88Å; H474-R478 VanDerWaalsContact O-CB 3.27Å; H474-R478 WeakPolarHBondContact O-CB 3.46Å; H474-R478 PolarHBondContact O-N 3.19Å; D475-R478 WeakPolarHBondContact O-CA 3.35Å; D475-R478 VanDerWaalsContact O-CB 3.3Å; D475-R478 WeakPolarHBondContact O-CB 3.34Å; D475-R478 PolarHBondContact O-N 3Å; D475-R478 IonicContact OD1-CZ 2.66Å; D475-R478 VanDerWaalsContact OD1-CZ 3.25Å; D475-R478 IonicContact OD1-NE 3.85Å; D475-R478 PolarHBondContact OD1-NE 3.37Å; D475-R478 IonicContact OD1-NH2 2.7Å; D475-R478 PolarHBondContact OD1-NH2 3.26Å; L476-R478 PolarHBondContact O-N 2.97Å
479	V	96.8	Very high	96.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	4.8	169.8	-58.6	0	0	0	0	113.6	H409 V411 V441 L443 Y466 D475 L476 I481	H409-V479 PolarHBondContact NE2-O 3.11Å; V411-V479 HydrophobicContact CG1-CG2 3.94Å; V411-V479 HydrophobicContact CG2-CB 4.17Å; V411-V479 HydrophobicContact CG2-CG2 3.88Å; V441-V479 HydrophobicContact CG1-CB 3.95Å; V441-V479 HydrophobicContact CG1-CG1 3.93Å; L443-V479 HydrophobicContact CB-CG1 4.26Å; L443-V479 HydrophobicContact CD1-CG1 4.06Å; L443-V479 HydrophobicContact CD2-CG1 4.19Å; L443-V479 HydrophobicContact CD2-CG2 4.05Å; L443-V479 HydrophobicContact CG-CG1 4.39Å; Y466-V479 HydrophobicContact CD2-CG1 4.07Å; Y466-V479 HydrophobicContact CG-CG1 4.39Å; D475-V479 PolarHBondContact O-N 3.18Å; D475-V479 VanDerWaalsContact O-N 3.09Å; L476-V479 WeakPolarHBondContact O-CG2 3.3Å; L476-V479 PolarHBondContact O-N 3.48Å; V479-I481 PolarHBondContact O-N 2.98Å
480	K	96.4	Very high	96.4	Very high	62 Å²	62	35.6 Å²	35.6	27%	0.27	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	43.4	177.9	-54.1	-65.2	168.8	-153.4	0	114.4	Y401 H409 L476 A477 E482 S483 A484	Y401-K480 HydrophobicContact CD1-CB 3.96Å; Y401-K480 HydrophobicContact CD1-CG 3.96Å; H409-K480 PolarHBondContact CE1-O 2.9Å; H409-K480 PolarHBondContact NE2-O 3.08Å; L476-K480 PolarHBondContact O-N 2.83Å; A477-K480 WeakPolarHBondContact O-CE 3.42Å; A477-K480 PolarHBondContact O-NZ 3.12Å; K480-E482 VanDerWaalsContact C-OE2 3.25Å; K480-E482 VanDerWaalsContact CA-OE2 3.28Å; K480-E482 WeakPolarHBondContact CA-OE2 3.23Å; K480-E482 WeakPolarHBondContact CD-OE1 3.08Å; K480-E482 IonicContact NZ-OE1 2.69Å; K480-E482 PolarHBondContact NZ-OE1 3.18Å; K480-E482 PolarHBondContact O-N 3.46Å; K480-E482 VanDerWaalsContact O-N 3.11Å; K480-S483 WeakPolarHBondContact CB-OG 3.34Å; K480-S483 PolarHBondContact O-N 3Å; K480-S483 PolarHBondContact O-OG 3.34Å; K480-A484 PolarHBondContact O-N 2.74Å
481	I	96.8	Very high	96.4	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-55.1	-29.1	177.6	-157.3	68.2	0	0	0	111.9	V411 L476 V479 S483 A484 C487 I512 Y515 I519	V411-I481 HydrophobicContact CB-CD1 3.67Å; V411-I481 HydrophobicContact CG1-CD1 4.05Å; V411-I481 HydrophobicContact CG2-CD1 3.66Å; L476-I481 HydrophobicContact CB-CG2 3.85Å; L476-I481 HydrophobicContact CD2-CG1 4.47Å; L476-I481 HydrophobicContact CD2-CG2 4.49Å; L476-I481 PolarHBondContact O-N 3.14Å; V479-I481 PolarHBondContact O-N 2.98Å; I481-S483 PolarHBondContact O-N 3.31Å; I481-S483 VanDerWaalsContact O-N 3.11Å; I481-A484 HydrophobicContact CD1-CB 4.39Å; I481-A484 PolarHBondContact O-N 2.96Å; I481-C487 HydrophobicContact CD1-CB 4.02Å; I481-I512 HydrophobicContact CG1-CG2 4.22Å; I481-Y515 HydrophobicContact CG2-CD1 3.28Å; I481-Y515 HydrophobicContact CG2-CE1 3.37Å; I481-Y515 HydrophobicContact CG2-CG 4.34Å; I481-I519 HydrophobicContact CD1-CD1 3.47Å; I481-I519 VanDerWaalsContact CD1-CD1 3.47Å; I481-I519 HydrophobicContact CG1-CD1 3.64Å
482	E	94.7	Very high	96.1	Very high	72 Å²	72	32.3 Å²	32.3	34%	0.336	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-64.6	-9.5	175.8	68.5	-86	-162.1	0	0	114.8	K480 Y515	K480-E482 VanDerWaalsContact C-OE2 3.25Å; K480-E482 VanDerWaalsContact CA-OE2 3.28Å; K480-E482 WeakPolarHBondContact CA-OE2 3.23Å; K480-E482 WeakPolarHBondContact CD-OE1 3.08Å; K480-E482 IonicContact NZ-OE1 2.69Å; K480-E482 PolarHBondContact NZ-OE1 3.18Å; K480-E482 PolarHBondContact O-N 3.46Å; K480-E482 VanDerWaalsContact O-N 3.11Å; E482-Y515 HydrophobicContact CB-CE1 4.4Å
483	S	94.1	Very high	95.7	Very high	66 Å²	66	31 Å²	31	46%	0.462	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-133.6	2.7	179.6	59.5	0	0	0	0	113.8	K480 I481	K480-S483 WeakPolarHBondContact CB-OG 3.34Å; K480-S483 PolarHBondContact O-N 3Å; K480-S483 PolarHBondContact O-OG 3.34Å; I481-S483 PolarHBondContact O-N 3.31Å; I481-S483 VanDerWaalsContact O-N 3.11Å
484	A	95.7	Very high	95.1	Very high	14 Å²	14	30.5 Å²	30.5	12%	0.116	16%	0.156	C	C	.	.			trans	-73.4	147.5	175.7	0	0	0	0	0	110.7	H409 V411 K480 I481 I519	H409-A484 WeakPolarHBondContact O-CA 3.19Å; V411-A484 HydrophobicContact CG2-CB 4.01Å; K480-A484 PolarHBondContact O-N 2.74Å; I481-A484 HydrophobicContact CD1-CB 4.39Å; I481-A484 PolarHBondContact O-N 2.96Å; A484-I519 HydrophobicContact CB-CD1 4.08Å
485	D	94.9	Very high	94.6	Very high	60 Å²	60	24.1 Å²	24.1	32%	0.321	13%	0.128	S	C	.	.	S	Bend	trans	-76.5	-36.3	-178.7	-157	48.6	0	0	0	112.1	K408 H409 Y1055	K408-D485 HydrophobicContact CB-CB 4.41Å; K408-D485 HydrophobicContact CD-CB 4.08Å; K408-D485 WeakPolarHBondContact CD-OD2 3.23Å; K408-D485 WeakPolarHBondContact CE-OD1 3.32Å; K408-D485 IonicContact NZ-OD1 3.96Å; K408-D485 PolarHBondContact NZ-OD1 3.4Å; K408-D485 IonicContact NZ-OD2 2.27Å; K408-D485 PolarHBondContact NZ-OD2 3.33Å; H409-D485 PolarHBondContact O-N 3.38Å; D485-Y1055 PolarHBondContact OD2-OH 2.92Å
486	A	96.2	Very high	93.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	160.5	173.2	0	0	0	0	0	111.3	I410 V411 L488 R520 Y1055	I410-A486 WeakPolarHBondContact CA-O 3.33Å; I410-A486 HydrophobicContact CG2-CB 4.25Å; V411-A486 PolarHBondContact N-O 3.04Å; V411-A486 VanDerWaalsContact N-O 3.1Å; A486-L488 HydrophobicContact CB-CD1 4.01Å; A486-R520 CarbonylContact C-O 3.04Å; A486-R520 VanDerWaalsContact CA-O 3.27Å; A486-R520 WeakPolarHBondContact CA-O 3.34Å; A486-R520 HydrophobicContact CB-CB 4.19Å; A486-Y1055 HydrophobicContact CB-CD2 3.8Å; A486-Y1055 HydrophobicContact CB-CE2 3.77Å
487	C	97.7	Very high	93.4	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.9	164.7	-167.9	0	0	0	0	110.3	V411 I481 I512 I519 R520 I521 I522	V411-C487 CarbonylContact O-C 3.27Å; V411-C487 VanDerWaalsContact O-CA 3.26Å; V411-C487 WeakPolarHBondContact O-CA 3.4Å; V411-C487 PolarHBondContact O-SG 2.85Å; I481-C487 HydrophobicContact CD1-CB 4.02Å; C487-I512 HydrophobicContact CB-CD1 4.35Å; C487-I519 HydrophobicContact CB-CD1 3.97Å; C487-R520 PolarHBondContact N-O 2.77Å; C487-I521 WeakPolarHBondContact O-CA 3.45Å; C487-I522 PolarHBondContact O-N 3.43Å
488	L	98	Very high	93.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.1	179.4	-77.6	71.1	0	0	0	109	I410 V411 V412 C413 F424 A486 I522 M1051 Y1055	I410-L488 HydrophobicContact CB-CD1 4.31Å; I410-L488 HydrophobicContact CD1-CD1 4.18Å; I410-L488 HydrophobicContact CD1-CD2 4.35Å; I410-L488 HydrophobicContact CG2-CD1 4.38Å; V411-L488 PolarHBondContact O-N 3.46Å; V412-L488 WeakPolarHBondContact CA-O 3.42Å; V412-L488 HydrophobicContact CG2-CB 4.38Å; C413-L488 PolarHBondContact N-O 3Å; F424-L488 HydrophobicContact CE2-CD2 3.47Å; F424-L488 VanDerWaalsContact CE2-CD2 3.47Å; F424-L488 HydrophobicContact CZ-CD2 3.7Å; A486-L488 HydrophobicContact CB-CD1 4.01Å; L488-I522 CarbonylContact C-O 3.53Å; L488-I522 WeakPolarHBondContact CA-O 3.29Å; L488-I522 HydrophobicContact CG-CB 4.38Å; L488-M1051 HydrophobicContact CB-CE 3.9Å; L488-M1051 HydrophobicContact CD2-CE 4.26Å; L488-M1051 HydrophobicContact CG-CE 4.1Å; L488-Y1055 HydrophobicContact CD1-CD2 4.39Å
489	I	98.1	Very high	92.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	114.3	-179.5	-42.4	-176.2	0	0	0	109.3	C413 N505 R508 V509 I512 I521 I522 Q524	C413-I489 WeakPolarHBondContact O-CA 3.19Å; I489-N505 WeakPolarHBondContact CG2-OD1 3.3Å; I489-R508 HydrophobicContact CD1-CB 4.13Å; I489-V509 HydrophobicContact CD1-CG2 3.56Å; I489-I512 HydrophobicContact CD1-CD1 3.94Å; I489-I512 HydrophobicContact CG1-CD1 4.49Å; I489-I521 HydrophobicContact CD1-CG2 3.86Å; I489-I521 HydrophobicContact CG1-CG2 4.16Å; I489-I522 PolarHBondContact N-O 2.71Å; I489-Q524 PolarHBondContact O-N 2.78Å
490	L	96.3	Very high	92.8	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	140.3	176.8	-58.9	174.8	0	0	0	110.4	V412 C413 G414 H415 M1051	V412-L490 HydrophobicContact CG1-CD1 3.9Å; V412-L490 HydrophobicContact CG1-CG 4.21Å; C413-L490 PolarHBondContact O-N 2.98Å; G414-L490 CarbonylContact C-O 3.59Å; G414-L490 WeakPolarHBondContact CA-O 3.42Å; H415-L490 PolarHBondContact N-O 2.94Å; L490-M1051 HydrophobicContact CD2-CE 4.17Å; L490-M1051 HydrophobicContact CD2-CG 4.31Å
491	A	95.1	Very high	92.7	Very high	3 Å²	3	32 Å²	32	3%	0.025	19%	0.19	C	C	.	.			trans	-103.9	152.1	177	0	0	0	0	0	111.3	K493 Q524 L526	A491-K493 PolarHBondContact O-N 2.84Å; A491-Q524 HydrophobicContact CB-CB 3.76Å; A491-L526 HydrophobicContact CB-CD2 4.07Å; A491-L526 HydrophobicContact CB-CG 4.42Å
492	N	92.1	Very high	92.7	Very high	34 Å²	34	32 Å²	32	18%	0.182	19%	0.19	C	C	.	.			trans	-74.5	110	165.4	-176.8	1.1	0	0	0	108.9	H415 Y494 C495 E501 L526	H415-N492 HydrophobicContact CB-CB 4.16Å; N492-Y494 PolarHBondContact O-N 2.95Å; N492-Y494 PolarHBondContact OD1-N 3.35Å; N492-C495 HydrophobicContact CB-CB 4.11Å; N492-C495 PolarHBondContact O-SG 2.79Å; N492-E501 HydrophobicContact CB-CG 4.28Å; N492-L526 WeakPolarHBondContact O-CD1 3.33Å
493	K	88.4	Confident	92.8	Very high	25 Å²	25	30.9 Å²	30.9	11%	0.109	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-22.8	178.9	-63.8	-168.8	-71	-77.7	0	113.3	A491 L551 V1044 D1048	A491-K493 PolarHBondContact O-N 2.84Å; K493-L551 HydrophobicContact CD-CD1 3.93Å; K493-L551 HydrophobicContact CG-CD1 3.78Å; K493-V1044 HydrophobicContact CD-CG1 4.09Å; K493-V1044 HydrophobicContact CD-CG2 4.05Å; K493-D1048 IonicContact NZ-OD1 2.62Å; K493-D1048 PolarHBondContact NZ-OD1 3.18Å; K493-D1048 IonicContact NZ-OD2 3.36Å; K493-D1048 PolarHBondContact NZ-OD2 3.22Å
494	Y	83.6	Confident	92.9	Very high	58 Å²	58	30 Å²	30	23%	0.227	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	32.4	-169.3	-36.9	-57.4	0	0	0	111.7	E419 N492 V1010 V1044	E419-Y494 WeakPolarHBondContact OE1-CE2 3.49Å; E419-Y494 PolarHBondContact OE1-OH 2.86Å; N492-Y494 PolarHBondContact O-N 2.95Å; N492-Y494 PolarHBondContact OD1-N 3.35Å; Y494-V1010 HydrophobicContact CD1-CG1 3.57Å; Y494-V1010 HydrophobicContact CE1-CG1 3.56Å; Y494-V1044 HydrophobicContact CE1-CG1 3.95Å
495	C	85.3	Confident	93	Very high	14 Å²	14	29.4 Å²	29.4	10%	0.095	18%	0.182	C	C	.	.			trans	-78.8	145.6	178.5	59.5	0	0	0	0	112.5	N492 D497 E501 L526 N935	N492-C495 HydrophobicContact CB-CB 4.11Å; N492-C495 PolarHBondContact O-SG 2.79Å; C495-D497 VanDerWaalsContact C-N 3.33Å; C495-D497 PolarHBondContact O-N 3.04Å; C495-E501 HydrophobicContact CB-CB 4.37Å; C495-L526 WeakPolarHBondContact SG-CD1 3.38Å; C495-N935 VanDerWaalsContact O-CG 3.22Å; C495-N935 PolarHBondContact O-ND2 3.1Å
496	A	81.6	Confident	93.1	Very high	85 Å²	85	27.3 Å²	27.3	70%	0.702	17%	0.171	S	C	*	.	S	Bend	trans	-48.7	-50.2	177.4	0	0	0	0	0	113.6	N935	A496-N935 PolarHBondContact O-ND2 3.38Å; A496-N935 VanDerWaalsContact O-ND2 3.08Å
497	D	87.3	Confident	93.2	Very high	84 Å²	84	32.2 Å²	32.2	45%	0.449	20%	0.195	S	C	.	.			trans	-119.6	105.8	179.6	178.4	-3.2	0	0	0	110.2	C495 D499 A500 E501	C495-D497 VanDerWaalsContact C-N 3.33Å; C495-D497 PolarHBondContact O-N 3.04Å; D497-D499 VanDerWaalsContact C-N 3.31Å; D497-D499 PolarHBondContact O-N 3.48Å; D497-D499 PolarHBondContact OD1-N 3.3Å; D497-A500 HydrophobicContact CB-CB 4.01Å; D497-A500 PolarHBondContact O-N 3.04Å; D497-A500 PolarHBondContact OD1-N 3.45Å; D497-E501 PolarHBondContact O-N 2.88Å
498	P	91.3	Very high	93.2	Very high	14 Å²	14	34.3 Å²	34.3	9%	0.091	20%	0.203	C	C	.	.	H	α-helix	trans	-61.6	-31.4	176.9	-27.7	37.8	0	0	0	115.1	A500 D502 L526 Q527 A857	P498-A500 VanDerWaalsContact C-N 3.34Å; P498-D502 WeakPolarHBondContact O-CB 3.39Å; P498-D502 PolarHBondContact O-N 3.03Å; P498-L526 HydrophobicContact CB-CB 3.98Å; P498-L526 HydrophobicContact CB-CD1 3.8Å; P498-Q527 HydrophobicContact CB-CG 4.13Å; P498-A857 HydrophobicContact CG-CB 3.85Å
499	D	91.6	Very high	93.2	Very high	61 Å²	61	34.3 Å²	34.3	33%	0.326	20%	0.203	S	C	.	.	H	α-helix	trans	-72.2	-31.7	-179	-70	-51.4	0	0	0	111	D497 A503 H529 N530	D497-D499 VanDerWaalsContact C-N 3.31Å; D497-D499 PolarHBondContact O-N 3.48Å; D497-D499 PolarHBondContact OD1-N 3.3Å; D499-A503 VanDerWaalsContact O-CB 3.27Å; D499-A503 WeakPolarHBondContact O-CB 3.41Å; D499-A503 PolarHBondContact O-N 2.86Å; D499-H529 IonicContact OD1-CD2 2.73Å; D499-H529 IonicContact OD1-CE1 2.73Å; D499-H529 IonicContact OD1-NE2 3.23Å; D499-H529 PolarHBondContact OD1-NE2 2.99Å; D499-H529 IonicContact OD2-NE2 3.21Å; D499-N530 PolarHBondContact OD1-ND2 3.1Å
500	A	93.4	Very high	93.2	Very high	47 Å²	47	37.6 Å²	37.6	39%	0.388	22%	0.22	S	C	.	.	H	α-helix	trans	-71.4	-38	175.4	0	0	0	0	0	113.9	D497 P498 S504	D497-A500 HydrophobicContact CB-CB 4.01Å; D497-A500 PolarHBondContact O-N 3.04Å; D497-A500 PolarHBondContact OD1-N 3.45Å; P498-A500 VanDerWaalsContact C-N 3.34Å; A500-S504 WeakPolarHBondContact O-CB 3.37Å; A500-S504 PolarHBondContact O-N 2.95Å; A500-S504 PolarHBondContact O-OG 3.08Å
501	E	95	Very high	93.3	Very high	29 Å²	29	38.4 Å²	38.4	14%	0.136	23%	0.226	C	C	.	.	H	α-helix	trans	-73.4	-37.3	174.6	-176.2	58.1	-156.2	0	0	111.1	N492 C495 D497 S504 N505 R508 L526	N492-E501 HydrophobicContact CB-CG 4.28Å; C495-E501 HydrophobicContact CB-CB 4.37Å; D497-E501 PolarHBondContact O-N 2.88Å; E501-S504 CarbonylContact O-C 3.58Å; E501-S504 WeakPolarHBondContact O-CA 3.5Å; E501-S504 WeakPolarHBondContact O-CB 3.31Å; E501-S504 PolarHBondContact O-N 2.8Å; E501-N505 PolarHBondContact O-N 2.89Å; E501-N505 PolarHBondContact O-ND2 2.67Å; E501-R508 IonicContact OE1-CZ 2.93Å; E501-R508 IonicContact OE1-NH1 3.64Å; E501-R508 PolarHBondContact OE1-NH1 2.95Å; E501-R508 IonicContact OE1-NH2 2.67Å; E501-R508 PolarHBondContact OE1-NH2 3.47Å; E501-R508 VanDerWaalsContact OE1-NH2 3.09Å; E501-R508 IonicContact OE2-NH2 3.53Å; E501-L526 HydrophobicContact CB-CD1 4.19Å; E501-L526 HydrophobicContact CG-CD1 4.44Å
502	D	96.4	Very high	93.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-45.2	171.6	-86.9	-10	0	0	0	112.4	P498 S504 N505 I506 M525 L526 Q527 N530	P498-D502 WeakPolarHBondContact O-CB 3.39Å; P498-D502 PolarHBondContact O-N 3.03Å; D502-S504 PolarHBondContact O-N 2.9Å; D502-N505 WeakPolarHBondContact O-CB 3.27Å; D502-N505 PolarHBondContact O-N 3.32Å; D502-N505 VanDerWaalsContact O-N 3.12Å; D502-I506 WeakPolarHBondContact O-CD1 3.34Å; D502-I506 WeakPolarHBondContact O-CG1 3.48Å; D502-I506 PolarHBondContact O-N 2.9Å; D502-M525 HydrophobicContact CB-CE 3.7Å; D502-M525 WeakPolarHBondContact OD1-CA 3.16Å; D502-L526 PolarHBondContact OD1-N 2.7Å; D502-L526 PolarHBondContact OD2-N 3.3Å; D502-Q527 PolarHBondContact OD2-N 2.72Å; D502-N530 HydrophobicContact CB-CB 3.84Å; D502-N530 VanDerWaalsContact CB-ND2 3.25Å; D502-N530 WeakPolarHBondContact CB-ND2 3.28Å; D502-N530 WeakPolarHBondContact OD2-CB 3.26Å; D502-N530 PolarHBondContact OD2-ND2 2.8Å
503	A	96.5	Very high	93.7	Very high	49 Å²	49	37 Å²	37	41%	0.405	22%	0.217	S	C	.	.	H	α-helix	trans	-59.4	-37.9	173	0	0	0	0	0	111.6	D499 I506 M507	D499-A503 VanDerWaalsContact O-CB 3.27Å; D499-A503 WeakPolarHBondContact O-CB 3.41Å; D499-A503 PolarHBondContact O-N 2.86Å; A503-I506 PolarHBondContact O-N 3.13Å; A503-M507 WeakPolarHBondContact O-CG 3.4Å; A503-M507 PolarHBondContact O-N 3.04Å
504	S	96.5	Very high	94.1	Very high	49 Å²	49	42.5 Å²	42.5	34%	0.343	25%	0.248	S	C	.	.	H	α-helix	trans	-65.5	-39.2	174.3	-61.5	0	0	0	0	112.2	A500 E501 D502 M507 R508	A500-S504 WeakPolarHBondContact O-CB 3.37Å; A500-S504 PolarHBondContact O-N 2.95Å; A500-S504 PolarHBondContact O-OG 3.08Å; E501-S504 CarbonylContact O-C 3.58Å; E501-S504 WeakPolarHBondContact O-CA 3.5Å; E501-S504 WeakPolarHBondContact O-CB 3.31Å; E501-S504 PolarHBondContact O-N 2.8Å; D502-S504 PolarHBondContact O-N 2.9Å; S504-M507 PolarHBondContact O-N 2.92Å; S504-R508 VanDerWaalsContact O-CG 3.26Å; S504-R508 WeakPolarHBondContact O-CG 3.42Å; S504-R508 PolarHBondContact O-N 3.19Å
505	N	97.6	Very high	94.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-65.1	-45.7	173.2	-76.6	-43.4	0	0	0	112.3	I489 E501 D502 M507 R508 V509 M525	I489-N505 WeakPolarHBondContact CG2-OD1 3.3Å; E501-N505 PolarHBondContact O-N 2.89Å; E501-N505 PolarHBondContact O-ND2 2.67Å; D502-N505 WeakPolarHBondContact O-CB 3.27Å; D502-N505 PolarHBondContact O-N 3.32Å; D502-N505 VanDerWaalsContact O-N 3.12Å; N505-M507 VanDerWaalsContact C-N 3.27Å; N505-M507 PolarHBondContact O-N 3.49Å; N505-R508 WeakPolarHBondContact O-CA 3.41Å; N505-R508 WeakPolarHBondContact O-CB 3.42Å; N505-R508 PolarHBondContact O-N 3.45Å; N505-R508 PolarHBondContact OD1-NH1 3.46Å; N505-V509 WeakPolarHBondContact O-CG2 3.3Å; N505-V509 PolarHBondContact O-N 2.76Å; N505-M525 HydrophobicContact CB-SD 4.42Å
506	I	98	Very high	95.3	Very high	16 Å²	16	46 Å²	46	8%	0.082	26%	0.262	C	S	.	.	H	α-helix	trans	-57.3	-41.5	175.2	-67.4	156.9	0	0	0	110.7	D502 A503 V509 I510 M525 N530 H533 L534	D502-I506 WeakPolarHBondContact O-CD1 3.34Å; D502-I506 WeakPolarHBondContact O-CG1 3.48Å; D502-I506 PolarHBondContact O-N 2.9Å; A503-I506 PolarHBondContact O-N 3.13Å; I506-V509 PolarHBondContact O-N 3.37Å; I506-I510 HydrophobicContact CG2-CD1 3.85Å; I506-I510 HydrophobicContact CG2-CG1 4.47Å; I506-I510 VanDerWaalsContact O-CG1 3.29Å; I506-I510 WeakPolarHBondContact O-CG1 3.35Å; I506-I510 PolarHBondContact O-N 2.83Å; I506-M525 HydrophobicContact CD1-CE 3.84Å; I506-M525 HydrophobicContact CG1-CE 3.89Å; I506-N530 HydrophobicContact CD1-CB 4.28Å; I506-H533 HydrophobicContact CD1-CB 3.91Å; I506-L534 HydrophobicContact CB-CD2 4.45Å; I506-L534 HydrophobicContact CG1-CD2 3.85Å; I506-L534 HydrophobicContact CG1-CG 4.35Å
507	M	97.6	Very high	96	Very high	104 Å²	104	45.1 Å²	45.1	51%	0.512	25%	0.249	S	C	.	.	H	α-helix	trans	-67	-33.9	175.1	-70.9	-58.7	-61.3	0	0	113.5	L471 A503 S504 N505 I510 S511	L471-M507 HydrophobicContact CD2-CB 4.41Å; L471-M507 WeakPolarHBondContact CD2-O 3.47Å; A503-M507 WeakPolarHBondContact O-CG 3.4Å; A503-M507 PolarHBondContact O-N 3.04Å; S504-M507 PolarHBondContact O-N 2.92Å; N505-M507 VanDerWaalsContact C-N 3.27Å; N505-M507 PolarHBondContact O-N 3.49Å; M507-I510 HydrophobicContact SD-CD1 4.1Å; M507-S511 PolarHBondContact O-N 3.36Å; M507-S511 VanDerWaalsContact O-N 3.1Å
508	R	98.1	Very high	96.3	Very high	44 Å²	44	49.2 Å²	49.2	17%	0.166	26%	0.263	C	S	.	.	H	α-helix	trans	-63.4	-47	171	-65	161.4	-161.1	157.8	4.5	110.3	V470 I489 E501 S504 N505 I510 S511 I512	V470-R508 HydrophobicContact CG1-CB 4.32Å; I489-R508 HydrophobicContact CD1-CB 4.13Å; E501-R508 IonicContact OE1-CZ 2.93Å; E501-R508 IonicContact OE1-NH1 3.64Å; E501-R508 PolarHBondContact OE1-NH1 2.95Å; E501-R508 IonicContact OE1-NH2 2.67Å; E501-R508 PolarHBondContact OE1-NH2 3.47Å; E501-R508 VanDerWaalsContact OE1-NH2 3.09Å; E501-R508 IonicContact OE2-NH2 3.53Å; S504-R508 VanDerWaalsContact O-CG 3.26Å; S504-R508 WeakPolarHBondContact O-CG 3.42Å; S504-R508 PolarHBondContact O-N 3.19Å; N505-R508 WeakPolarHBondContact O-CA 3.41Å; N505-R508 WeakPolarHBondContact O-CB 3.42Å; N505-R508 PolarHBondContact O-N 3.45Å; N505-R508 PolarHBondContact OD1-NH1 3.46Å; R508-I510 PolarHBondContact O-N 3.32Å; R508-S511 PolarHBondContact O-N 3.08Å; R508-I512 WeakPolarHBondContact O-CD1 3.39Å; R508-I512 WeakPolarHBondContact O-CG1 3.42Å; R508-I512 PolarHBondContact O-N 3.36Å; R508-I512 VanDerWaalsContact O-N 3.12Å
509	V	98.3	Very high	96.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-57.3	-49.3	175.1	177	0	0	0	0	111.6	I489 N505 I506 S511 I512 K513 I521 T523 L534 I537 W540	I489-V509 HydrophobicContact CD1-CG2 3.56Å; N505-V509 WeakPolarHBondContact O-CG2 3.3Å; N505-V509 PolarHBondContact O-N 2.76Å; I506-V509 PolarHBondContact O-N 3.37Å; V509-S511 VanDerWaalsContact C-N 3.32Å; V509-S511 PolarHBondContact O-N 2.87Å; V509-I512 PolarHBondContact O-N 3.43Å; V509-K513 HydrophobicContact CG1-CG 4.28Å; V509-K513 PolarHBondContact O-N 3.02Å; V509-I521 HydrophobicContact CG1-CD1 4.13Å; V509-I521 HydrophobicContact CG2-CG2 4.23Å; V509-T523 HydrophobicContact CG2-CG2 4.35Å; V509-L534 HydrophobicContact CB-CD2 4.17Å; V509-L534 HydrophobicContact CG1-CD2 4.11Å; V509-L534 HydrophobicContact CG2-CD2 3.97Å; V509-I537 HydrophobicContact CB-CD1 4.46Å; V509-I537 HydrophobicContact CG1-CD1 3.83Å; V509-W540 HydrophobicContact CG1-CE3 3.82Å; V509-W540 HydrophobicContact CG1-CZ3 3.84Å; V509-W540 HydrophobicContact CG2-CZ3 4.49Å
510	I	98	Very high	96.8	Very high	69 Å²	69	47.4 Å²	47.4	35%	0.354	25%	0.25	S	S	.	.	H	α-helix	trans	-58.7	-43.5	179.9	-70.9	166.1	0	0	0	110.9	I506 M507 R508 N514 I537	I506-I510 HydrophobicContact CG2-CD1 3.85Å; I506-I510 HydrophobicContact CG2-CG1 4.47Å; I506-I510 VanDerWaalsContact O-CG1 3.29Å; I506-I510 WeakPolarHBondContact O-CG1 3.35Å; I506-I510 PolarHBondContact O-N 2.83Å; M507-I510 HydrophobicContact SD-CD1 4.1Å; R508-I510 PolarHBondContact O-N 3.32Å; I510-N514 WeakPolarHBondContact O-CB 3.43Å; I510-N514 PolarHBondContact O-N 2.81Å; I510-I537 HydrophobicContact CD1-CD1 4.43Å; I510-I537 HydrophobicContact CG1-CD1 3.65Å; I510-I537 HydrophobicContact CG1-CG1 4.14Å
511	S	98.1	Very high	97	Very high	22 Å²	22	45.1 Å²	45.1	15%	0.154	23%	0.232	C	C	.	.	H	α-helix	trans	-63.5	-45.7	179.2	-164.1	0	0	0	0	112.3	V470 L471 M507 R508 V509 N514 Y515	V470-S511 PolarHBondContact O-OG 3.35Å; L471-S511 WeakPolarHBondContact CA-OG 3.46Å; M507-S511 PolarHBondContact O-N 3.36Å; M507-S511 VanDerWaalsContact O-N 3.1Å; R508-S511 PolarHBondContact O-N 3.08Å; V509-S511 VanDerWaalsContact C-N 3.32Å; V509-S511 PolarHBondContact O-N 2.87Å; S511-N514 PolarHBondContact O-N 3.49Å; S511-Y515 PolarHBondContact O-N 3.14Å; S511-Y515 VanDerWaalsContact O-N 3.11Å
512	I	98.1	Very high	97.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-62.9	-50.2	177.7	-61.6	157.9	0	0	0	110.8	V470 L476 I481 C487 I489 R508 V509 N514 Y515 H516 I519 I521	V470-I512 HydrophobicContact CG1-CD1 3.67Å; V470-I512 HydrophobicContact CG1-CG1 3.49Å; V470-I512 VanDerWaalsContact CG1-CG1 3.49Å; L476-I512 HydrophobicContact CD2-CG1 4.32Å; I481-I512 HydrophobicContact CG1-CG2 4.22Å; C487-I512 HydrophobicContact CB-CD1 4.35Å; I489-I512 HydrophobicContact CD1-CD1 3.94Å; I489-I512 HydrophobicContact CG1-CD1 4.49Å; R508-I512 WeakPolarHBondContact O-CD1 3.39Å; R508-I512 WeakPolarHBondContact O-CG1 3.42Å; R508-I512 PolarHBondContact O-N 3.36Å; R508-I512 VanDerWaalsContact O-N 3.12Å; V509-I512 PolarHBondContact O-N 3.43Å; I512-N514 VanDerWaalsContact C-N 3.3Å; I512-N514 PolarHBondContact O-N 3.45Å; I512-Y515 PolarHBondContact O-N 2.83Å; I512-Y515 VanDerWaalsContact O-N 3.1Å; I512-H516 PolarHBondContact O-N 2.87Å; I512-I519 HydrophobicContact CG2-CG2 3.54Å; I512-I521 HydrophobicContact CB-CD1 3.81Å; I512-I521 HydrophobicContact CD1-CD1 4.32Å; I512-I521 HydrophobicContact CG2-CD1 3.59Å; I512-I521 HydrophobicContact CG2-CG1 4.23Å
513	K	97.1	Very high	97.2	Very high	6 Å²	6	43.8 Å²	43.8	3%	0.026	23%	0.225	C	C	.	.	H	α-helix	trans	-64.2	-32.8	-179.8	-73.9	-59.6	-165.9	174.6	0	112.8	V509 Y515 H516 P517 I519 I521 S539 D546	V509-K513 HydrophobicContact CG1-CG 4.28Å; V509-K513 PolarHBondContact O-N 3.02Å; K513-Y515 VanDerWaalsContact C-N 3.34Å; K513-H516 CarbonylContact O-C 3.57Å; K513-P517 WeakPolarHBondContact CD-O 3.49Å; K513-P517 PolarHBondContact NZ-O 2.95Å; K513-P517 VanDerWaalsContact NZ-O 3.13Å; K513-P517 VanDerWaalsContact O-CA 3.27Å; K513-P517 WeakPolarHBondContact O-CA 3.45Å; K513-P517 WeakPolarHBondContact O-CD 3.49Å; K513-P517 VanDerWaalsContact O-CG 3.32Å; K513-P517 WeakPolarHBondContact O-CG 3.3Å; K513-I519 PolarHBondContact NZ-O 2.89Å; K513-I521 HydrophobicContact CD-CD1 3.78Å; K513-I521 HydrophobicContact CD-CG1 4.49Å; K513-I521 HydrophobicContact CG-CD1 3.69Å; K513-S539 WeakPolarHBondContact CD-O 3.44Å; K513-S539 WeakPolarHBondContact CE-O 3.48Å; K513-S539 PolarHBondContact NZ-O 2.86Å; K513-S539 VanDerWaalsContact NZ-O 3.14Å; K513-D546 WeakPolarHBondContact CE-OD1 3.45Å; K513-D546 VanDerWaalsContact CE-OD2 3.3Å; K513-D546 WeakPolarHBondContact CE-OD2 3.29Å; K513-D546 IonicContact NZ-OD1 3.21Å; K513-D546 PolarHBondContact NZ-OD1 3.39Å; K513-D546 IonicContact NZ-OD2 2.71Å; K513-D546 PolarHBondContact NZ-OD2 3.19Å
514	N	97.1	Very high	97.2	Very high	142 Å²	142	41.5 Å²	41.5	76%	0.759	21%	0.206	S	C	*	.	H	α-helix	trans	-69.4	-30.9	174.2	-172.6	47.8	0	0	0	112.5	I510 S511 I512	I510-N514 WeakPolarHBondContact O-CB 3.43Å; I510-N514 PolarHBondContact O-N 2.81Å; S511-N514 PolarHBondContact O-N 3.49Å; I512-N514 VanDerWaalsContact C-N 3.3Å; I512-N514 PolarHBondContact O-N 3.45Å
515	Y	97.4	Very high	97.1	Very high	83 Å²	83	39.2 Å²	39.2	33%	0.325	19%	0.19	S	C	.	.	H	α-helix	trans	-79	-46.2	175.1	-172.9	-87.5	0	0	0	112.6	P473 L476 A477 I481 E482 S511 I512 K513	P473-Y515 HydrophobicContact CB-CD2 3.86Å; P473-Y515 HydrophobicContact CB-CE2 4.15Å; L476-Y515 HydrophobicContact CB-CD1 4.23Å; L476-Y515 HydrophobicContact CB-CD2 4.19Å; L476-Y515 HydrophobicContact CB-CE1 4.4Å; L476-Y515 HydrophobicContact CB-CE2 4.35Å; L476-Y515 HydrophobicContact CB-CG 4.14Å; L476-Y515 HydrophobicContact CD1-CD1 4.44Å; L476-Y515 HydrophobicContact CD1-CD2 4.15Å; L476-Y515 HydrophobicContact CD1-CG 3.8Å; A477-Y515 HydrophobicContact CB-CE2 4.46Å; A477-Y515 VanDerWaalsContact CB-OH 3.27Å; A477-Y515 WeakPolarHBondContact CB-OH 3.43Å; I481-Y515 HydrophobicContact CG2-CD1 3.28Å; I481-Y515 HydrophobicContact CG2-CE1 3.37Å; I481-Y515 HydrophobicContact CG2-CG 4.34Å; E482-Y515 HydrophobicContact CB-CE1 4.4Å; S511-Y515 PolarHBondContact O-N 3.14Å; S511-Y515 VanDerWaalsContact O-N 3.11Å; I512-Y515 PolarHBondContact O-N 2.83Å; I512-Y515 VanDerWaalsContact O-N 3.1Å; K513-Y515 VanDerWaalsContact C-N 3.34Å
516	H	96.8	Very high	96.9	Very high	62 Å²	62	39.9 Å²	39.9	29%	0.287	19%	0.194	S	C	.	.			trans	-142.9	93.8	177.9	-164.9	92.4	0	0	0	111.5	I512 K513 K518 I519	I512-H516 PolarHBondContact O-N 2.87Å; K513-H516 CarbonylContact O-C 3.57Å; H516-K518 PolarHBondContact O-N 2.91Å; H516-I519 WeakPolarHBondContact O-CG2 3.48Å; H516-I519 PolarHBondContact O-N 2.9Å
517	P	95.7	Very high	96.7	Very high	66 Å²	66	39.6 Å²	39.6	43%	0.429	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-27.3	-172.5	-29.6	34.8	0	0	0	116.3	K513	K513-P517 WeakPolarHBondContact CD-O 3.49Å; K513-P517 PolarHBondContact NZ-O 2.95Å; K513-P517 VanDerWaalsContact NZ-O 3.13Å; K513-P517 VanDerWaalsContact O-CA 3.27Å; K513-P517 WeakPolarHBondContact O-CA 3.45Å; K513-P517 WeakPolarHBondContact O-CD 3.49Å; K513-P517 VanDerWaalsContact O-CG 3.32Å; K513-P517 WeakPolarHBondContact O-CG 3.3Å
518	K	94.8	Very high	96.3	Very high	171 Å²	171	35.5 Å²	35.5	74%	0.743	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-2	-172	-62.6	-173.5	177.9	-176.1	0	115.2	H516	H516-K518 PolarHBondContact O-N 2.91Å
519	I	95.8	Very high	95.9	Very high	7 Å²	7	36.1 Å²	36.1	4%	0.036	18%	0.176	C	C	.	.	S	Bend	trans	-72.5	138.4	178.5	-169.9	174.5	0	0	0	109.3	I481 A484 C487 I512 K513 H516 I521	I481-I519 HydrophobicContact CD1-CD1 3.47Å; I481-I519 VanDerWaalsContact CD1-CD1 3.47Å; I481-I519 HydrophobicContact CG1-CD1 3.64Å; A484-I519 HydrophobicContact CB-CD1 4.08Å; C487-I519 HydrophobicContact CB-CD1 3.97Å; I512-I519 HydrophobicContact CG2-CG2 3.54Å; K513-I519 PolarHBondContact NZ-O 2.89Å; H516-I519 WeakPolarHBondContact O-CG2 3.48Å; H516-I519 PolarHBondContact O-N 2.9Å; I519-I521 HydrophobicContact CG2-CD1 4.3Å; I519-I521 HydrophobicContact CG2-CG1 4.03Å
520	R	97	Very high	95.6	Very high	29 Å²	29	36.8 Å²	36.8	11%	0.109	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	126.6	170.7	-172.8	-174.7	176.1	-175.7	4.2	109.9	A486 C487 G545 D547 T1054 Y1055 D1058	A486-R520 CarbonylContact C-O 3.04Å; A486-R520 VanDerWaalsContact CA-O 3.27Å; A486-R520 WeakPolarHBondContact CA-O 3.34Å; A486-R520 HydrophobicContact CB-CB 4.19Å; C487-R520 PolarHBondContact N-O 2.77Å; R520-G545 WeakPolarHBondContact CG-O 3.2Å; R520-G545 PolarHBondContact NE-O 2.99Å; R520-D547 IonicContact CZ-OD2 3.25Å; R520-D547 IonicContact NE-OD2 3.27Å; R520-D547 IonicContact NH2-OD2 2.77Å; R520-D547 PolarHBondContact NH2-OD2 2.85Å; R520-T1054 PolarHBondContact NH1-O 3.34Å; R520-T1054 PolarHBondContact NH2-O 3.42Å; R520-Y1055 PolarHBondContact NH1-O 2.93Å; R520-D1058 IonicContact CZ-OD1 3.25Å; R520-D1058 IonicContact NH1-OD1 2.88Å; R520-D1058 PolarHBondContact NH1-OD1 2.95Å; R520-D1058 IonicContact NH2-OD1 2.71Å; R520-D1058 PolarHBondContact NH2-OD1 3.23Å
521	I	97.8	Very high	95.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	129.2	175.3	-55.6	-178.6	0	0	0	110.4	C487 I489 V509 I512 K513 I519 W540 D546 D547	C487-I521 WeakPolarHBondContact O-CA 3.45Å; I489-I521 HydrophobicContact CD1-CG2 3.86Å; I489-I521 HydrophobicContact CG1-CG2 4.16Å; V509-I521 HydrophobicContact CG1-CD1 4.13Å; V509-I521 HydrophobicContact CG2-CG2 4.23Å; I512-I521 HydrophobicContact CB-CD1 3.81Å; I512-I521 HydrophobicContact CD1-CD1 4.32Å; I512-I521 HydrophobicContact CG2-CD1 3.59Å; I512-I521 HydrophobicContact CG2-CG1 4.23Å; K513-I521 HydrophobicContact CD-CD1 3.78Å; K513-I521 HydrophobicContact CD-CG1 4.49Å; K513-I521 HydrophobicContact CG-CD1 3.69Å; I519-I521 HydrophobicContact CG2-CD1 4.3Å; I519-I521 HydrophobicContact CG2-CG1 4.03Å; I521-W540 HydrophobicContact CB-CZ3 4.22Å; I521-W540 HydrophobicContact CG2-CZ3 4.34Å; I521-D546 PolarHBondContact N-OD1 3.36Å; I521-D546 CarbonylContact O-C 3.52Å; I521-D546 WeakPolarHBondContact O-CA 3.48Å; I521-D547 PolarHBondContact O-N 2.86Å
522	I	97.7	Very high	94.8	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	119.7	170.8	-51.8	175.7	0	0	0	107	C487 L488 I489 D547 I549 M1051 T1054	C487-I522 PolarHBondContact O-N 3.43Å; L488-I522 CarbonylContact C-O 3.53Å; L488-I522 WeakPolarHBondContact CA-O 3.29Å; L488-I522 HydrophobicContact CG-CB 4.38Å; I489-I522 PolarHBondContact N-O 2.71Å; I522-D547 WeakPolarHBondContact CA-O 3.42Å; I522-D547 HydrophobicContact CG1-CB 4.39Å; I522-D547 HydrophobicContact CG2-CB 4.3Å; I522-I549 HydrophobicContact CG2-CD1 4.03Å; I522-M1051 HydrophobicContact CB-CE 4.39Å; I522-M1051 HydrophobicContact CG2-CE 3.96Å; I522-M1051 HydrophobicContact CG2-SD 3.86Å; I522-T1054 HydrophobicContact CD1-CG2 4.22Å; I522-T1054 HydrophobicContact CG2-CG2 4.28Å
523	T	97.4	Very high	94.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	137.7	-179.1	-169.5	0	0	0	0	111.2	V509 M525 L534 W540 D547 A548 I549	V509-T523 HydrophobicContact CG2-CG2 4.35Å; T523-M525 HydrophobicContact CG2-CG 4.23Å; T523-M525 HydrophobicContact CG2-SD 4.09Å; T523-L534 HydrophobicContact CG2-CD1 3.69Å; T523-W540 HydrophobicContact CG2-CH2 4.13Å; T523-D547 PolarHBondContact N-O 3.31Å; T523-A548 HydrophobicContact CG2-CB 4.24Å; T523-I549 PolarHBondContact O-N 3.44Å
524	Q	96.3	Very high	94.3	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.009	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	143.5	159.3	-66.4	-179.6	-39.8	0	0	109	I489 A491 I549 D1048 M1051	I489-Q524 PolarHBondContact O-N 2.78Å; A491-Q524 HydrophobicContact CB-CB 3.76Å; Q524-I549 WeakPolarHBondContact CA-O 3.3Å; Q524-D1048 PolarHBondContact NE2-OD1 3.36Å; Q524-D1048 VanDerWaalsContact NE2-OD1 3.13Å; Q524-M1051 HydrophobicContact CG-CE 4.41Å; Q524-M1051 HydrophobicContact CG-CG 4.08Å; Q524-M1051 HydrophobicContact CG-SD 3.55Å; Q524-M1051 VanDerWaalsContact CG-SD 3.55Å
525	M	95.3	Very high	93.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	139.7	167.9	-61.9	-60.4	-63	0	0	107.5	D502 N505 I506 T523 N530 L534 A548 I549 C550 L551	D502-M525 HydrophobicContact CB-CE 3.7Å; D502-M525 WeakPolarHBondContact OD1-CA 3.16Å; N505-M525 HydrophobicContact CB-SD 4.42Å; I506-M525 HydrophobicContact CD1-CE 3.84Å; I506-M525 HydrophobicContact CG1-CE 3.89Å; T523-M525 HydrophobicContact CG2-CG 4.23Å; T523-M525 HydrophobicContact CG2-SD 4.09Å; M525-N530 HydrophobicContact CE-CB 3.65Å; M525-L534 HydrophobicContact CG-CD1 4.05Å; M525-L534 HydrophobicContact SD-CD1 3.91Å; M525-A548 HydrophobicContact CG-CB 4.44Å; M525-I549 PolarHBondContact N-O 3.11Å; M525-C550 HydrophobicContact CB-CB 4.49Å; M525-C550 CarbonylContact O-C 3.55Å; M525-C550 VanDerWaalsContact O-CA 3.29Å; M525-C550 WeakPolarHBondContact O-CA 3.29Å; M525-L551 PolarHBondContact O-N 3.11Å
526	L	93.6	Very high	93.5	Very high	14 Å²	14	36.5 Å²	36.5	7%	0.073	18%	0.181	C	C	.	.	S	Bend	trans	-81.3	-51	179.4	-56.4	177.5	0	0	0	109.7	A491 N492 C495 P498 E501 D502 L551 A552	A491-L526 HydrophobicContact CB-CD2 4.07Å; A491-L526 HydrophobicContact CB-CG 4.42Å; N492-L526 WeakPolarHBondContact O-CD1 3.33Å; C495-L526 WeakPolarHBondContact SG-CD1 3.38Å; P498-L526 HydrophobicContact CB-CB 3.98Å; P498-L526 HydrophobicContact CB-CD1 3.8Å; E501-L526 HydrophobicContact CB-CD1 4.19Å; E501-L526 HydrophobicContact CG-CD1 4.44Å; D502-L526 PolarHBondContact OD1-N 2.7Å; D502-L526 PolarHBondContact OD2-N 3.3Å; L526-L551 HydrophobicContact CD2-CD1 3.98Å; L526-A552 WeakPolarHBondContact O-CB 3.15Å; L526-A552 PolarHBondContact O-N 2.85Å
527	Q	92.2	Very high	93.3	Very high	11 Å²	11	34.5 Å²	34.5	5%	0.051	17%	0.172	C	C	.	.	S	Bend	trans	-100.8	155.1	-176.5	-62.4	-64.3	-17.5	0	0	113.6	P498 D502 H529 C550 L858	P498-Q527 HydrophobicContact CB-CG 4.13Å; D502-Q527 PolarHBondContact OD2-N 2.72Å; Q527-H529 VanDerWaalsContact CB-CE1 3.46Å; Q527-H529 WeakPolarHBondContact CB-CE1 3.28Å; Q527-C550 PolarHBondContact O-SG 3.35Å; Q527-C550 VanDerWaalsContact O-SG 3.41Å; Q527-L858 PolarHBondContact NE2-O 3.22Å
528	Y	90.7	Very high	93.2	Very high	18 Å²	18	37.8 Å²	37.8	7%	0.071	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-33	-177.5	-179.1	-104.2	0	0	0	113.5	K531 E553 I1080	Y528-K531 HydrophobicContact CD2-CD 4.24Å; Y528-K531 HydrophobicContact CE2-CD 4.25Å; Y528-K531 VanDerWaalsContact O-CB 3.24Å; Y528-K531 WeakPolarHBondContact O-CB 3.05Å; Y528-E553 HydrophobicContact CD2-CB 4.02Å; Y528-E553 HydrophobicContact CD2-CG 4.03Å; Y528-E553 HydrophobicContact CE2-CG 4.21Å; Y528-E553 WeakPolarHBondContact CE2-OE2 3.27Å; Y528-I1080 HydrophobicContact CE1-CD1 4.14Å; Y528-I1080 HydrophobicContact CE1-CG2 4.16Å
529	H	88.4	Confident	93.2	Very high	57 Å²	57	31.7 Å²	31.7	26%	0.264	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-41.4	176.4	48	-85.6	0	0	0	112.2	D499 Q527 K531 A532	D499-H529 IonicContact OD1-CD2 2.73Å; D499-H529 IonicContact OD1-CE1 2.73Å; D499-H529 IonicContact OD1-NE2 3.23Å; D499-H529 PolarHBondContact OD1-NE2 2.99Å; D499-H529 IonicContact OD2-NE2 3.21Å; Q527-H529 VanDerWaalsContact CB-CE1 3.46Å; Q527-H529 WeakPolarHBondContact CB-CE1 3.28Å; H529-K531 PolarHBondContact O-N 3.23Å; H529-A532 VanDerWaalsContact O-CB 3.26Å; H529-A532 WeakPolarHBondContact O-CB 3.5Å; H529-A532 PolarHBondContact O-N 3.06Å
530	N	92.3	Very high	93.1	Very high	13 Å²	13	32.6 Å²	32.6	7%	0.07	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-31.7	179.5	-66.7	-29.2	0	0	0	113	D499 D502 I506 M525 A532 H533	D499-N530 PolarHBondContact OD1-ND2 3.1Å; D502-N530 HydrophobicContact CB-CB 3.84Å; D502-N530 VanDerWaalsContact CB-ND2 3.25Å; D502-N530 WeakPolarHBondContact CB-ND2 3.28Å; D502-N530 WeakPolarHBondContact OD2-CB 3.26Å; D502-N530 PolarHBondContact OD2-ND2 2.8Å; I506-N530 HydrophobicContact CD1-CB 4.28Å; M525-N530 HydrophobicContact CE-CB 3.65Å; N530-A532 PolarHBondContact O-N 3.43Å; N530-H533 WeakPolarHBondContact O-CB 3.28Å; N530-H533 PolarHBondContact O-N 3.02Å
531	K	90.8	Very high	92.7	Very high	14 Å²	14	33.5 Å²	33.5	6%	0.061	18%	0.183	C	C	.	.	H	α-helix	trans	-53.9	-32.7	174	-162.8	-167	-173.9	-170.2	0	113.1	Y528 H529 H533 L534 A548 C550 E553 E1077	Y528-K531 HydrophobicContact CD2-CD 4.24Å; Y528-K531 HydrophobicContact CE2-CD 4.25Å; Y528-K531 VanDerWaalsContact O-CB 3.24Å; Y528-K531 WeakPolarHBondContact O-CB 3.05Å; H529-K531 PolarHBondContact O-N 3.23Å; K531-H533 PolarHBondContact O-N 2.9Å; K531-L534 WeakPolarHBondContact O-CB 3.42Å; K531-L534 PolarHBondContact O-N 2.93Å; K531-A548 VanDerWaalsContact CE-O 3.31Å; K531-A548 WeakPolarHBondContact CE-O 3.44Å; K531-A548 HydrophobicContact CG-CB 3.92Å; K531-C550 HydrophobicContact CD-CB 4.2Å; K531-E553 IonicContact NZ-OE1 3.86Å; K531-E553 IonicContact NZ-OE2 3.76Å; K531-E553 PolarHBondContact NZ-OE2 3.37Å; K531-E1077 IonicContact NZ-OE1 2.95Å; K531-E1077 PolarHBondContact NZ-OE1 2.87Å
532	A	88	Confident	92.1	Very high	20 Å²	20	39.8 Å²	39.8	17%	0.165	21%	0.206	C	C	.	.	H	α-helix	trans	-63.8	-29.4	178	0	0	0	0	0	112.6	H529 N530 L534 L535 A1081	H529-A532 VanDerWaalsContact O-CB 3.26Å; H529-A532 WeakPolarHBondContact O-CB 3.5Å; H529-A532 PolarHBondContact O-N 3.06Å; N530-A532 PolarHBondContact O-N 3.43Å; A532-L534 VanDerWaalsContact C-N 3.26Å; A532-L534 PolarHBondContact O-N 3.12Å; A532-L535 WeakPolarHBondContact O-CB 3.41Å; A532-L535 PolarHBondContact O-N 2.97Å; A532-A1081 HydrophobicContact CB-CB 3.82Å
533	H	91.5	Very high	91.4	Very high	97 Å²	97	45 Å²	45	45%	0.449	23%	0.229	S	C	.	.	H	α-helix	trans	-65.9	-27.9	177.7	-58.8	-42.1	0	0	0	112.9	I506 N530 K531 N536	I506-H533 HydrophobicContact CD1-CB 3.91Å; N530-H533 WeakPolarHBondContact O-CB 3.28Å; N530-H533 PolarHBondContact O-N 3.02Å; K531-H533 PolarHBondContact O-N 2.9Å; H533-N536 PolarHBondContact O-N 2.94Å
534	L	93.2	Very high	90.8	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-66.7	-37.8	174.5	-60.7	174.3	0	0	0	111.7	I506 V509 T523 M525 K531 A532 N536 I537 W540 A548	I506-L534 HydrophobicContact CB-CD2 4.45Å; I506-L534 HydrophobicContact CG1-CD2 3.85Å; I506-L534 HydrophobicContact CG1-CG 4.35Å; V509-L534 HydrophobicContact CB-CD2 4.17Å; V509-L534 HydrophobicContact CG1-CD2 4.11Å; V509-L534 HydrophobicContact CG2-CD2 3.97Å; T523-L534 HydrophobicContact CG2-CD1 3.69Å; M525-L534 HydrophobicContact CG-CD1 4.05Å; M525-L534 HydrophobicContact SD-CD1 3.91Å; K531-L534 WeakPolarHBondContact O-CB 3.42Å; K531-L534 PolarHBondContact O-N 2.93Å; A532-L534 VanDerWaalsContact C-N 3.26Å; A532-L534 PolarHBondContact O-N 3.12Å; L534-N536 PolarHBondContact O-N 2.84Å; L534-I537 HydrophobicContact CD2-CD1 4.03Å; L534-I537 WeakPolarHBondContact O-CB 3.34Å; L534-I537 PolarHBondContact O-N 3.29Å; L534-I537 VanDerWaalsContact O-N 3.08Å; L534-W540 HydrophobicContact CB-CD2 4.17Å; L534-W540 HydrophobicContact CB-CE3 4.42Å; L534-W540 HydrophobicContact CD1-CH2 4.19Å; L534-W540 HydrophobicContact CD1-CZ2 4.33Å; L534-W540 VanDerWaalsContact O-CB 3.31Å; L534-W540 WeakPolarHBondContact O-CB 3.4Å; L534-A548 HydrophobicContact CD1-CB 3.6Å
535	L	87.9	Confident	90.3	Very high	72 Å²	72	51.1 Å²	51.1	38%	0.377	26%	0.258	S	S	.	.	H	α-helix	trans	-65.9	-19.7	177.1	-59.3	178.9	0	0	0	113.1	A532 E1077	A532-L535 WeakPolarHBondContact O-CB 3.41Å; A532-L535 PolarHBondContact O-N 2.97Å; L535-E1077 HydrophobicContact CD1-CB 4.23Å
536	N	89.8	Confident	90.3	Very high	113 Å²	113	51.3 Å²	51.3	60%	0.604	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-8.2	176	-63.7	-22.9	0	0	0	113.1	H533 L534	H533-N536 PolarHBondContact O-N 2.94Å; L534-N536 PolarHBondContact O-N 2.84Å
537	I	93.5	Very high	90.3	Very high	20 Å²	20	51.4 Å²	51.4	10%	0.103	26%	0.26	C	S	.	.	S	Bend	trans	-78.6	120.4	176.5	-59.4	172.7	0	0	0	108.4	V509 I510 L534 S539 W540	V509-I537 HydrophobicContact CB-CD1 4.46Å; V509-I537 HydrophobicContact CG1-CD1 3.83Å; I510-I537 HydrophobicContact CD1-CD1 4.43Å; I510-I537 HydrophobicContact CG1-CD1 3.65Å; I510-I537 HydrophobicContact CG1-CG1 4.14Å; L534-I537 HydrophobicContact CD2-CD1 4.03Å; L534-I537 WeakPolarHBondContact O-CB 3.34Å; L534-I537 PolarHBondContact O-N 3.29Å; L534-I537 VanDerWaalsContact O-N 3.08Å; I537-S539 PolarHBondContact O-N 2.88Å; I537-W540 HydrophobicContact CB-CB 4.03Å; I537-W540 HydrophobicContact CG2-CB 4.43Å; I537-W540 WeakPolarHBondContact O-CB 3.36Å; I537-W540 PolarHBondContact O-N 3.07Å
538	P	92.8	Very high	90.4	Very high	135 Å²	135	51.4 Å²	51.4	88%	0.877	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-10.4	-171.7	28.1	-36.7	0	0	0	114.5
539	S	94.6	Very high	90.6	Very high	42 Å²	42	50.6 Å²	50.6	29%	0.294	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	9.6	175.7	-53.2	0	0	0	0	113.4	K513 I537	K513-S539 WeakPolarHBondContact CD-O 3.44Å; K513-S539 WeakPolarHBondContact CE-O 3.48Å; K513-S539 PolarHBondContact NZ-O 2.86Å; K513-S539 VanDerWaalsContact NZ-O 3.14Å; I537-S539 PolarHBondContact O-N 2.88Å
540	W	93.8	Very high	90.9	Very high	26 Å²	26	47.9 Å²	47.9	10%	0.098	25%	0.246	C	C	.	.			trans	-87.5	116.4	172.4	-176.8	-88.3	0	0	0	110.1	V509 I521 T523 L534 I537 D546 A548	V509-W540 HydrophobicContact CG1-CE3 3.82Å; V509-W540 HydrophobicContact CG1-CZ3 3.84Å; V509-W540 HydrophobicContact CG2-CZ3 4.49Å; I521-W540 HydrophobicContact CB-CZ3 4.22Å; I521-W540 HydrophobicContact CG2-CZ3 4.34Å; T523-W540 HydrophobicContact CG2-CH2 4.13Å; L534-W540 HydrophobicContact CB-CD2 4.17Å; L534-W540 HydrophobicContact CB-CE3 4.42Å; L534-W540 HydrophobicContact CD1-CH2 4.19Å; L534-W540 HydrophobicContact CD1-CZ2 4.33Å; L534-W540 VanDerWaalsContact O-CB 3.31Å; L534-W540 WeakPolarHBondContact O-CB 3.4Å; I537-W540 HydrophobicContact CB-CB 4.03Å; I537-W540 HydrophobicContact CG2-CB 4.43Å; I537-W540 WeakPolarHBondContact O-CB 3.36Å; I537-W540 PolarHBondContact O-N 3.07Å; W540-D546 HydrophobicContact CD2-CB 3.78Å; W540-D546 HydrophobicContact CE3-CB 4Å; W540-D546 HydrophobicContact CG-CB 4.33Å; W540-D546 HydrophobicContact CH2-CB 4Å; W540-D546 VanDerWaalsContact CZ2-C 3.46Å; W540-D546 HydrophobicContact CZ2-CB 3.79Å; W540-D546 WeakPolarHBondContact CZ2-O 3.44Å; W540-D546 HydrophobicContact CZ3-CB 4.11Å; W540-A548 HydrophobicContact CH2-CB 4.34Å; W540-A548 HydrophobicContact CZ2-CB 3.98Å
541	N	89.8	Confident	91	Very high	49 Å²	49	47.6 Å²	47.6	26%	0.262	25%	0.245	S	C	.	.			trans	-131.6	91.1	-173.5	-172.5	10.4	0	0	0	112.1	K543 E544 D546	N541-K543 PolarHBondContact O-N 2.58Å; N541-K543 WeakPolarHBondContact OD1-CB 3.47Å; N541-K543 PolarHBondContact OD1-N 2.79Å; N541-K543 VanDerWaalsContact OD1-N 3.13Å; N541-E544 HydrophobicContact CB-CB 4.43Å; N541-E544 VanDerWaalsContact ND2-CG 3.35Å; N541-E544 WeakPolarHBondContact ND2-CG 3.42Å; N541-E544 PolarHBondContact ND2-OE2 2.89Å; N541-E544 PolarHBondContact O-N 3.48Å; N541-D546 PolarHBondContact N-OD2 2.94Å; N541-D546 PolarHBondContact O-N 2.87Å
542	W	84.3	Confident	91.1	Very high	131 Å²	131	47.4 Å²	47.4	50%	0.496	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-9.4	173	63	-94.9	0	0	0	114.9
543	K	82.4	Confident	91.4	Very high	111 Å²	111	46.7 Å²	46.7	48%	0.483	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-15.2	173.9	-55.6	-177.4	-177.2	-178.7	0	114	N541 S644	N541-K543 PolarHBondContact O-N 2.58Å; N541-K543 WeakPolarHBondContact OD1-CB 3.47Å; N541-K543 PolarHBondContact OD1-N 2.79Å; N541-K543 VanDerWaalsContact OD1-N 3.13Å; K543-S644 PolarHBondContact NZ-OG 3.26Å
544	E	85.3	Confident	91.5	Very high	127 Å²	127	42.1 Å²	42.1	59%	0.593	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.4	10.7	173.1	-74.1	174	146.8	0	0	111.5	N541	N541-E544 HydrophobicContact CB-CB 4.43Å; N541-E544 VanDerWaalsContact ND2-CG 3.35Å; N541-E544 WeakPolarHBondContact ND2-CG 3.42Å; N541-E544 PolarHBondContact ND2-OE2 2.89Å; N541-E544 PolarHBondContact O-N 3.48Å
545	G	87	Confident	91.6	Very high	3 Å²	3	43 Å²	43	3%	0.031	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.9	14.7	174.6	0	0	0	0	0	115.2	R520 D547	R520-G545 WeakPolarHBondContact CG-O 3.2Å; R520-G545 PolarHBondContact NE-O 2.99Å; G545-D547 PolarHBondContact O-N 3.39Å; G545-D547 VanDerWaalsContact O-N 3.12Å; G545-D547 VanDerWaalsContact O-OD2 3.08Å
546	D	94.4	Very high	92	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.021	20%	0.203	C	C	.	.			trans	-68.6	108.9	170.4	-69.8	-37.8	0	0	0	110	K513 I521 W540 N541	K513-D546 WeakPolarHBondContact CE-OD1 3.45Å; K513-D546 VanDerWaalsContact CE-OD2 3.3Å; K513-D546 WeakPolarHBondContact CE-OD2 3.29Å; K513-D546 IonicContact NZ-OD1 3.21Å; K513-D546 PolarHBondContact NZ-OD1 3.39Å; K513-D546 IonicContact NZ-OD2 2.71Å; K513-D546 PolarHBondContact NZ-OD2 3.19Å; I521-D546 PolarHBondContact N-OD1 3.36Å; I521-D546 CarbonylContact O-C 3.52Å; I521-D546 WeakPolarHBondContact O-CA 3.48Å; W540-D546 HydrophobicContact CD2-CB 3.78Å; W540-D546 HydrophobicContact CE3-CB 4Å; W540-D546 HydrophobicContact CG-CB 4.33Å; W540-D546 HydrophobicContact CH2-CB 4Å; W540-D546 VanDerWaalsContact CZ2-C 3.46Å; W540-D546 HydrophobicContact CZ2-CB 3.79Å; W540-D546 WeakPolarHBondContact CZ2-O 3.44Å; W540-D546 HydrophobicContact CZ3-CB 4.11Å; N541-D546 PolarHBondContact N-OD2 2.94Å; N541-D546 PolarHBondContact O-N 2.87Å
547	D	93.9	Very high	92.2	Very high	15 Å²	15	34.1 Å²	34.1	8%	0.08	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	130.3	-167.8	-77.5	-56	0	0	0	111.4	R520 I521 I522 T523 G545 T1054 L1061	R520-D547 IonicContact CZ-OD2 3.25Å; R520-D547 IonicContact NE-OD2 3.27Å; R520-D547 IonicContact NH2-OD2 2.77Å; R520-D547 PolarHBondContact NH2-OD2 2.85Å; I521-D547 PolarHBondContact O-N 2.86Å; I522-D547 WeakPolarHBondContact CA-O 3.42Å; I522-D547 HydrophobicContact CG1-CB 4.39Å; I522-D547 HydrophobicContact CG2-CB 4.3Å; T523-D547 PolarHBondContact N-O 3.31Å; G545-D547 PolarHBondContact O-N 3.39Å; G545-D547 VanDerWaalsContact O-N 3.12Å; G545-D547 VanDerWaalsContact O-OD2 3.08Å; D547-T1054 HydrophobicContact CB-CG2 3.75Å; D547-T1054 VanDerWaalsContact OD2-CG2 3.32Å; D547-T1054 WeakPolarHBondContact OD2-CG2 3.19Å; D547-L1061 HydrophobicContact CB-CD2 3.87Å
548	A	94.4	Very high	92.3	Very high	12 Å²	12	33.2 Å²	33.2	10%	0.099	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	104.9	177.1	0	0	0	0	0	110.2	T523 M525 K531 L534 W540 C550	T523-A548 HydrophobicContact CG2-CB 4.24Å; M525-A548 HydrophobicContact CG-CB 4.44Å; K531-A548 VanDerWaalsContact CE-O 3.31Å; K531-A548 WeakPolarHBondContact CE-O 3.44Å; K531-A548 HydrophobicContact CG-CB 3.92Å; L534-A548 HydrophobicContact CD1-CB 3.6Å; W540-A548 HydrophobicContact CH2-CB 4.34Å; W540-A548 HydrophobicContact CZ2-CB 3.98Å; A548-C550 PolarHBondContact O-N 3.17Å
549	I	95.3	Very high	92.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	95.6	-179	-62.5	179.5	0	0	0	108.2	I522 T523 Q524 M525 L551 L554 L1050 M1051 T1054 L1061	I522-I549 HydrophobicContact CG2-CD1 4.03Å; T523-I549 PolarHBondContact O-N 3.44Å; Q524-I549 WeakPolarHBondContact CA-O 3.3Å; M525-I549 PolarHBondContact N-O 3.11Å; I549-L551 HydrophobicContact CG2-CD2 4.25Å; I549-L551 PolarHBondContact O-N 2.93Å; I549-L554 HydrophobicContact CG2-CD1 3.77Å; I549-L1050 HydrophobicContact CD1-CG 4.2Å; I549-L1050 HydrophobicContact CG2-CD2 4.14Å; I549-M1051 HydrophobicContact CD1-CG 4.48Å; I549-M1051 HydrophobicContact CD1-SD 3.78Å; I549-T1054 HydrophobicContact CD1-CG2 4.45Å; I549-L1061 HydrophobicContact CG1-CD1 4.04Å; I549-L1061 HydrophobicContact CG1-CD2 3.72Å
550	C	94.8	Very high	92.6	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.007	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	115.5	175.8	-179.8	0	0	0	0	110.6	M525 Q527 K531 A548 E553 L554	M525-C550 HydrophobicContact CB-CB 4.49Å; M525-C550 CarbonylContact O-C 3.55Å; M525-C550 VanDerWaalsContact O-CA 3.29Å; M525-C550 WeakPolarHBondContact O-CA 3.29Å; Q527-C550 PolarHBondContact O-SG 3.35Å; Q527-C550 VanDerWaalsContact O-SG 3.41Å; K531-C550 HydrophobicContact CD-CB 4.2Å; A548-C550 PolarHBondContact O-N 3.17Å; C550-E553 HydrophobicContact CB-CB 3.65Å; C550-E553 PolarHBondContact O-N 2.93Å; C550-E553 PolarHBondContact SG-N 2.77Å; C550-L554 WeakPolarHBondContact O-CG 3.44Å; C550-L554 PolarHBondContact O-N 2.91Å; C550-L554 VanDerWaalsContact O-N 3.14Å
551	L	93.8	Very high	92.7	Very high	7 Å²	7	24 Å²	24	4%	0.037	11%	0.112	C	C	.	.	H	α-helix	trans	-68	-43.4	-177.5	-59.9	-173.7	0	0	0	111.5	K493 M525 L526 I549 E553 L554 K555 V1044 L1047	K493-L551 HydrophobicContact CD-CD1 3.93Å; K493-L551 HydrophobicContact CG-CD1 3.78Å; M525-L551 PolarHBondContact O-N 3.11Å; L526-L551 HydrophobicContact CD2-CD1 3.98Å; I549-L551 HydrophobicContact CG2-CD2 4.25Å; I549-L551 PolarHBondContact O-N 2.93Å; L551-E553 PolarHBondContact O-N 2.7Å; L551-L554 PolarHBondContact O-N 2.75Å; L551-K555 WeakPolarHBondContact O-CB 3.37Å; L551-K555 PolarHBondContact O-N 3.35Å; L551-V1044 HydrophobicContact CD1-CG2 4.45Å; L551-L1047 HydrophobicContact CD2-CB 3.88Å; L551-L1047 HydrophobicContact CD2-CD1 3.99Å
552	A	92.8	Very high	93	Very high	9 Å²	9	21.8 Å²	21.8	7%	0.074	10%	0.1	C	C	.	.	H	α-helix	trans	-64	-36.4	175.5	0	0	0	0	0	113.2	L526 L556	L526-A552 WeakPolarHBondContact O-CB 3.15Å; L526-A552 PolarHBondContact O-N 2.85Å; A552-L556 WeakPolarHBondContact O-CB 3.44Å; A552-L556 WeakPolarHBondContact O-CG 3.31Å; A552-L556 PolarHBondContact O-N 2.72Å
553	E	94.1	Very high	93.5	Very high	5 Å²	5	15.6 Å²	15.6	2%	0.023	8%	0.077	C	C	.	.	H	α-helix	trans	-61.6	-47.7	175.4	-174.5	-172.2	162	0	0	111.2	Y528 K531 C550 L551 G557 R1065 T1069	Y528-E553 HydrophobicContact CD2-CB 4.02Å; Y528-E553 HydrophobicContact CD2-CG 4.03Å; Y528-E553 HydrophobicContact CE2-CG 4.21Å; Y528-E553 WeakPolarHBondContact CE2-OE2 3.27Å; K531-E553 IonicContact NZ-OE1 3.86Å; K531-E553 IonicContact NZ-OE2 3.76Å; K531-E553 PolarHBondContact NZ-OE2 3.37Å; C550-E553 HydrophobicContact CB-CB 3.65Å; C550-E553 PolarHBondContact O-N 2.93Å; C550-E553 PolarHBondContact SG-N 2.77Å; L551-E553 PolarHBondContact O-N 2.7Å; E553-G557 PolarHBondContact O-N 3.18Å; E553-R1065 IonicContact OE1-CZ 2.81Å; E553-R1065 IonicContact OE1-NE 2.77Å; E553-R1065 PolarHBondContact OE1-NE 3.15Å; E553-R1065 IonicContact OE1-NH2 3.84Å; E553-R1065 PolarHBondContact OE1-NH2 3.22Å; E553-R1065 IonicContact OE2-CZ 3.67Å; E553-R1065 IonicContact OE2-NE 2.68Å; E553-R1065 IonicContact OE2-NH2 2.59Å; E553-T1069 HydrophobicContact CG-CG2 4.06Å; E553-T1069 WeakPolarHBondContact OE1-CG2 3.33Å
554	L	94.4	Very high	94.1	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-77.3	-49.3	-175.8	-69	171.8	0	0	0	112.4	I549 C550 L551 L556 G557 F558 L1047 L1050 L1061 I1064 R1065	I549-L554 HydrophobicContact CG2-CD1 3.77Å; C550-L554 WeakPolarHBondContact O-CG 3.44Å; C550-L554 PolarHBondContact O-N 2.91Å; C550-L554 VanDerWaalsContact O-N 3.14Å; L551-L554 PolarHBondContact O-N 2.75Å; L554-L556 PolarHBondContact O-N 2.9Å; L554-G557 CarbonylContact O-C 3.56Å; L554-G557 WeakPolarHBondContact O-CA 3.49Å; L554-G557 PolarHBondContact O-N 3.11Å; L554-G557 VanDerWaalsContact O-N 3.14Å; L554-F558 HydrophobicContact CB-CD2 4.36Å; L554-F558 HydrophobicContact CB-CE2 4.05Å; L554-F558 HydrophobicContact CD2-CE2 4.49Å; L554-F558 WeakPolarHBondContact O-CD2 3.19Å; L554-F558 PolarHBondContact O-N 3Å; L554-L1047 HydrophobicContact CB-CD1 4.28Å; L554-L1047 HydrophobicContact CB-CD2 4.4Å; L554-L1050 HydrophobicContact CD1-CD2 3.43Å; L554-L1050 VanDerWaalsContact CD1-CD2 3.43Å; L554-L1061 HydrophobicContact CD1-CD1 4.26Å; L554-I1064 HydrophobicContact CD2-CG2 4.09Å; L554-R1065 HydrophobicContact CD2-CG 4.15Å
555	K	94.3	Very high	94.5	Very high	19 Å²	19	5.7 Å²	5.7	8%	0.083	3%	0.033	C	C	.	.	H	α-helix	trans	-51.4	-58.3	178.6	177.5	-178	73.4	156.3	0	111.4	L551 G557 F558 I559 E1008 F1042 L1047	L551-K555 WeakPolarHBondContact O-CB 3.37Å; L551-K555 PolarHBondContact O-N 3.35Å; K555-G557 VanDerWaalsContact C-N 3.27Å; K555-G557 PolarHBondContact O-N 2.61Å; K555-F558 PolarHBondContact O-N 3.11Å; K555-I559 HydrophobicContact CG-CD1 4.29Å; K555-I559 WeakPolarHBondContact O-CG1 3.44Å; K555-I559 PolarHBondContact O-N 3.4Å; K555-I559 VanDerWaalsContact O-N 3.17Å; K555-E1008 VanDerWaalsContact CD-CD 3.49Å; K555-E1008 HydrophobicContact CD-CG 4.24Å; K555-E1008 WeakPolarHBondContact CD-OE1 3.35Å; K555-E1008 WeakPolarHBondContact CE-OE2 3.37Å; K555-E1008 IonicContact NZ-OE1 3.6Å; K555-E1008 PolarHBondContact NZ-OE1 3.07Å; K555-E1008 IonicContact NZ-OE2 2.89Å; K555-E1008 PolarHBondContact NZ-OE2 2.69Å; K555-F1042 HydrophobicContact CB-CE1 4.26Å; K555-F1042 HydrophobicContact CG-CD1 4.19Å; K555-F1042 HydrophobicContact CG-CE1 3.96Å; K555-L1047 HydrophobicContact CB-CD1 4.25Å
556	L	95.8	Very high	94.9	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-68.2	-29.5	-179	-63.9	176.9	0	0	0	112	A552 L554 A560 I859 G860 N863 L864 L930	A552-L556 WeakPolarHBondContact O-CB 3.44Å; A552-L556 WeakPolarHBondContact O-CG 3.31Å; A552-L556 PolarHBondContact O-N 2.72Å; L554-L556 PolarHBondContact O-N 2.9Å; L556-A560 WeakPolarHBondContact O-CB 3.32Å; L556-A560 PolarHBondContact O-N 3.04Å; L556-I859 HydrophobicContact CD1-CG2 3.93Å; L556-I859 HydrophobicContact CD2-CG2 3.96Å; L556-I859 HydrophobicContact CG-CG2 4.38Å; L556-G860 VanDerWaalsContact CD1-O 3.27Å; L556-G860 WeakPolarHBondContact CD1-O 3.23Å; L556-N863 HydrophobicContact CB-CB 3.93Å; L556-N863 HydrophobicContact CD1-CB 3.82Å; L556-L864 HydrophobicContact CB-CB 4.13Å; L556-L864 HydrophobicContact CD2-CB 4.42Å; L556-L864 WeakPolarHBondContact O-CD1 3.3Å; L556-L930 HydrophobicContact CD2-CD1 3.92Å; L556-L930 HydrophobicContact CD2-CD2 4.25Å
557	G	95.8	Very high	94.9	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-66.1	-45.3	172.7	0	0	0	0	0	113.6	E553 L554 K555 I559 A560 Q561 V1068	E553-G557 PolarHBondContact O-N 3.18Å; L554-G557 CarbonylContact O-C 3.56Å; L554-G557 WeakPolarHBondContact O-CA 3.49Å; L554-G557 PolarHBondContact O-N 3.11Å; L554-G557 VanDerWaalsContact O-N 3.14Å; K555-G557 VanDerWaalsContact C-N 3.27Å; K555-G557 PolarHBondContact O-N 2.61Å; G557-I559 VanDerWaalsContact C-N 3.31Å; G557-I559 PolarHBondContact O-N 3.13Å; G557-A560 WeakPolarHBondContact O-CB 3.39Å; G557-A560 PolarHBondContact O-N 3.44Å; G557-Q561 WeakPolarHBondContact O-CG 3.42Å; G557-Q561 PolarHBondContact O-N 2.99Å; G557-V1068 VanDerWaalsContact CA-CG1 3.49Å
558	F	95.8	Very high	95	Very high	1 Å²	1	6.6 Å²	6.6	0%	0.004	4%	0.036	C	C	.	.	H	α-helix	trans	-63	-40.1	177	-74.7	-60.9	0	0	0	111.4	L554 K555 S562 L572 F576 F1042 L1047 I1064 V1068	L554-F558 HydrophobicContact CB-CD2 4.36Å; L554-F558 HydrophobicContact CB-CE2 4.05Å; L554-F558 HydrophobicContact CD2-CE2 4.49Å; L554-F558 WeakPolarHBondContact O-CD2 3.19Å; L554-F558 PolarHBondContact O-N 3Å; K555-F558 PolarHBondContact O-N 3.11Å; F558-S562 WeakPolarHBondContact O-CB 3.46Å; F558-S562 PolarHBondContact O-N 3.19Å; F558-S562 PolarHBondContact O-OG 3.08Å; F558-L572 HydrophobicContact CD1-CB 4.06Å; F558-L572 HydrophobicContact CD1-CD1 3.98Å; F558-L572 HydrophobicContact CE1-CB 3.55Å; F558-L572 HydrophobicContact CE1-CD1 3.78Å; F558-L572 HydrophobicContact CE1-CG 4.32Å; F558-F576 HydrophobicContact CE1-CE1 4.4Å; F558-F576 HydrophobicContact CE2-CE1 4.43Å; F558-F576 HydrophobicContact CE2-CZ 4.33Å; F558-F576 AromaticContact CZ-CE1 3.74Å; F558-F576 HydrophobicContact CZ-CE1 3.74Å; F558-F576 HydrophobicContact CZ-CZ 4.09Å; F558-F1042 HydrophobicContact CB-CE2 4.01Å; F558-F1042 HydrophobicContact CB-CZ 4.05Å; F558-F1042 HydrophobicContact CD2-CE2 4.25Å; F558-F1042 AromaticContact CD2-CZ 3.79Å; F558-F1042 HydrophobicContact CD2-CZ 3.79Å; F558-F1042 HydrophobicContact CG-CE2 4.28Å; F558-F1042 HydrophobicContact CG-CZ 4.21Å; F558-L1047 HydrophobicContact CD2-CD2 4.09Å; F558-L1047 HydrophobicContact CE2-CD2 3.64Å; F558-I1064 HydrophobicContact CE1-CG2 4.22Å; F558-I1064 HydrophobicContact CZ-CG2 3.71Å; F558-V1068 HydrophobicContact CD1-CG1 4.29Å; F558-V1068 HydrophobicContact CD1-CG2 3.87Å; F558-V1068 HydrophobicContact CE1-CG2 3.55Å; F558-V1068 HydrophobicContact CG-CG1 4.43Å; F558-V1068 HydrophobicContact CZ-CG2 4.2Å
559	I	96.7	Very high	95	Very high	1 Å²	1	6 Å²	6	1%	0.005	3%	0.031	C	C	.	.	H	α-helix	trans	-64.2	-45.9	172.5	-65.6	171.3	0	0	0	110.5	K555 G557 Q561 S562 C563 L864 V928 L930 I1006 F1042	K555-I559 HydrophobicContact CG-CD1 4.29Å; K555-I559 WeakPolarHBondContact O-CG1 3.44Å; K555-I559 PolarHBondContact O-N 3.4Å; K555-I559 VanDerWaalsContact O-N 3.17Å; G557-I559 VanDerWaalsContact C-N 3.31Å; G557-I559 PolarHBondContact O-N 3.13Å; I559-Q561 PolarHBondContact O-N 2.98Å; I559-S562 WeakPolarHBondContact O-CA 3.49Å; I559-S562 WeakPolarHBondContact O-CB 3.35Å; I559-S562 PolarHBondContact O-N 3.11Å; I559-C563 PolarHBondContact O-N 2.85Å; I559-C563 PolarHBondContact O-SG 3.03Å; I559-L864 HydrophobicContact CB-CD1 4.18Å; I559-L864 HydrophobicContact CG2-CD1 3.71Å; I559-V928 HydrophobicContact CG2-CB 4.36Å; I559-V928 HydrophobicContact CG2-CG1 3.47Å; I559-V928 VanDerWaalsContact CG2-CG1 3.47Å; I559-V928 HydrophobicContact CG2-CG2 3.91Å; I559-L930 HydrophobicContact CD1-CD2 4.01Å; I559-I1006 HydrophobicContact CG1-CD1 4.16Å; I559-I1006 HydrophobicContact CG2-CG2 3.98Å; I559-F1042 HydrophobicContact CD1-CD1 4.4Å; I559-F1042 HydrophobicContact CG1-CD1 4.43Å
560	A	96.3	Very high	95	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-59.6	-42.7	177.9	0	0	0	0	0	113.2	L556 G557 S562 C563 L864 P867 L868	L556-A560 WeakPolarHBondContact O-CB 3.32Å; L556-A560 PolarHBondContact O-N 3.04Å; G557-A560 WeakPolarHBondContact O-CB 3.39Å; G557-A560 PolarHBondContact O-N 3.44Å; A560-S562 VanDerWaalsContact C-N 3.31Å; A560-C563 WeakPolarHBondContact O-CB 3.44Å; A560-C563 PolarHBondContact O-N 3.18Å; A560-L864 HydrophobicContact CB-CD1 4.11Å; A560-L864 WeakPolarHBondContact CB-O 3.24Å; A560-P867 HydrophobicContact CB-CB 3.95Å; A560-P867 HydrophobicContact CB-CG 3.94Å; A560-L868 HydrophobicContact CB-CG 4.18Å; A560-L868 WeakPolarHBondContact O-CD2 3.48Å
561	Q	94.6	Very high	95	Very high	9 Å²	9	6 Å²	6	4%	0.042	3%	0.031	C	C	.	.	H	α-helix	trans	-68.7	-31.5	174	-63.6	-61.1	-36.4	0	0	112	G557 I559 C563 L564 A565 L568 V1068	G557-Q561 WeakPolarHBondContact O-CG 3.42Å; G557-Q561 PolarHBondContact O-N 2.99Å; I559-Q561 PolarHBondContact O-N 2.98Å; Q561-C563 VanDerWaalsContact C-N 3.29Å; Q561-C563 PolarHBondContact O-N 3.47Å; Q561-L564 WeakPolarHBondContact O-CA 3.46Å; Q561-L564 WeakPolarHBondContact O-CB 3.3Å; Q561-L564 PolarHBondContact O-N 3.02Å; Q561-A565 PolarHBondContact O-N 2.9Å; Q561-L568 HydrophobicContact CB-CD2 3.58Å; Q561-L568 HydrophobicContact CG-CD2 4.32Å; Q561-V1068 PolarHBondContact NE2-O 3.48Å
562	S	96.4	Very high	95	Very high	1 Å²	1	6 Å²	6	1%	0.007	3%	0.03	C	C	.	.	H	α-helix	trans	-68	-28.6	175	-57.1	0	0	0	0	112.6	F558 I559 A560 L564 A565 Q566 S569	F558-S562 WeakPolarHBondContact O-CB 3.46Å; F558-S562 PolarHBondContact O-N 3.19Å; F558-S562 PolarHBondContact O-OG 3.08Å; I559-S562 WeakPolarHBondContact O-CA 3.49Å; I559-S562 WeakPolarHBondContact O-CB 3.35Å; I559-S562 PolarHBondContact O-N 3.11Å; A560-S562 VanDerWaalsContact C-N 3.31Å; S562-L564 PolarHBondContact O-N 3.38Å; S562-A565 WeakPolarHBondContact CA-O 3.31Å; S562-A565 CarbonylContact O-C 3.53Å; S562-A565 VanDerWaalsContact O-C 3.27Å; S562-A565 PolarHBondContact O-N 3.38Å; S562-Q566 WeakPolarHBondContact O-CA 3.45Å; S562-Q566 PolarHBondContact O-N 3.04Å; S562-S569 VanDerWaalsContact OG-CB 3.23Å; S562-S569 WeakPolarHBondContact OG-CB 3.44Å; S562-S569 PolarHBondContact OG-N 3.14Å; S562-S569 PolarHBondContact OG-OG 3.03Å
563	C	96.1	Very high	95	Very high	2 Å²	2	5.6 Å²	5.6	1%	0.014	3%	0.027	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-13.3	167.6	-58.8	0	0	0	0	113.9	I559 A560 Q561 V846 L868 K879 M926 V928	I559-C563 PolarHBondContact O-N 2.85Å; I559-C563 PolarHBondContact O-SG 3.03Å; A560-C563 WeakPolarHBondContact O-CB 3.44Å; A560-C563 PolarHBondContact O-N 3.18Å; Q561-C563 VanDerWaalsContact C-N 3.29Å; Q561-C563 PolarHBondContact O-N 3.47Å; C563-V846 HydrophobicContact CB-CG2 4.08Å; C563-L868 HydrophobicContact CB-CD1 4.45Å; C563-L868 HydrophobicContact CB-CD2 4.1Å; C563-K879 WeakPolarHBondContact O-CE 3.31Å; C563-K879 PolarHBondContact O-NZ 3.16Å; C563-M926 HydrophobicContact CB-CB 4.09Å; C563-M926 HydrophobicContact CB-CG 4.34Å; C563-M926 VanDerWaalsContact SG-CG 3.59Å; C563-V928 WeakPolarHBondContact SG-CG2 3.24Å
564	L	93.7	Very high	94.9	Very high	29 Å²	29	5.4 Å²	5.4	15%	0.152	3%	0.026	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-38.9	173.8	-59.6	171.8	0	0	0	111.6	Q561 S562 L868 F873	Q561-L564 WeakPolarHBondContact O-CA 3.46Å; Q561-L564 WeakPolarHBondContact O-CB 3.3Å; Q561-L564 PolarHBondContact O-N 3.02Å; S562-L564 PolarHBondContact O-N 3.38Å; L564-L868 HydrophobicContact CD1-CD2 4.31Å; L564-L868 HydrophobicContact CD2-CD2 3.73Å; L564-L868 HydrophobicContact CG-CD2 3.81Å; L564-F873 HydrophobicContact CD1-CE2 3.95Å; L564-F873 HydrophobicContact CD1-CZ 3.82Å; L564-F873 HydrophobicContact CD2-CE1 4.41Å; L564-F873 HydrophobicContact CD2-CE2 4.36Å; L564-F873 HydrophobicContact CD2-CZ 3.89Å; L564-F873 HydrophobicContact CG-CZ 4.43Å
565	A	95.1	Very high	94.8	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.027	C	C	.	.	S	Bend	trans	-144.8	104.6	177	0	0	0	0	0	110	Q561 S562 L568 V1104 Q1106 F1177	Q561-A565 PolarHBondContact O-N 2.9Å; S562-A565 WeakPolarHBondContact CA-O 3.31Å; S562-A565 CarbonylContact O-C 3.53Å; S562-A565 VanDerWaalsContact O-C 3.27Å; S562-A565 PolarHBondContact O-N 3.38Å; A565-L568 WeakPolarHBondContact O-CB 3.42Å; A565-L568 PolarHBondContact O-N 2.72Å; A565-V1104 HydrophobicContact CB-CG1 3.94Å; A565-Q1106 HydrophobicContact CB-CG 3.86Å; A565-F1177 HydrophobicContact CB-CD1 4.13Å; A565-F1177 HydrophobicContact CB-CE1 4.1Å
566	Q	95.4	Very high	94.3	Very high	41 Å²	41	5 Å²	5	19%	0.192	3%	0.025	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	138.2	-173.2	-171.8	-177.4	24.1	0	0	111.3	S562 M926 Q1106 Y1142 F1177	S562-Q566 WeakPolarHBondContact O-CA 3.45Å; S562-Q566 PolarHBondContact O-N 3.04Å; Q566-M926 HydrophobicContact CB-CE 3.93Å; Q566-M926 HydrophobicContact CG-CE 3.75Å; Q566-Q1106 PolarHBondContact O-NE2 3.38Å; Q566-Y1142 HydrophobicContact CB-CE1 3.97Å; Q566-Y1142 HydrophobicContact CG-CE1 4.24Å; Q566-Y1142 VanDerWaalsContact CG-OH 3.29Å; Q566-Y1142 WeakPolarHBondContact CG-OH 3.4Å; Q566-Y1142 PolarHBondContact OE1-OH 3.18Å; Q566-F1177 WeakPolarHBondContact O-CE1 3.36Å; Q566-F1177 WeakPolarHBondContact O-CZ 3.19Å
567	G	94.3	Very high	93.8	Very high	0 Å²	0	5.3 Å²	5.3	0%	0	3%	0.027	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	-5.2	-175.9	0	0	0	0	0	115.1	S569 T570 M571 V1160	G567-S569 VanDerWaalsContact C-N 3.29Å; G567-S569 PolarHBondContact O-N 2.97Å; G567-T570 PolarHBondContact O-N 2.73Å; G567-M571 PolarHBondContact O-N 2.96Å; G567-V1160 WeakPolarHBondContact O-CG2 3.42Å
568	L	95.3	Very high	93	Very high	1 Å²	1	6.2 Å²	6.2	1%	0.005	3%	0.031	C	C	.	.	H	α-helix	trans	-65.9	-30.5	179	-161.1	80.7	0	0	0	113	Q561 A565 M571 L572 V1104 F1139 F1177	Q561-L568 HydrophobicContact CB-CD2 3.58Å; Q561-L568 HydrophobicContact CG-CD2 4.32Å; A565-L568 WeakPolarHBondContact O-CB 3.42Å; A565-L568 PolarHBondContact O-N 2.72Å; L568-M571 HydrophobicContact CD1-CG 4.47Å; L568-M571 HydrophobicContact CD1-SD 3.98Å; L568-M571 PolarHBondContact O-N 3.24Å; L568-L572 HydrophobicContact CD2-CD1 3.9Å; L568-L572 HydrophobicContact CG-CD1 3.97Å; L568-L572 HydrophobicContact CG-CG 4.16Å; L568-L572 WeakPolarHBondContact O-CG 3.13Å; L568-L572 PolarHBondContact O-N 3.44Å; L568-V1104 HydrophobicContact CD1-CG1 3.9Å; L568-V1104 HydrophobicContact CD2-CB 4.33Å; L568-V1104 HydrophobicContact CD2-CG1 3.85Å; L568-V1104 HydrophobicContact CD2-CG2 4.08Å; L568-V1104 HydrophobicContact CG-CG1 4.47Å; L568-F1139 HydrophobicContact CD1-CE2 3.7Å; L568-F1139 HydrophobicContact CD1-CZ 3.76Å; L568-F1177 HydrophobicContact CB-CE1 4.24Å; L568-F1177 HydrophobicContact CD1-CD1 3.84Å; L568-F1177 HydrophobicContact CD1-CE1 4.07Å
569	S	95.2	Very high	92.3	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-54.6	-56.3	172.6	48.8	0	0	0	0	111.7	S562 G567 L572 A573	S562-S569 VanDerWaalsContact OG-CB 3.23Å; S562-S569 WeakPolarHBondContact OG-CB 3.44Å; S562-S569 PolarHBondContact OG-N 3.14Å; S562-S569 PolarHBondContact OG-OG 3.03Å; G567-S569 VanDerWaalsContact C-N 3.29Å; G567-S569 PolarHBondContact O-N 2.97Å; S569-L572 PolarHBondContact O-N 2.89Å; S569-A573 VanDerWaalsContact O-CB 3.3Å; S569-A573 WeakPolarHBondContact O-CB 3.45Å; S569-A573 PolarHBondContact O-N 2.96Å
570	T	95.1	Very high	91.1	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-57.5	-47.9	175.6	-54.1	0	0	0	0	111.8	G567 L572 A573 N574 Y593 F1036 G1039 V1160	G567-T570 PolarHBondContact O-N 2.73Å; T570-L572 PolarHBondContact O-N 2.94Å; T570-A573 PolarHBondContact O-N 2.87Å; T570-N574 PolarHBondContact O-N 2.83Å; T570-N574 PolarHBondContact O-OD1 2.61Å; T570-Y593 HydrophobicContact CG2-CE2 4.11Å; T570-F1036 WeakPolarHBondContact CB-O 3.47Å; T570-F1036 HydrophobicContact CG2-CD1 3.87Å; T570-F1036 HydrophobicContact CG2-CE1 3.72Å; T570-F1036 HydrophobicContact CG2-CZ 4.43Å; T570-F1036 WeakPolarHBondContact CG2-O 3.35Å; T570-F1036 PolarHBondContact OG1-O 3.45Å; T570-G1039 WeakPolarHBondContact OG1-CA 3.45Å; T570-V1160 HydrophobicContact CG2-CB 4.42Å; T570-V1160 HydrophobicContact CG2-CG2 4.29Å
571	M	95.1	Very high	90.3	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-52.8	-52.7	176.8	169.8	159.4	-73.8	0	0	111.4	G567 L568 L575 F1139 V1160 T1162 F1177	G567-M571 PolarHBondContact O-N 2.96Å; L568-M571 HydrophobicContact CD1-CG 4.47Å; L568-M571 HydrophobicContact CD1-SD 3.98Å; L568-M571 PolarHBondContact O-N 3.24Å; M571-L575 WeakPolarHBondContact O-CG 3.17Å; M571-F1139 HydrophobicContact CE-CD2 4.5Å; M571-F1139 HydrophobicContact SD-CD2 3.44Å; M571-F1139 WeakPolarHBondContact SD-CD2 3.36Å; M571-F1139 HydrophobicContact SD-CE2 3.28Å; M571-F1139 WeakPolarHBondContact SD-CE2 3.49Å; M571-F1139 HydrophobicContact SD-CZ 4.42Å; M571-V1160 HydrophobicContact CB-CG1 3.79Å; M571-V1160 HydrophobicContact CE-CG1 3.79Å; M571-T1162 HydrophobicContact CB-CG2 4.44Å; M571-T1162 HydrophobicContact CE-CG2 3.7Å; M571-T1162 HydrophobicContact CG-CG2 3.6Å; M571-T1162 HydrophobicContact SD-CG2 4.2Å; M571-F1177 HydrophobicContact CE-CB 4.49Å; M571-F1177 HydrophobicContact CE-CD2 3.49Å; M571-F1177 VanDerWaalsContact CE-CD2 3.49Å; M571-F1177 HydrophobicContact CE-CE2 3.76Å; M571-F1177 HydrophobicContact CE-CG 4.08Å; M571-F1177 HydrophobicContact SD-CB 4.4Å; M571-F1177 HydrophobicContact SD-CD2 4.13Å; M571-F1177 HydrophobicContact SD-CE2 4.47Å; M571-F1177 HydrophobicContact SD-CG 4.14Å
572	L	93	Very high	89.8	Confident	6 Å²	6	17.3 Å²	17.3	3%	0.031	9%	0.086	C	C	.	.	H	α-helix	trans	-73.9	-35.9	-175.9	-64.1	175.8	0	0	0	112.2	F558 L568 S569 T570 N574 L575 F576 L1067 V1068	F558-L572 HydrophobicContact CD1-CB 4.06Å; F558-L572 HydrophobicContact CD1-CD1 3.98Å; F558-L572 HydrophobicContact CE1-CB 3.55Å; F558-L572 HydrophobicContact CE1-CD1 3.78Å; F558-L572 HydrophobicContact CE1-CG 4.32Å; L568-L572 HydrophobicContact CD2-CD1 3.9Å; L568-L572 HydrophobicContact CG-CD1 3.97Å; L568-L572 HydrophobicContact CG-CG 4.16Å; L568-L572 WeakPolarHBondContact O-CG 3.13Å; L568-L572 PolarHBondContact O-N 3.44Å; S569-L572 PolarHBondContact O-N 2.89Å; T570-L572 PolarHBondContact O-N 2.94Å; L572-N574 VanDerWaalsContact C-N 3.3Å; L572-N574 PolarHBondContact O-N 3.33Å; L572-L575 HydrophobicContact CD2-CD1 4.1Å; L572-L575 PolarHBondContact O-N 3.3Å; L572-F576 WeakPolarHBondContact O-CD1 3.28Å; L572-F576 WeakPolarHBondContact O-CE1 3.33Å; L572-L1067 HydrophobicContact CD1-CD2 3.96Å; L572-L1067 HydrophobicContact CD2-CD2 3.81Å; L572-V1068 HydrophobicContact CD1-CG2 3.89Å
573	A	92.6	Very high	89.2	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.008	11%	0.114	C	C	.	.	H	α-helix	trans	-59.9	-39.1	175.2	0	0	0	0	0	112.3	S569 T570 L575 F576 S577 F1036 V1046	S569-A573 VanDerWaalsContact O-CB 3.3Å; S569-A573 WeakPolarHBondContact O-CB 3.45Å; S569-A573 PolarHBondContact O-N 2.96Å; T570-A573 PolarHBondContact O-N 2.87Å; A573-L575 VanDerWaalsContact C-N 3.33Å; A573-L575 PolarHBondContact O-N 2.87Å; A573-F576 HydrophobicContact CB-CZ 4.47Å; A573-S577 PolarHBondContact O-N 2.73Å; A573-F1036 HydrophobicContact CB-CZ 4.02Å; A573-V1046 HydrophobicContact CB-CB 4.41Å; A573-V1046 HydrophobicContact CB-CG2 4.14Å
574	N	92.8	Very high	88.8	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-64.4	-36	176.5	-69.1	-0.8	0	0	0	112.3	T570 L572 F576 R579 Y593	T570-N574 PolarHBondContact O-N 2.83Å; T570-N574 PolarHBondContact O-OD1 2.61Å; L572-N574 VanDerWaalsContact C-N 3.3Å; L572-N574 PolarHBondContact O-N 3.33Å; N574-F576 PolarHBondContact O-N 2.73Å; N574-F576 VanDerWaalsContact O-N 3.14Å; N574-R579 PolarHBondContact OD1-NH1 3.33Å; N574-Y593 PolarHBondContact ND2-OH 3.1Å
575	L	90.9	Very high	88.4	Confident	4 Å²	4	31.7 Å²	31.7	2%	0.021	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-5.9	-175.9	-64.7	175.7	0	0	0	115.5	M571 L572 A573 N599 M601 I667 T1162	M571-L575 WeakPolarHBondContact O-CG 3.17Å; L572-L575 HydrophobicContact CD2-CD1 4.1Å; L572-L575 PolarHBondContact O-N 3.3Å; A573-L575 VanDerWaalsContact C-N 3.33Å; A573-L575 PolarHBondContact O-N 2.87Å; L575-N599 HydrophobicContact CD2-CB 4.16Å; L575-N599 VanDerWaalsContact CD2-O 3.32Å; L575-N599 WeakPolarHBondContact CD2-O 3.2Å; L575-M601 HydrophobicContact CB-CB 4.45Å; L575-M601 HydrophobicContact CB-CE 4.25Å; L575-M601 HydrophobicContact CD1-CE 4.29Å; L575-M601 PolarHBondContact O-N 3.4Å; L575-I667 HydrophobicContact CD1-CD1 3.51Å; L575-I667 HydrophobicContact CD1-CG1 4.21Å; L575-I667 HydrophobicContact CD2-CD1 3.82Å; L575-I667 HydrophobicContact CD2-CG1 4.12Å; L575-I667 HydrophobicContact CD2-CG2 3.77Å; L575-I667 HydrophobicContact CG-CD1 4.34Å; L575-T1162 HydrophobicContact CD2-CG2 3.98Å; L575-T1162 HydrophobicContact CG-CG2 4.31Å
576	F	84.4	Confident	88	Confident	9 Å²	9	38.7 Å²	38.7	4%	0.039	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.5	-1.7	179.1	64.4	-105.5	0	0	0	115.9	F558 L572 A573 N574 V1046 L1047 L1050 A1053 I1064	F558-F576 HydrophobicContact CE1-CE1 4.4Å; F558-F576 HydrophobicContact CE2-CE1 4.43Å; F558-F576 HydrophobicContact CE2-CZ 4.33Å; F558-F576 AromaticContact CZ-CE1 3.74Å; F558-F576 HydrophobicContact CZ-CE1 3.74Å; F558-F576 HydrophobicContact CZ-CZ 4.09Å; L572-F576 WeakPolarHBondContact O-CD1 3.28Å; L572-F576 WeakPolarHBondContact O-CE1 3.33Å; A573-F576 HydrophobicContact CB-CZ 4.47Å; N574-F576 PolarHBondContact O-N 2.73Å; N574-F576 VanDerWaalsContact O-N 3.14Å; F576-V1046 WeakPolarHBondContact CE2-O 3.44Å; F576-L1047 HydrophobicContact CZ-CD2 4.21Å; F576-L1050 HydrophobicContact CB-CD1 4.41Å; F576-L1050 HydrophobicContact CD1-CD1 4.47Å; F576-L1050 HydrophobicContact CD2-CB 4.08Å; F576-L1050 HydrophobicContact CD2-CD1 4.07Å; F576-L1050 HydrophobicContact CE2-CB 4.04Å; F576-L1050 HydrophobicContact CE2-CD1 4.46Å; F576-L1050 HydrophobicContact CG-CD1 4.08Å; F576-A1053 HydrophobicContact CB-CB 4.22Å; F576-I1064 HydrophobicContact CB-CD1 4.5Å; F576-I1064 HydrophobicContact CD1-CD1 3.63Å; F576-I1064 HydrophobicContact CE1-CD1 4.16Å; F576-I1064 HydrophobicContact CG-CD1 4.28Å
577	S	84.6	Confident	87.4	Confident	6 Å²	6	40.5 Å²	40.5	4%	0.042	19%	0.194	C	C	.	.	S	Bend	trans	-85.3	135.6	160.7	-63.9	0	0	0	0	109.7	A573 R579 S1049	A573-S577 PolarHBondContact O-N 2.73Å; S577-R579 VanDerWaalsContact CB-NH2 3.35Å; S577-R579 PolarHBondContact O-N 3.24Å; S577-R579 PolarHBondContact OG-NH2 2.87Å; S577-S1049 PolarHBondContact OG-OG 2.68Å
578	M	80.2	Confident	87.2	Confident	18 Å²	18	42.2 Å²	42.2	9%	0.089	21%	0.205	C	C	.	.			trans	-79.4	116.8	172.2	-64.4	-60.5	-46.3	0	0	109.4	D427 H430 D432 R433 E600	D427-M578 PolarHBondContact OD1-N 3.44Å; H430-M578 HydrophobicContact CB-CB 3.69Å; H430-M578 HydrophobicContact CB-CG 4.21Å; H430-M578 PolarHBondContact NE2-O 2.61Å; D432-M578 HydrophobicContact CB-CE 4.25Å; R433-M578 HydrophobicContact CG-CE 4.03Å; R433-M578 HydrophobicContact CG-CG 4.22Å; R433-M578 HydrophobicContact CG-SD 4.13Å; M578-E600 HydrophobicContact CE-CG 4.38Å; M578-E600 WeakPolarHBondContact CE-OE1 3.49Å; M578-E600 HydrophobicContact SD-CG 4.31Å
579	R	81.1	Confident	86.9	Confident	23 Å²	23	43.4 Å²	43.4	9%	0.087	21%	0.209	C	C	.	.			trans	-133.8	135.9	-176	-61.6	-167.6	-164.7	138.5	12.9	112.8	H430 N574 S577 F581 V597 Y1031	H430-R579 PolarHBondContact CE1-O 3.13Å; N574-R579 PolarHBondContact OD1-NH1 3.33Å; S577-R579 VanDerWaalsContact CB-NH2 3.35Å; S577-R579 PolarHBondContact O-N 3.24Å; S577-R579 PolarHBondContact OG-NH2 2.87Å; R579-F581 PolarHBondContact O-N 2.83Å; R579-V597 HydrophobicContact CB-CG1 3.91Å; R579-V597 HydrophobicContact CG-CG1 4.43Å; R579-Y1031 VanDerWaalsContact NH1-CG 3.25Å
580	S	70.9	Confident	86.8	Confident	31 Å²	31	46.6 Å²	46.6	22%	0.217	22%	0.224	C	C	.	.			trans	-64.3	129.4	176.6	-62.3	0	0	0	0	110	H430 K431 I582	H430-S580 WeakPolarHBondContact CE1-CA 3.31Å; H430-S580 PolarHBondContact CE1-N 3.26Å; H430-S580 PolarHBondContact NE2-N 2.91Å; H430-S580 PolarHBondContact NE2-OG 2.95Å; H430-S580 VanDerWaalsContact NE2-OG 3.12Å; K431-S580 VanDerWaalsContact CE-OG 3.24Å; K431-S580 WeakPolarHBondContact CE-OG 3.38Å; K431-S580 PolarHBondContact NZ-OG 3.16Å; S580-I582 PolarHBondContact O-N 3.46Å
581	F	79.8	Confident	86.6	Confident	113 Å²	113	49.9 Å²	49.9	50%	0.496	24%	0.238	S	C	.	.			trans	-63.3	122.4	164.6	179.4	-106.8	0	0	0	110.2	R579 K583 S598	R579-F581 PolarHBondContact O-N 2.83Å; F581-K583 HydrophobicContact CE1-CB 3.9Å; F581-K583 HydrophobicContact CE1-CG 4.39Å; F581-K583 HydrophobicContact CZ-CB 4.48Å; F581-S598 WeakPolarHBondContact CD2-OG 3.38Å
582	I	84	Confident	86.5	Confident	78 Å²	78	52 Å²	52	40%	0.4	25%	0.247	S	C	.	.			trans	-106.8	120.1	174.3	-61.7	172.7	0	0	0	107.6	S580 I584 L594	S580-I582 PolarHBondContact O-N 3.46Å; I582-I584 PolarHBondContact O-N 3.25Å; I582-L594 HydrophobicContact CB-CD1 4.2Å
583	K	84.8	Confident	86.6	Confident	139 Å²	139	51.8 Å²	51.8	60%	0.604	25%	0.246	S	C	*	.			trans	-84.4	106.5	178.4	-171	-155.8	174.7	-162.9	0	110.2	F581 E585	F581-K583 HydrophobicContact CE1-CB 3.9Å; F581-K583 HydrophobicContact CE1-CG 4.39Å; F581-K583 HydrophobicContact CZ-CB 4.48Å; K583-E585 HydrophobicContact CD-CG 4.49Å; K583-E585 IonicContact NZ-OE1 3.3Å; K583-E585 PolarHBondContact NZ-OE1 2.84Å
584	I	87.1	Confident	86.6	Confident	41 Å²	41	51.9 Å²	51.9	21%	0.21	25%	0.246	C	C	.	.			trans	-85.9	135.2	165.1	-60.1	-178.2	0	0	0	108.7	I582 E586 Q590 K591 L594	I582-I584 PolarHBondContact O-N 3.25Å; I584-E586 HydrophobicContact CG2-CB 4.27Å; I584-Q590 HydrophobicContact CD1-CB 3.56Å; I584-K591 HydrophobicContact CB-CB 4.13Å; I584-K591 HydrophobicContact CG2-CB 4.27Å; I584-L594 HydrophobicContact CD1-CD1 3.59Å; I584-L594 HydrophobicContact CG1-CD1 3.96Å
585	E	85.3	Confident	86.5	Confident	154 Å²	154	55.4 Å²	55.4	72%	0.72	26%	0.262	S	S	*	.			trans	-95.4	-28.4	177.9	-54.1	-154.2	138.4	0	0	112.9	K583	K583-E585 HydrophobicContact CD-CG 4.49Å; K583-E585 IonicContact NZ-OE1 3.3Å; K583-E585 PolarHBondContact NZ-OE1 2.84Å
586	E	85.9	Confident	86.5	Confident	146 Å²	146	55.2 Å²	55.2	68%	0.682	26%	0.261	S	S	*	.	S	Bend	trans	-70.2	148.3	174.7	-60.3	-173.8	173.3	0	0	111.7	I584 T588 K591	I584-E586 HydrophobicContact CG2-CB 4.27Å; E586-T588 VanDerWaalsContact C-N 3.33Å; E586-T588 HydrophobicContact CB-CG2 4.14Å; E586-T588 PolarHBondContact O-N 2.91Å; E586-K591 VanDerWaalsContact O-CD 3.27Å; E586-K591 WeakPolarHBondContact O-CD 3.49Å
587	D	83.2	Confident	86.9	Confident	79 Å²	79	55 Å²	55	42%	0.422	26%	0.26	S	S	.	.			trans	-86.9	73.5	-177.2	-156.2	46.3	0	0	0	111.2	K591 Y592 H1148	D587-K591 IonicContact OD1-NZ 2.66Å; D587-K591 PolarHBondContact OD1-NZ 3.41Å; D587-Y592 WeakPolarHBondContact OD1-CE2 3.31Å; D587-Y592 PolarHBondContact OD1-OH 2.88Å; D587-H1148 PolarHBondContact O-CD2 3.28Å; D587-H1148 PolarHBondContact O-NE2 2.75Å
588	T	89.3	Confident	87.1	Confident	36 Å²	36	55.5 Å²	55.5	22%	0.221	26%	0.264	C	S	.	.	S	Bend	trans	-109.7	166.9	178.9	69.2	0	0	0	0	111.6	E586 Q590 K591 Y592	E586-T588 VanDerWaalsContact C-N 3.33Å; E586-T588 HydrophobicContact CB-CG2 4.14Å; E586-T588 PolarHBondContact O-N 2.91Å; T588-Q590 PolarHBondContact O-N 3.18Å; T588-Q590 PolarHBondContact OG1-N 2.86Å; T588-K591 WeakPolarHBondContact O-CB 3.35Å; T588-K591 PolarHBondContact O-N 3.41Å; T588-Y592 WeakPolarHBondContact O-CD2 3.32Å
589	W	90.8	Very high	87.6	Confident	27 Å²	27	55 Å²	55	10%	0.102	26%	0.262	C	S	.	.	H	α-helix	trans	-59.6	-32.8	173	69.6	-97	0	0	0	112.5	K591 Y592 Y593 L1032 Q1034 A1037 R1145 Y1159	W589-K591 VanDerWaalsContact C-N 3.34Å; W589-K591 PolarHBondContact O-N 3.03Å; W589-Y592 PolarHBondContact O-N 2.92Å; W589-Y593 HydrophobicContact CZ3-CD1 4.41Å; W589-Y593 HydrophobicContact CZ3-CG 4.15Å; W589-Y593 WeakPolarHBondContact O-CB 3.27Å; W589-Y593 PolarHBondContact O-N 3.03Å; W589-L1032 WeakPolarHBondContact CH2-O 3.4Å; W589-Q1034 HydrophobicContact CH2-CB 4.42Å; W589-Q1034 HydrophobicContact CZ2-CB 4.06Å; W589-A1037 HydrophobicContact CE3-CB 4.45Å; W589-A1037 HydrophobicContact CH2-CB 3.75Å; W589-A1037 HydrophobicContact CZ3-CB 3.42Å; W589-A1037 VanDerWaalsContact CZ3-CB 3.42Å; W589-R1145 HydrophobicContact CB-CG 4Å; W589-R1145 HydrophobicContact CD2-CG 4.48Å; W589-R1145 HydrophobicContact CG-CG 3.76Å; W589-Y1159 HydrophobicContact CB-CD1 4Å; W589-Y1159 HydrophobicContact CB-CE1 3.74Å; W589-Y1159 HydrophobicContact CB-CE2 4.5Å; W589-Y1159 HydrophobicContact CB-CG 4.48Å; W589-Y1159 HydrophobicContact CE3-CD2 4.44Å; W589-Y1159 HydrophobicContact CE3-CG 4.29Å; W589-Y1159 WeakPolarHBondContact O-CE2 3.36Å
590	Q	91.3	Very high	88	Confident	66 Å²	66	54.7 Å²	54.7	31%	0.308	26%	0.261	S	S	.	.	H	α-helix	trans	-63.5	-36.9	-179.4	-67.2	177.4	-18.8	0	0	112.5	I584 T588 Y592 Y593 L594	I584-Q590 HydrophobicContact CD1-CB 3.56Å; T588-Q590 PolarHBondContact O-N 3.18Å; T588-Q590 PolarHBondContact OG1-N 2.86Å; Q590-Y592 PolarHBondContact O-N 2.86Å; Q590-Y593 PolarHBondContact O-N 3.08Å; Q590-L594 WeakPolarHBondContact O-CB 3.29Å; Q590-L594 WeakPolarHBondContact O-CG 3.25Å; Q590-L594 PolarHBondContact O-N 2.71Å
591	K	92.2	Very high	88.9	Confident	69 Å²	69	54.2 Å²	54.2	30%	0.3	26%	0.256	S	S	.	.	H	α-helix	trans	-55.9	-48.7	176	169.3	-174.9	159.7	-167.7	0	111.6	I584 E586 D587 T588 W589 E595	I584-K591 HydrophobicContact CB-CB 4.13Å; I584-K591 HydrophobicContact CG2-CB 4.27Å; E586-K591 VanDerWaalsContact O-CD 3.27Å; E586-K591 WeakPolarHBondContact O-CD 3.49Å; D587-K591 IonicContact OD1-NZ 2.66Å; D587-K591 PolarHBondContact OD1-NZ 3.41Å; T588-K591 WeakPolarHBondContact O-CB 3.35Å; T588-K591 PolarHBondContact O-N 3.41Å; W589-K591 VanDerWaalsContact C-N 3.34Å; W589-K591 PolarHBondContact O-N 3.03Å; K591-E595 PolarHBondContact O-N 2.83Å
592	Y	92.5	Very high	89.3	Confident	46 Å²	46	50.2 Å²	50.2	18%	0.18	24%	0.238	C	C	.	.	H	α-helix	trans	-73.3	-33.7	179.1	-62.4	-71.7	0	0	0	112.6	D587 T588 W589 Q590 Y1159 F1168	D587-Y592 WeakPolarHBondContact OD1-CE2 3.31Å; D587-Y592 PolarHBondContact OD1-OH 2.88Å; T588-Y592 WeakPolarHBondContact O-CD2 3.32Å; W589-Y592 PolarHBondContact O-N 2.92Å; Q590-Y592 PolarHBondContact O-N 2.86Å; Y592-Y1159 WeakPolarHBondContact CB-OH 3.32Å; Y592-F1168 AromaticContact CD1-CE2 3.84Å; Y592-F1168 HydrophobicContact CD1-CE2 3.84Å; Y592-F1168 AromaticContact CD1-CZ 3.94Å; Y592-F1168 HydrophobicContact CD1-CZ 3.94Å; Y592-F1168 HydrophobicContact CE1-CE2 4.32Å; Y592-F1168 HydrophobicContact CE1-CZ 4.49Å
593	Y	94.5	Very high	89.6	Confident	1 Å²	1	47.6 Å²	47.6	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-62.4	-46	172.1	179.8	-101.3	0	0	0	111.6	T570 N574 W589 Q590 G596 V597 Y1031 A1037 Y1159 V1160	T570-Y593 HydrophobicContact CG2-CE2 4.11Å; N574-Y593 PolarHBondContact ND2-OH 3.1Å; W589-Y593 HydrophobicContact CZ3-CD1 4.41Å; W589-Y593 HydrophobicContact CZ3-CG 4.15Å; W589-Y593 WeakPolarHBondContact O-CB 3.27Å; W589-Y593 PolarHBondContact O-N 3.03Å; Q590-Y593 PolarHBondContact O-N 3.08Å; Y593-G596 CarbonylContact O-C 3.57Å; Y593-G596 VanDerWaalsContact O-CA 3.27Å; Y593-G596 WeakPolarHBondContact O-CA 3.33Å; Y593-G596 PolarHBondContact O-N 3.23Å; Y593-V597 HydrophobicContact CD1-CG2 3.58Å; Y593-V597 HydrophobicContact CE1-CG2 3.23Å; Y593-V597 HydrophobicContact CE2-CG2 4.5Å; Y593-V597 HydrophobicContact CG-CG2 4.34Å; Y593-V597 WeakPolarHBondContact O-CG2 3.48Å; Y593-V597 PolarHBondContact O-N 3.42Å; Y593-Y1031 HydrophobicContact CE1-CD2 4.46Å; Y593-Y1031 WeakPolarHBondContact CE1-O 3.48Å; Y593-Y1031 PolarHBondContact OH-O 2.77Å; Y593-A1037 HydrophobicContact CD2-CB 3.84Å; Y593-A1037 HydrophobicContact CE1-CB 4.27Å; Y593-A1037 HydrophobicContact CE2-CB 3.56Å; Y593-A1037 HydrophobicContact CG-CB 4.33Å; Y593-Y1159 HydrophobicContact CD2-CD2 4.43Å; Y593-V1160 WeakPolarHBondContact CD2-O 3.42Å; Y593-V1160 HydrophobicContact CE2-CB 4.47Å
594	L	92.8	Very high	90	Very high	3 Å²	3	42 Å²	42	2%	0.016	20%	0.202	C	C	.	.	H	α-helix	trans	-69.3	-32.4	-175.7	-78.9	165.7	0	0	0	114.3	I582 I584 Q590 G596 V597 S598 Y1031 L1032	I582-L594 HydrophobicContact CB-CD1 4.2Å; I584-L594 HydrophobicContact CD1-CD1 3.59Å; I584-L594 HydrophobicContact CG1-CD1 3.96Å; Q590-L594 WeakPolarHBondContact O-CB 3.29Å; Q590-L594 WeakPolarHBondContact O-CG 3.25Å; Q590-L594 PolarHBondContact O-N 2.71Å; L594-G596 PolarHBondContact O-N 3.09Å; L594-V597 HydrophobicContact CD2-CB 4.28Å; L594-V597 HydrophobicContact CD2-CG2 4.29Å; L594-V597 PolarHBondContact O-N 2.84Å; L594-V597 VanDerWaalsContact O-N 3.15Å; L594-S598 PolarHBondContact O-N 3.33Å; L594-S598 PolarHBondContact O-OG 2.91Å; L594-Y1031 HydrophobicContact CD2-CE2 4.36Å; L594-L1032 HydrophobicContact CD1-CD2 4.41Å; L594-L1032 HydrophobicContact CD2-CD2 3.88Å; L594-L1032 HydrophobicContact CG-CD2 4.45Å
595	E	90.3	Very high	90.2	Very high	75 Å²	75	44.9 Å²	44.9	35%	0.35	21%	0.211	S	C	.	.	H	α-helix	trans	-58.6	-35.1	167.2	-176.6	174.2	-160.5	0	0	111.1	K591 S598 N599 P1165	K591-E595 PolarHBondContact O-N 2.83Å; E595-S598 PolarHBondContact O-OG 3.28Å; E595-N599 PolarHBondContact O-ND2 2.88Å; E595-P1165 WeakPolarHBondContact OE1-CD 3.49Å; E595-P1165 WeakPolarHBondContact OE1-CG 3.43Å
596	G	91.4	Very high	90.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-70.4	-42.8	170.3	0	0	0	0	0	113.8	Y593 L594 S598 N599 T1162	Y593-G596 CarbonylContact O-C 3.57Å; Y593-G596 VanDerWaalsContact O-CA 3.27Å; Y593-G596 WeakPolarHBondContact O-CA 3.33Å; Y593-G596 PolarHBondContact O-N 3.23Å; L594-G596 PolarHBondContact O-N 3.09Å; G596-S598 VanDerWaalsContact C-N 3.32Å; G596-S598 PolarHBondContact O-N 3.22Å; G596-N599 PolarHBondContact O-N 3.33Å; G596-N599 PolarHBondContact O-ND2 3.29Å; G596-N599 VanDerWaalsContact O-ND2 3.11Å; G596-T1162 WeakPolarHBondContact CA-O 3.4Å; G596-T1162 WeakPolarHBondContact CA-OG1 3.44Å; G596-T1162 WeakPolarHBondContact O-CB 3.12Å; G596-T1162 PolarHBondContact O-OG1 3.49Å
597	V	92.3	Very high	90.9	Very high	3 Å²	3	31.5 Å²	31.5	2%	0.018	15%	0.149	C	C	.	.	H	α-helix	trans	-60.5	-37.8	-176.8	173.5	0	0	0	0	112.5	R579 Y593 L594 N599 Y1031	R579-V597 HydrophobicContact CB-CG1 3.91Å; R579-V597 HydrophobicContact CG-CG1 4.43Å; Y593-V597 HydrophobicContact CD1-CG2 3.58Å; Y593-V597 HydrophobicContact CE1-CG2 3.23Å; Y593-V597 HydrophobicContact CE2-CG2 4.5Å; Y593-V597 HydrophobicContact CG-CG2 4.34Å; Y593-V597 WeakPolarHBondContact O-CG2 3.48Å; Y593-V597 PolarHBondContact O-N 3.42Å; L594-V597 HydrophobicContact CD2-CB 4.28Å; L594-V597 HydrophobicContact CD2-CG2 4.29Å; L594-V597 PolarHBondContact O-N 2.84Å; L594-V597 VanDerWaalsContact O-N 3.15Å; V597-N599 PolarHBondContact O-N 2.91Å; V597-Y1031 HydrophobicContact CG1-CD2 4.14Å; V597-Y1031 HydrophobicContact CG1-CE2 4.11Å; V597-Y1031 HydrophobicContact CG2-CD2 4.38Å
598	S	89.8	Confident	91.3	Very high	18 Å²	18	30.7 Å²	30.7	13%	0.126	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	38	179.3	62.2	0	0	0	0	113.8	F581 L594 E595 G596 S669	F581-S598 WeakPolarHBondContact CD2-OG 3.38Å; L594-S598 PolarHBondContact O-N 3.33Å; L594-S598 PolarHBondContact O-OG 2.91Å; E595-S598 PolarHBondContact O-OG 3.28Å; G596-S598 VanDerWaalsContact C-N 3.32Å; G596-S598 PolarHBondContact O-N 3.22Å; S598-S669 VanDerWaalsContact O-CA 3.24Å; S598-S669 WeakPolarHBondContact O-CA 3.44Å; S598-S669 WeakPolarHBondContact O-CB 3.44Å
599	N	91.5	Very high	91.3	Very high	8 Å²	8	30.7 Å²	30.7	4%	0.043	15%	0.153	C	C	.	.			trans	-123.6	126.1	173.3	-75.2	-92.4	0	0	0	109	L575 E595 G596 V597 I667 A668 N1163	L575-N599 HydrophobicContact CD2-CB 4.16Å; L575-N599 VanDerWaalsContact CD2-O 3.32Å; L575-N599 WeakPolarHBondContact CD2-O 3.2Å; E595-N599 PolarHBondContact O-ND2 2.88Å; G596-N599 PolarHBondContact O-N 3.33Å; G596-N599 PolarHBondContact O-ND2 3.29Å; G596-N599 VanDerWaalsContact O-ND2 3.11Å; V597-N599 PolarHBondContact O-N 2.91Å; N599-I667 HydrophobicContact CB-CG2 3.65Å; N599-A668 CarbonylContact C-O 3.48Å; N599-A668 WeakPolarHBondContact CA-O 3.29Å; N599-N1163 PolarHBondContact OD1-ND2 2.99Å
600	E	89.1	Confident	91.4	Very high	15 Å²	15	29.4 Å²	29.4	7%	0.07	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	167	174	-44	94.3	160.6	0	0	112.5	M578 Y602 I667 A668	M578-E600 HydrophobicContact CE-CG 4.38Å; M578-E600 WeakPolarHBondContact CE-OE1 3.49Å; M578-E600 HydrophobicContact SD-CG 4.31Å; E600-Y602 HydrophobicContact CB-CD2 4.46Å; E600-Y602 HydrophobicContact CB-CE2 3.77Å; E600-Y602 VanDerWaalsContact CD-OH 3.24Å; E600-Y602 WeakPolarHBondContact O-CD2 3.35Å; E600-Y602 WeakPolarHBondContact OE2-CE2 3.48Å; E600-Y602 VanDerWaalsContact OE2-CZ 3.27Å; E600-Y602 PolarHBondContact OE2-OH 3.35Å; E600-I667 WeakPolarHBondContact O-CA 3.29Å; E600-A668 PolarHBondContact N-O 3.18Å; E600-A668 PolarHBondContact O-N 3.36Å
601	M	89.4	Confident	91.5	Very high	22 Å²	22	29.4 Å²	29.4	11%	0.108	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	117.1	178.3	-165.7	-174.9	-52.6	0	0	111.5	L575 F666 I1060 L1063 I1064	L575-M601 HydrophobicContact CB-CB 4.45Å; L575-M601 HydrophobicContact CB-CE 4.25Å; L575-M601 HydrophobicContact CD1-CE 4.29Å; L575-M601 PolarHBondContact O-N 3.4Å; M601-F666 WeakPolarHBondContact CA-O 3.19Å; M601-I1060 HydrophobicContact CB-CD1 3.89Å; M601-I1060 HydrophobicContact CG-CD1 3.56Å; M601-I1060 WeakPolarHBondContact O-CD1 3.39Å; M601-I1060 HydrophobicContact SD-CD1 3.66Å; M601-I1060 HydrophobicContact SD-CG2 4.31Å; M601-L1063 HydrophobicContact CG-CD2 4.47Å; M601-L1063 HydrophobicContact SD-CD2 3.54Å; M601-L1063 VanDerWaalsContact SD-CD2 3.54Å; M601-L1063 HydrophobicContact SD-CG 4.16Å; M601-I1064 HydrophobicContact CE-CD1 4.29Å; M601-I1064 HydrophobicContact CE-CG1 3.97Å; M601-I1064 HydrophobicContact SD-CG1 4.39Å
602	Y	88.7	Confident	91.4	Very high	29 Å²	29	28.4 Å²	28.4	11%	0.114	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	156.3	-175.4	-67.4	-78.7	0	0	0	112.8	E600 F665 F666 A668 A671 V674	E600-Y602 HydrophobicContact CB-CD2 4.46Å; E600-Y602 HydrophobicContact CB-CE2 3.77Å; E600-Y602 VanDerWaalsContact CD-OH 3.24Å; E600-Y602 WeakPolarHBondContact O-CD2 3.35Å; E600-Y602 WeakPolarHBondContact OE2-CE2 3.48Å; E600-Y602 VanDerWaalsContact OE2-CZ 3.27Å; E600-Y602 PolarHBondContact OE2-OH 3.35Å; Y602-F665 WeakPolarHBondContact O-CA 3.38Å; Y602-F666 PolarHBondContact N-O 3.43Å; Y602-F666 PolarHBondContact O-N 3.15Å; Y602-A668 HydrophobicContact CD2-CB 4.29Å; Y602-A668 WeakPolarHBondContact CE2-O 3.38Å; Y602-A671 HydrophobicContact CD1-CB 4.08Å; Y602-A671 HydrophobicContact CE1-CB 3.57Å; Y602-A671 PolarHBondContact OH-N 2.81Å; Y602-V674 HydrophobicContact CD2-CG2 3.84Å; Y602-V674 HydrophobicContact CG-CG2 3.88Å
603	T	90.1	Very high	91.4	Very high	23 Å²	23	29 Å²	29	14%	0.141	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	134	174.3	79.3	0	0	0	0	111.4	G664 F665 N1057 N1059 I1060	T603-G664 WeakPolarHBondContact CA-O 3.25Å; T603-F665 HydrophobicContact CG2-CD1 3.57Å; T603-F665 HydrophobicContact CG2-CE1 3.68Å; T603-F665 HydrophobicContact CG2-CG 4.44Å; T603-N1057 PolarHBondContact OG1-OD1 3.2Å; T603-N1057 VanDerWaalsContact OG1-OD1 3.14Å; T603-N1059 HydrophobicContact CG2-CB 4.46Å; T603-I1060 HydrophobicContact CG2-CD1 4.11Å
604	E	92.1	Very high	91.4	Very high	21 Å²	21	30 Å²	30	10%	0.098	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	151.5	-178.2	-171.6	52.1	-97.6	0	0	112.1	G664 F666 V674 K675 F678	E604-G664 PolarHBondContact N-O 3.28Å; E604-G664 PolarHBondContact O-N 3.28Å; E604-F666 HydrophobicContact CB-CE2 4.3Å; E604-V674 HydrophobicContact CB-CG1 3.69Å; E604-V674 HydrophobicContact CG-CG1 4.36Å; E604-K675 WeakPolarHBondContact OE2-CD 3.48Å; E604-K675 WeakPolarHBondContact OE2-CE 3.31Å; E604-K675 IonicContact OE2-NZ 3.12Å; E604-K675 PolarHBondContact OE2-NZ 3.49Å; E604-F678 HydrophobicContact CG-CB 4.19Å
605	Y	92.8	Very high	91.5	Very high	101 Å²	101	29.9 Å²	29.9	40%	0.396	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	134.6	179.3	-74.3	-71.6	0	0	0	112.4	L663 F678	Y605-L663 HydrophobicContact CD1-CB 4.26Å; Y605-L663 HydrophobicContact CD1-CD1 4.02Å; Y605-L663 HydrophobicContact CD2-CD1 4.14Å; Y605-L663 HydrophobicContact CE1-CB 4.03Å; Y605-L663 HydrophobicContact CE1-CD1 3.91Å; Y605-L663 HydrophobicContact CE2-CD1 4.03Å; Y605-L663 HydrophobicContact CG-CD1 4.14Å; Y605-F678 WeakPolarHBondContact O-CA 3.49Å; Y605-F678 WeakPolarHBondContact O-CB 3.4Å; Y605-F678 WeakPolarHBondContact O-CD2 3.41Å
606	L	93.4	Very high	91.8	Very high	12 Å²	12	26.9 Å²	26.9	6%	0.063	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-69.7	138	176.7	-64.1	178.9	0	0	0	111.5	F610 M630 I633 I658 T662 F666	L606-F610 HydrophobicContact CB-CD2 4.24Å; L606-F610 HydrophobicContact CD2-CD2 4.33Å; L606-M630 HydrophobicContact CD1-SD 4.32Å; L606-M630 HydrophobicContact CD2-SD 3.93Å; L606-I633 HydrophobicContact CD1-CG2 4.34Å; L606-I658 HydrophobicContact CD1-CD1 4.24Å; L606-I658 HydrophobicContact CD1-CG1 4.4Å; L606-I658 HydrophobicContact CD1-CG2 3.63Å; L606-T662 HydrophobicContact CD1-CG2 3.9Å; L606-T662 PolarHBondContact N-O 2.81Å; L606-T662 VanDerWaalsContact N-O 3.12Å; L606-F666 HydrophobicContact CD2-CE2 4.39Å; L606-F666 HydrophobicContact CD2-CZ 3.74Å
607	S	92.4	Very high	91.9	Very high	7 Å²	7	29.4 Å²	29.4	5%	0.049	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-56.9	148.7	171.2	174.6	0	0	0	0	112.4	A609 F610 A677 Y680	S607-A609 PolarHBondContact O-N 3.14Å; S607-A609 PolarHBondContact OG-N 3.18Å; S607-A609 VanDerWaalsContact OG-N 3.13Å; S607-F610 PolarHBondContact O-N 3.13Å; S607-A677 VanDerWaalsContact CB-O 3.28Å; S607-A677 WeakPolarHBondContact CB-O 3.48Å; S607-A677 PolarHBondContact N-O 3.36Å; S607-Y680 VanDerWaalsContact CB-O 3.25Å; S607-Y680 WeakPolarHBondContact CB-O 3.39Å; S607-Y680 PolarHBondContact OG-O 3.33Å
608	S	89.8	Confident	92	Very high	62 Å²	62	29.3 Å²	29.3	43%	0.434	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-56.5	-17.5	169.5	53	0	0	0	0	113.7	F610	S608-F610 PolarHBondContact O-N 3.08Å
609	A	90.1	Very high	92.3	Very high	36 Å²	36	28.4 Å²	28.4	30%	0.298	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-68.2	-17.9	174.1	0	0	0	0	0	114.1	S607 Y680	S607-A609 PolarHBondContact O-N 3.14Å; S607-A609 PolarHBondContact OG-N 3.18Å; S607-A609 VanDerWaalsContact OG-N 3.13Å; A609-Y680 HydrophobicContact CB-CD1 4.3Å
610	F	92.9	Very high	92.4	Very high	1 Å²	1	30.7 Å²	30.7	0%	0.004	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-96.6	-7.9	179.9	-59.3	-56.4	0	0	0	113.9	L606 S607 S608 G612 L613 V618 L621 L626 A677 Y680	L606-F610 HydrophobicContact CB-CD2 4.24Å; L606-F610 HydrophobicContact CD2-CD2 4.33Å; S607-F610 PolarHBondContact O-N 3.13Å; S608-F610 PolarHBondContact O-N 3.08Å; F610-G612 PolarHBondContact O-N 3.23Å; F610-L613 HydrophobicContact CD1-CD1 4.28Å; F610-L613 WeakPolarHBondContact O-CB 3.46Å; F610-L613 PolarHBondContact O-N 3.24Å; F610-L613 VanDerWaalsContact O-N 3.15Å; F610-V618 HydrophobicContact CB-CG1 4.21Å; F610-V618 HydrophobicContact CB-CG2 4.01Å; F610-V618 HydrophobicContact CD1-CB 4.49Å; F610-V618 HydrophobicContact CD1-CG1 3.81Å; F610-V618 HydrophobicContact CD1-CG2 4.06Å; F610-V618 HydrophobicContact CD2-CG1 4.34Å; F610-V618 HydrophobicContact CE1-CG1 4.21Å; F610-V618 HydrophobicContact CG-CG1 3.88Å; F610-V618 HydrophobicContact CG-CG2 4.31Å; F610-L621 HydrophobicContact CE1-CB 4.37Å; F610-L621 HydrophobicContact CE1-CD1 4.33Å; F610-L626 HydrophobicContact CZ-CD1 4.31Å; F610-A677 WeakPolarHBondContact CE2-O 3.29Å; F610-Y680 AromaticContact CE1-CD1 3.71Å; F610-Y680 HydrophobicContact CE1-CD1 3.71Å; F610-Y680 HydrophobicContact CE1-CE1 4.13Å; F610-Y680 HydrophobicContact CE2-CD1 4.27Å; F610-Y680 AromaticContact CZ-CD1 3.48Å; F610-Y680 HydrophobicContact CZ-CD1 3.48Å; F610-Y680 VanDerWaalsContact CZ-CD1 3.48Å; F610-Y680 HydrophobicContact CZ-CE1 4.29Å; F610-Y680 AromaticContact CZ-CG 3.95Å; F610-Y680 HydrophobicContact CZ-CG 3.95Å
611	V	92.6	Very high	92.6	Very high	65 Å²	65	32.5 Å²	32.5	39%	0.394	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	130.3	-175.5	177.9	0	0	0	0	110.8	L613 E660	V611-L613 VanDerWaalsContact C-N 3.31Å; V611-E660 HydrophobicContact CG2-CB 4.13Å
612	G	90.3	Very high	92.8	Very high	48 Å²	48	31.5 Å²	31.5	50%	0.495	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	-10.8	-176.4	0	0	0	0	0	115.2	F610 I658	F610-G612 PolarHBondContact O-N 3.23Å; G612-I658 PolarHBondContact N-O 3.3Å
613	L	93.7	Very high	93.1	Very high	60 Å²	60	30.6 Å²	30.6	31%	0.314	18%	0.182	S	C	.	.	S	Bend	trans	-75.6	157.3	172	-58.8	-176.3	0	0	0	111.5	F610 V611 V618 L621 K657 I658	F610-L613 HydrophobicContact CD1-CD1 4.28Å; F610-L613 WeakPolarHBondContact O-CB 3.46Å; F610-L613 PolarHBondContact O-N 3.24Å; F610-L613 VanDerWaalsContact O-N 3.15Å; V611-L613 VanDerWaalsContact C-N 3.31Å; L613-V618 HydrophobicContact CB-CG2 3.66Å; L613-V618 HydrophobicContact CD1-CG2 4.11Å; L613-L621 HydrophobicContact CD1-CD1 4.18Å; L613-K657 CarbonylContact O-C 3.46Å; L613-K657 VanDerWaalsContact O-CA 3.29Å; L613-K657 WeakPolarHBondContact O-CA 3.45Å; L613-I658 PolarHBondContact O-N 3.06Å
614	S	94.5	Very high	93.2	Very high	21 Å²	21	32.5 Å²	32.5	15%	0.147	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-73.9	146.4	172.5	-13.4	0	0	0	0	110.8	T617 V618 K657	S614-T617 WeakPolarHBondContact CB-OG1 3.26Å; S614-T617 WeakPolarHBondContact O-CB 3.39Å; S614-T617 PolarHBondContact O-N 3.02Å; S614-T617 VanDerWaalsContact O-N 3.08Å; S614-T617 PolarHBondContact OG-OG1 2.79Å; S614-T617 VanDerWaalsContact OG-OG1 3.12Å; S614-V618 PolarHBondContact O-N 2.88Å; S614-V618 VanDerWaalsContact O-N 3.1Å; S614-K657 PolarHBondContact OG-NZ 2.98Å
615	F	94.3	Very high	93.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-52.7	-49.6	177	173.4	-86	0	0	0	113.4	T617 V618 C619 M630 I633 N651 P652 L656 I658	F615-T617 VanDerWaalsContact C-N 3.29Å; F615-T617 PolarHBondContact O-N 2.59Å; F615-V618 PolarHBondContact O-N 2.71Å; F615-C619 WeakPolarHBondContact CE1-SG 3.37Å; F615-C619 WeakPolarHBondContact CZ-SG 3.49Å; F615-C619 PolarHBondContact O-N 3.33Å; F615-C619 PolarHBondContact O-SG 2.83Å; F615-M630 HydrophobicContact CD2-CE 3.77Å; F615-M630 HydrophobicContact CE2-CE 3.65Å; F615-M630 HydrophobicContact CE2-CG 4.27Å; F615-M630 HydrophobicContact CE2-SD 4.38Å; F615-M630 HydrophobicContact CZ-CE 4.35Å; F615-I633 HydrophobicContact CD2-CD1 4.21Å; F615-I633 HydrophobicContact CD2-CG1 4.23Å; F615-I633 HydrophobicContact CD2-CG2 3.98Å; F615-I633 HydrophobicContact CE2-CG1 4.48Å; F615-I633 HydrophobicContact CE2-CG2 4.01Å; F615-N651 HydrophobicContact CE1-CB 4.3Å; F615-N651 WeakPolarHBondContact CE1-OD1 3.37Å; F615-P652 HydrophobicContact CB-CG 3.99Å; F615-P652 HydrophobicContact CD1-CG 4.11Å; F615-P652 VanDerWaalsContact CD1-O 3.28Å; F615-P652 WeakPolarHBondContact CD1-O 3.22Å; F615-P652 HydrophobicContact CD2-CG 3.79Å; F615-P652 HydrophobicContact CE2-CG 4.3Å; F615-P652 HydrophobicContact CG-CG 3.69Å; F615-L656 PolarHBondContact N-O 3.12Å; F615-I658 HydrophobicContact CB-CD1 4.36Å; F615-I658 HydrophobicContact CD2-CD1 4.47Å
616	P	95.4	Very high	93.1	Very high	13 Å²	13	29.8 Å²	29.8	8%	0.084	18%	0.184	C	C	.	.	H	α-helix	trans	-56.9	-38.1	176	-28.3	36.5	0	0	0	114.2	V618 C619 E620 N654 L1131	P616-V618 VanDerWaalsContact C-N 3.29Å; P616-V618 PolarHBondContact O-N 3.13Å; P616-C619 PolarHBondContact O-N 3.31Å; P616-E620 PolarHBondContact O-N 3.15Å; P616-N654 HydrophobicContact CG-CB 4.48Å; P616-L1131 HydrophobicContact CB-CD1 3.91Å; P616-L1131 HydrophobicContact CB-CG 4.06Å; P616-L1131 HydrophobicContact CG-CD1 4.44Å
617	T	94.1	Very high	93.1	Very high	53 Å²	53	35.2 Å²	35.2	33%	0.325	21%	0.207	S	C	.	.	H	α-helix	trans	-66.1	-32.1	177.3	-41.9	0	0	0	0	112	S614 F615 L621	S614-T617 WeakPolarHBondContact CB-OG1 3.26Å; S614-T617 WeakPolarHBondContact O-CB 3.39Å; S614-T617 PolarHBondContact O-N 3.02Å; S614-T617 VanDerWaalsContact O-N 3.08Å; S614-T617 PolarHBondContact OG-OG1 2.79Å; S614-T617 VanDerWaalsContact OG-OG1 3.12Å; F615-T617 VanDerWaalsContact C-N 3.29Å; F615-T617 PolarHBondContact O-N 2.59Å; T617-L621 WeakPolarHBondContact O-CG 3.33Å; T617-L621 PolarHBondContact O-N 3.32Å
618	V	94.8	Very high	93.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-79.6	-37.3	176.1	-179.8	0	0	0	0	111	F610 L613 S614 F615 P616 L621 C622 M630 I658	F610-V618 HydrophobicContact CB-CG1 4.21Å; F610-V618 HydrophobicContact CB-CG2 4.01Å; F610-V618 HydrophobicContact CD1-CB 4.49Å; F610-V618 HydrophobicContact CD1-CG1 3.81Å; F610-V618 HydrophobicContact CD1-CG2 4.06Å; F610-V618 HydrophobicContact CD2-CG1 4.34Å; F610-V618 HydrophobicContact CE1-CG1 4.21Å; F610-V618 HydrophobicContact CG-CG1 3.88Å; F610-V618 HydrophobicContact CG-CG2 4.31Å; L613-V618 HydrophobicContact CB-CG2 3.66Å; L613-V618 HydrophobicContact CD1-CG2 4.11Å; S614-V618 PolarHBondContact O-N 2.88Å; S614-V618 VanDerWaalsContact O-N 3.1Å; F615-V618 PolarHBondContact O-N 2.71Å; P616-V618 VanDerWaalsContact C-N 3.29Å; P616-V618 PolarHBondContact O-N 3.13Å; V618-L621 PolarHBondContact O-N 2.76Å; V618-C622 WeakPolarHBondContact O-CB 3.36Å; V618-C622 PolarHBondContact O-N 2.84Å; V618-C622 PolarHBondContact O-SG 2.91Å; V618-M630 HydrophobicContact CB-CE 3.89Å; V618-M630 HydrophobicContact CG1-CE 3.58Å; V618-M630 HydrophobicContact CG1-SD 4.4Å; V618-I658 HydrophobicContact CG2-CG1 4.01Å
619	C	95.5	Very high	93.5	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61.2	-44	172.8	-68.1	0	0	0	0	112.2	F615 P616 L621 C622 F623 M630 L1131 L1137	F615-C619 WeakPolarHBondContact CE1-SG 3.37Å; F615-C619 WeakPolarHBondContact CZ-SG 3.49Å; F615-C619 PolarHBondContact O-N 3.33Å; F615-C619 PolarHBondContact O-SG 2.83Å; P616-C619 PolarHBondContact O-N 3.31Å; C619-L621 PolarHBondContact O-N 3.06Å; C619-C622 PolarHBondContact O-N 2.61Å; C619-F623 WeakPolarHBondContact O-CB 3.26Å; C619-F623 PolarHBondContact O-N 3.08Å; C619-M630 WeakPolarHBondContact SG-CE 3.47Å; C619-M630 PolarHBondContact SG-O 3.08Å; C619-L1131 HydrophobicContact CB-CD2 3.76Å; C619-L1137 HydrophobicContact CB-CD1 4.25Å
620	E	94.9	Very high	93.8	Very high	55 Å²	55	30.3 Å²	30.3	26%	0.257	17%	0.17	S	C	.	.	H	α-helix	trans	-56.4	-50.5	173.2	-179.6	-176.8	175	0	0	111.5	P616 C622 F623 V624 K1132	P616-E620 PolarHBondContact O-N 3.15Å; E620-C622 PolarHBondContact O-N 3.06Å; E620-F623 PolarHBondContact O-N 3.35Å; E620-V624 HydrophobicContact CG-CG2 4.33Å; E620-V624 WeakPolarHBondContact O-CB 3.08Å; E620-V624 VanDerWaalsContact O-CG2 3.31Å; E620-V624 WeakPolarHBondContact O-CG2 3.03Å; E620-V624 PolarHBondContact O-N 2.94Å; E620-K1132 WeakPolarHBondContact OE1-CE 3.43Å; E620-K1132 IonicContact OE1-NZ 2.67Å; E620-K1132 PolarHBondContact OE1-NZ 3.27Å; E620-K1132 WeakPolarHBondContact OE2-CE 3.33Å; E620-K1132 IonicContact OE2-NZ 3.79Å
621	L	92.6	Very high	93.9	Very high	54 Å²	54	31.3 Å²	31.3	28%	0.283	18%	0.175	S	C	.	.	H	α-helix	trans	-63.3	-39.7	178.4	-71.2	170.4	0	0	0	112.3	F610 L613 T617 V618 C619 K625	F610-L621 HydrophobicContact CE1-CB 4.37Å; F610-L621 HydrophobicContact CE1-CD1 4.33Å; L613-L621 HydrophobicContact CD1-CD1 4.18Å; T617-L621 WeakPolarHBondContact O-CG 3.33Å; T617-L621 PolarHBondContact O-N 3.32Å; V618-L621 PolarHBondContact O-N 2.76Å; C619-L621 PolarHBondContact O-N 3.06Å; L621-K625 VanDerWaalsContact O-CB 3.31Å; L621-K625 WeakPolarHBondContact O-CB 3.27Å; L621-K625 PolarHBondContact O-N 2.67Å
622	C	94.4	Very high	93.9	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.156	C	C	.	.	I	π-helix	trans	-66.2	-43.6	177.4	-67.1	0	0	0	0	111.6	V618 C619 E620 L626 K627 L628 F666	V618-C622 WeakPolarHBondContact O-CB 3.36Å; V618-C622 PolarHBondContact O-N 2.84Å; V618-C622 PolarHBondContact O-SG 2.91Å; C619-C622 PolarHBondContact O-N 2.61Å; E620-C622 PolarHBondContact O-N 3.06Å; C622-L626 CarbonylContact O-C 3.52Å; C622-L626 VanDerWaalsContact O-CA 3.31Å; C622-L626 WeakPolarHBondContact O-CA 3.3Å; C622-L626 VanDerWaalsContact O-CB 3.27Å; C622-L626 WeakPolarHBondContact O-CB 3.47Å; C622-L626 PolarHBondContact O-N 2.97Å; C622-K627 PolarHBondContact O-N 3.05Å; C622-L628 CarbonylContact C-O 3.44Å; C622-L628 HydrophobicContact CB-CB 4.38Å; C622-L628 WeakPolarHBondContact CB-O 3.4Å; C622-L628 PolarHBondContact O-N 3.05Å; C622-F666 HydrophobicContact CB-CE1 4.47Å
623	F	94.6	Very high	94.1	Very high	10 Å²	10	26 Å²	26	4%	0.044	13%	0.133	C	C	.	.	I	π-helix	trans	-69.4	-52.1	-179.3	-164.9	-99.7	0	0	0	111.4	C619 E620 K627 L628 L629 Y1123 F1127 Y1166	C619-F623 WeakPolarHBondContact O-CB 3.26Å; C619-F623 PolarHBondContact O-N 3.08Å; E620-F623 PolarHBondContact O-N 3.35Å; F623-K627 WeakPolarHBondContact O-CA 3.16Å; F623-K627 PolarHBondContact O-N 3.27Å; F623-L628 PolarHBondContact N-O 2.78Å; F623-L629 HydrophobicContact CD2-CB 4.33Å; F623-L629 HydrophobicContact CD2-CD1 4.37Å; F623-Y1123 HydrophobicContact CE2-CE1 4.37Å; F623-Y1123 HydrophobicContact CZ-CD1 4.02Å; F623-Y1123 AromaticContact CZ-CE1 3.8Å; F623-Y1123 HydrophobicContact CZ-CE1 3.8Å; F623-F1127 HydrophobicContact CB-CD1 4.15Å; F623-F1127 HydrophobicContact CB-CE1 3.53Å; F623-F1127 HydrophobicContact CB-CZ 3.95Å; F623-F1127 AromaticContact CD1-CD1 3.65Å; F623-F1127 HydrophobicContact CD1-CD1 3.65Å; F623-F1127 AromaticContact CD1-CE1 3.94Å; F623-F1127 HydrophobicContact CD1-CE1 3.94Å; F623-F1127 HydrophobicContact CD1-CG 4.12Å; F623-F1127 HydrophobicContact CD2-CE1 4.34Å; F623-F1127 HydrophobicContact CD2-CE2 4.43Å; F623-F1127 HydrophobicContact CD2-CZ 4.26Å; F623-F1127 HydrophobicContact CE1-CB 4.38Å; F623-F1127 HydrophobicContact CE1-CD1 4.23Å; F623-F1127 HydrophobicContact CE1-CG 4.26Å; F623-F1127 AromaticContact CG-CD1 3.86Å; F623-F1127 HydrophobicContact CG-CD1 3.86Å; F623-F1127 AromaticContact CG-CE1 3.67Å; F623-F1127 HydrophobicContact CG-CE1 3.67Å; F623-F1127 HydrophobicContact CG-CG 4.39Å; F623-F1127 HydrophobicContact CG-CZ 4.03Å; F623-Y1166 AromaticContact CD1-CD2 3.94Å; F623-Y1166 HydrophobicContact CD1-CD2 3.94Å; F623-Y1166 HydrophobicContact CD1-CE2 4.46Å; F623-Y1166 AromaticContact CE1-CD2 3.71Å; F623-Y1166 HydrophobicContact CE1-CD2 3.71Å; F623-Y1166 HydrophobicContact CE1-CE2 4.45Å
624	V	92.1	Very high	93.9	Very high	63 Å²	63	23.2 Å²	23.2	38%	0.382	12%	0.119	S	C	.	.	I	π-helix	trans	-72.7	-45.3	-174.9	-179.4	0	0	0	0	112.7	E620 Y1166	E620-V624 HydrophobicContact CG-CG2 4.33Å; E620-V624 WeakPolarHBondContact O-CB 3.08Å; E620-V624 VanDerWaalsContact O-CG2 3.31Å; E620-V624 WeakPolarHBondContact O-CG2 3.03Å; E620-V624 PolarHBondContact O-N 2.94Å; V624-Y1166 HydrophobicContact CG2-CE2 3.98Å
625	K	90.4	Very high	93.3	Very high	64 Å²	64	25.9 Å²	25.9	28%	0.278	13%	0.126	S	C	.	.	I	π-helix	trans	-96.4	-31.9	-174.1	-73.8	-82.6	179.4	169.4	0	114.2	L621 D686 V688	L621-K625 VanDerWaalsContact O-CB 3.31Å; L621-K625 WeakPolarHBondContact O-CB 3.27Å; L621-K625 PolarHBondContact O-N 2.67Å; K625-D686 PolarHBondContact NZ-O 3.15Å; K625-V688 PolarHBondContact NZ-O 3.36Å
626	L	91.9	Very high	92.4	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	14%	0.14	C	C	.	.	I	π-helix	trans	-103.9	-11.1	-177.2	-48.9	-176.1	0	0	0	113.5	F610 C622 L628 R676 A677 Y680 I694	F610-L626 HydrophobicContact CZ-CD1 4.31Å; C622-L626 CarbonylContact O-C 3.52Å; C622-L626 VanDerWaalsContact O-CA 3.31Å; C622-L626 WeakPolarHBondContact O-CA 3.3Å; C622-L626 VanDerWaalsContact O-CB 3.27Å; C622-L626 WeakPolarHBondContact O-CB 3.47Å; C622-L626 PolarHBondContact O-N 2.97Å; L626-L628 VanDerWaalsContact C-N 3.28Å; L626-L628 HydrophobicContact CB-CB 4.34Å; L626-L628 HydrophobicContact CB-CD1 3.9Å; L626-L628 HydrophobicContact CB-CG 3.93Å; L626-L628 HydrophobicContact CD1-CD1 4.2Å; L626-L628 PolarHBondContact O-N 3.43Å; L626-R676 HydrophobicContact CD2-CB 4.39Å; L626-R676 VanDerWaalsContact O-CZ 3.31Å; L626-R676 PolarHBondContact O-NE 3.31Å; L626-R676 PolarHBondContact O-NH2 2.79Å; L626-A677 HydrophobicContact CD1-CB 4.4Å; L626-Y680 HydrophobicContact CD2-CD2 3.73Å; L626-Y680 HydrophobicContact CD2-CE2 4.31Å; L626-Y680 HydrophobicContact CD2-CG 4.32Å; L626-I694 HydrophobicContact CD2-CD1 3.5Å; L626-I694 VanDerWaalsContact CD2-CD1 3.5Å; L626-I694 HydrophobicContact CD2-CG2 4.44Å
627	K	93.9	Very high	90.8	Very high	127 Å²	127	30.4 Å²	30.4	55%	0.552	15%	0.149	S	C	*	.			trans	52.2	45.7	-169.2	-56.6	-166.2	176.7	-163.4	0	112.2	C622 F623 P691	C622-K627 PolarHBondContact O-N 3.05Å; F623-K627 WeakPolarHBondContact O-CA 3.16Å; F623-K627 PolarHBondContact O-N 3.27Å; K627-P691 HydrophobicContact CD-CG 4.39Å; K627-P691 HydrophobicContact CG-CG 4.41Å
628	L	94.9	Very high	88.9	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.162	C	C	.	.			trans	-127	126.3	178.8	-61.3	176.1	0	0	0	110.4	C622 F623 L626 F666 A668 E673 V674 A677	C622-L628 CarbonylContact C-O 3.44Å; C622-L628 HydrophobicContact CB-CB 4.38Å; C622-L628 WeakPolarHBondContact CB-O 3.4Å; C622-L628 PolarHBondContact O-N 3.05Å; F623-L628 PolarHBondContact N-O 2.78Å; L626-L628 VanDerWaalsContact C-N 3.28Å; L626-L628 HydrophobicContact CB-CB 4.34Å; L626-L628 HydrophobicContact CB-CD1 3.9Å; L626-L628 HydrophobicContact CB-CG 3.93Å; L626-L628 HydrophobicContact CD1-CD1 4.2Å; L626-L628 PolarHBondContact O-N 3.43Å; L628-F666 HydrophobicContact CB-CD1 3.94Å; L628-F666 HydrophobicContact CB-CE1 4.35Å; L628-A668 HydrophobicContact CD2-CB 3.72Å; L628-E673 HydrophobicContact CD2-CB 4.37Å; L628-V674 HydrophobicContact CD2-CG2 4.17Å; L628-A677 HydrophobicContact CD1-CB 4.11Å
629	L	96.3	Very high	86.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	104.5	178.5	173.9	60.4	0	0	0	110.4	F623 I631 F666 I667 F1127 L1137 F1139 N1163	F623-L629 HydrophobicContact CD2-CB 4.33Å; F623-L629 HydrophobicContact CD2-CD1 4.37Å; L629-I631 HydrophobicContact CG-CG1 4.26Å; L629-F666 CarbonylContact O-C 3.16Å; L629-F666 VanDerWaalsContact O-CA 3.27Å; L629-F666 WeakPolarHBondContact O-CA 3.49Å; L629-I667 HydrophobicContact CB-CB 4.36Å; L629-I667 HydrophobicContact CD2-CB 4.38Å; L629-I667 HydrophobicContact CD2-CD1 4.26Å; L629-I667 PolarHBondContact N-O 3.06Å; L629-I667 PolarHBondContact O-N 2.9Å; L629-F1127 HydrophobicContact CD1-CE2 3.59Å; L629-F1127 HydrophobicContact CD1-CZ 4.1Å; L629-L1137 HydrophobicContact CD1-CD1 4.4Å; L629-L1137 HydrophobicContact CD1-CD2 4.47Å; L629-L1137 HydrophobicContact CD1-CG 4.45Å; L629-F1139 HydrophobicContact CD2-CB 3.82Å; L629-N1163 VanDerWaalsContact CB-OD1 3.23Å; L629-N1163 WeakPolarHBondContact CB-OD1 3.49Å; L629-N1163 HydrophobicContact CD2-CB 4.06Å; L629-N1163 WeakPolarHBondContact CD2-OD1 3.32Å
630	M	95.7	Very high	84.4	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.5	179	-170	175.5	62	0	0	111.5	L606 F615 V618 C619 I633 F665 F666 L1137	L606-M630 HydrophobicContact CD1-SD 4.32Å; L606-M630 HydrophobicContact CD2-SD 3.93Å; F615-M630 HydrophobicContact CD2-CE 3.77Å; F615-M630 HydrophobicContact CE2-CE 3.65Å; F615-M630 HydrophobicContact CE2-CG 4.27Å; F615-M630 HydrophobicContact CE2-SD 4.38Å; F615-M630 HydrophobicContact CZ-CE 4.35Å; V618-M630 HydrophobicContact CB-CE 3.89Å; V618-M630 HydrophobicContact CG1-CE 3.58Å; V618-M630 HydrophobicContact CG1-SD 4.4Å; C619-M630 WeakPolarHBondContact SG-CE 3.47Å; C619-M630 PolarHBondContact SG-O 3.08Å; M630-I633 HydrophobicContact SD-CG2 4.26Å; M630-F665 WeakPolarHBondContact CA-O 3.39Å; M630-F666 HydrophobicContact CB-CD1 3.76Å; M630-F666 HydrophobicContact CB-CE1 3.63Å; M630-F666 HydrophobicContact CB-CZ 4.47Å; M630-F666 HydrophobicContact CG-CD1 4.11Å; M630-F666 HydrophobicContact CG-CE1 3.8Å; M630-F666 HydrophobicContact CG-CZ 4.16Å; M630-F666 HydrophobicContact SD-CE1 4.03Å; M630-F666 HydrophobicContact SD-CZ 3.98Å; M630-L1137 WeakPolarHBondContact O-CD2 3.4Å
631	I	94.6	Very high	81.9	Confident	22 Å²	22	51.8 Å²	51.8	11%	0.113	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-38.3	-173.8	-66.7	-172.6	0	0	0	113.2	L629 I650 N651 F665 I667 L1137 F1139 L1179	L629-I631 HydrophobicContact CG-CG1 4.26Å; I631-I650 HydrophobicContact CG2-CG2 4.3Å; I631-N651 PolarHBondContact O-N 2.99Å; I631-F665 PolarHBondContact N-O 3.12Å; I631-I667 HydrophobicContact CD1-CD1 3.37Å; I631-I667 HydrophobicContact CD1-CG1 3.79Å; I631-L1137 HydrophobicContact CB-CD2 4.3Å; I631-L1137 HydrophobicContact CG1-CD2 3.92Å; I631-F1139 HydrophobicContact CD1-CB 4.35Å; I631-L1179 HydrophobicContact CG2-CD1 4.01Å
632	A	93.8	Very high	79.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	167	-173.9	0	0	0	0	0	112.3	I648 L649 I650 F665 L1063	A632-I648 HydrophobicContact CB-CG2 3.99Å; A632-L649 CarbonylContact C-O 3.6Å; A632-L649 WeakPolarHBondContact CA-O 3.46Å; A632-L649 WeakPolarHBondContact CB-O 3.27Å; A632-I650 HydrophobicContact CB-CG1 4.14Å; A632-F665 HydrophobicContact CB-CB 4.04Å; A632-F665 HydrophobicContact CB-CD2 3.93Å; A632-F665 HydrophobicContact CB-CG 4.18Å; A632-F665 PolarHBondContact O-N 2.86Å; A632-L1063 HydrophobicContact CB-CD1 3.92Å; A632-L1063 HydrophobicContact CB-CD2 4.46Å
633	I	93.1	Very high	76.9	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	150.6	174.8	51.1	166.2	0	0	0	112.8	L606 F615 M630 Y635 I648 L649 P652 L656 I658 T662 L663	L606-I633 HydrophobicContact CD1-CG2 4.34Å; F615-I633 HydrophobicContact CD2-CD1 4.21Å; F615-I633 HydrophobicContact CD2-CG1 4.23Å; F615-I633 HydrophobicContact CD2-CG2 3.98Å; F615-I633 HydrophobicContact CE2-CG1 4.48Å; F615-I633 HydrophobicContact CE2-CG2 4.01Å; M630-I633 HydrophobicContact SD-CG2 4.26Å; I633-Y635 PolarHBondContact O-N 3.45Å; I633-I648 WeakPolarHBondContact O-CA 3.34Å; I633-L649 HydrophobicContact CG1-CB 4.49Å; I633-L649 PolarHBondContact N-O 3.19Å; I633-L649 PolarHBondContact O-N 2.7Å; I633-P652 HydrophobicContact CD1-CG 3.82Å; I633-P652 HydrophobicContact CG1-CG 3.89Å; I633-L656 HydrophobicContact CD1-CD2 3.55Å; I633-I658 HydrophobicContact CD1-CD1 3.82Å; I633-I658 HydrophobicContact CG2-CD1 4.25Å; I633-T662 HydrophobicContact CB-CG2 3.69Å; I633-T662 HydrophobicContact CG2-CG2 3.73Å; I633-L663 CarbonylContact C-O 3.55Å; I633-L663 WeakPolarHBondContact CA-O 3.29Å
634	E	89.8	Confident	74.4	Confident	2 Å²	2	62 Å²	62	1%	0.009	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	108.5	166.6	-175.9	-160.3	-167.6	0	0	110.2	K636 K646 L663	E634-K636 VanDerWaalsContact CD-NZ 3.29Å; E634-K636 WeakPolarHBondContact OE1-CE 3.45Å; E634-K636 IonicContact OE1-NZ 2.72Å; E634-K636 PolarHBondContact OE1-NZ 3.15Å; E634-K636 WeakPolarHBondContact OE2-CE 3.27Å; E634-K636 IonicContact OE2-NZ 2.84Å; E634-K636 PolarHBondContact OE2-NZ 2.98Å; E634-K646 HydrophobicContact CG-CB 4.38Å; E634-K646 WeakPolarHBondContact OE1-CD 3.48Å; E634-K646 WeakPolarHBondContact OE1-CE 3.33Å; E634-K646 WeakPolarHBondContact OE1-CG 3.5Å; E634-K646 IonicContact OE1-NZ 3.09Å; E634-K646 PolarHBondContact OE1-NZ 3.01Å; E634-L663 HydrophobicContact CB-CB 3.76Å; E634-L663 PolarHBondContact N-O 3.45Å; E634-L663 WeakPolarHBondContact OE2-CB 3.38Å
635	Y	82.2	Confident	72.8	Confident	77 Å²	77	65 Å²	65	30%	0.302	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.4	174.6	-169.6	-105.2	0	0	0	112.2	I633 R647 L649 L656 Q659	I633-Y635 PolarHBondContact O-N 3.45Å; Y635-R647 PolarHBondContact N-O 2.69Å; Y635-R647 PolarHBondContact O-N 3.09Å; Y635-R647 VanDerWaalsContact O-N 3.08Å; Y635-L649 HydrophobicContact CD1-CD1 4.34Å; Y635-L649 HydrophobicContact CD2-CD1 4.46Å; Y635-L649 HydrophobicContact CG-CD1 3.9Å; Y635-L656 HydrophobicContact CD2-CD1 3.89Å; Y635-L656 HydrophobicContact CD2-CD2 4.34Å; Y635-L656 HydrophobicContact CD2-CG 4.37Å; Y635-L656 HydrophobicContact CE2-CD1 4.05Å; Y635-L656 HydrophobicContact CE2-CD2 4.49Å; Y635-L656 HydrophobicContact CE2-CG 4.24Å; Y635-L656 HydrophobicContact CG-CD1 4.47Å; Y635-Q659 VanDerWaalsContact CE2-NE2 3.28Å
636	K	76.2	Confident	71.7	Confident	68 Å²	68	68.2 Å²	68.2	30%	0.296	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	115.3	-179.4	-72.8	159.7	-175.3	155.3	0	108.9	E634 Q659 G661	E634-K636 VanDerWaalsContact CD-NZ 3.29Å; E634-K636 WeakPolarHBondContact OE1-CE 3.45Å; E634-K636 IonicContact OE1-NZ 2.72Å; E634-K636 PolarHBondContact OE1-NZ 3.15Å; E634-K636 WeakPolarHBondContact OE2-CE 3.27Å; E634-K636 IonicContact OE2-NZ 2.84Å; E634-K636 PolarHBondContact OE2-NZ 2.98Å; K636-Q659 PolarHBondContact O-NE2 2.88Å; K636-G661 PolarHBondContact NZ-O 3.27Å
637	S	62	Low	71	Confident	40 Å²	40	73.3 Å²	73.3	28%	0.28	34%	0.344	S	S	.	.			trans	-74.9	140.4	-179	-175.3	0	0	0	0	112.1
638	A	53.3	Low	70.7	Confident	72 Å²	72	68.4 Å²	68.4	60%	0.595	32%	0.323	S	S	*	.			trans	-75.9	-27.9	-177.9	0	0	0	0	0	113.7	R643	A638-R643 PolarHBondContact O-NE 3.08Å; A638-R643 VanDerWaalsContact O-NE 3.1Å; A638-R643 PolarHBondContact O-NH2 2.87Å
639	N	50	Low	70.4	Confident	105 Å²	105	71 Å²	71	56%	0.561	34%	0.337	S	S	*	.	S	Bend	trans	-59.6	135	-173.3	-74	6	0	0	0	111.8	E641 S642 R643	N639-E641 VanDerWaalsContact C-N 3.3Å; N639-E641 PolarHBondContact O-N 2.82Å; N639-S642 PolarHBondContact O-N 2.88Å; N639-R643 WeakPolarHBondContact O-CG 3.19Å; N639-R643 PolarHBondContact O-N 3.16Å
640	R	45.4	Very low	70.2	Confident	199 Å²	199	72.3 Å²	72.3	75%	0.751	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-43	-173.3	-97	-178.7	163.1	-170.7	-8.4	112.8
641	E	42.6	Very low	70.1	Confident	182 Å²	182	72.3 Å²	72.3	85%	0.85	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-36	178.8	-63.2	165.7	154.3	0	0	112.5	N639 R643	N639-E641 VanDerWaalsContact C-N 3.3Å; N639-E641 PolarHBondContact O-N 2.82Å; E641-R643 PolarHBondContact O-N 2.93Å
642	S	43.1	Very low	70	Confident	42 Å²	42	71.8 Å²	71.8	29%	0.294	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-81.4	-8.7	-176.6	-41.3	0	0	0	0	114.5	N639 S644 R645	N639-S642 PolarHBondContact O-N 2.88Å; S642-S644 PolarHBondContact O-N 3.07Å; S642-R645 PolarHBondContact O-N 3.24Å
643	R	39.4	Very low	69.6	Low	156 Å²	156	72.1 Å²	72.1	59%	0.589	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-57.2	-17.3	178.8	-84.1	171.3	-169.9	-174.3	1.3	114.9	A638 N639 E641	A638-R643 PolarHBondContact O-NE 3.08Å; A638-R643 VanDerWaalsContact O-NE 3.1Å; A638-R643 PolarHBondContact O-NH2 2.87Å; N639-R643 WeakPolarHBondContact O-CG 3.19Å; N639-R643 PolarHBondContact O-N 3.16Å; E641-R643 PolarHBondContact O-N 2.93Å
644	S	42.1	Very low	69.4	Low	79 Å²	79	76.4 Å²	76.4	55%	0.552	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-82.5	-11.3	176.1	-164.7	0	0	0	0	113.7	K543 S642	K543-S644 PolarHBondContact NZ-OG 3.26Å; S642-S644 PolarHBondContact O-N 3.07Å
645	R	57.3	Low	69.2	Low	128 Å²	128	82.3 Å²	82.3	48%	0.483	40%	0.395	S	S	.	.			trans	-110.3	103.1	179.8	-66.1	-173.1	-173.9	160.2	5.3	110.9	S642 E1075	S642-R645 PolarHBondContact O-N 3.24Å; R645-E1075 IonicContact CZ-OE1 3.38Å; R645-E1075 IonicContact CZ-OE2 3.5Å; R645-E1075 IonicContact NE-OE1 2.69Å; R645-E1075 IonicContact NH1-OE1 3.83Å; R645-E1075 PolarHBondContact NH1-OE1 2.89Å; R645-E1075 IonicContact NH1-OE2 2.73Å; R645-E1075 PolarHBondContact NH1-OE2 3.28Å
646	K	68.4	Low	69.4	Low	130 Å²	130	79.4 Å²	79.4	57%	0.565	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	142.1	155.3	-59.7	171.4	166.5	-136.6	0	108	E634	E634-K646 HydrophobicContact CG-CB 4.38Å; E634-K646 WeakPolarHBondContact OE1-CD 3.48Å; E634-K646 WeakPolarHBondContact OE1-CE 3.33Å; E634-K646 WeakPolarHBondContact OE1-CG 3.5Å; E634-K646 IonicContact OE1-NZ 3.09Å; E634-K646 PolarHBondContact OE1-NZ 3.01Å
647	R	77.3	Confident	70.1	Confident	109 Å²	109	80.7 Å²	80.7	41%	0.411	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	130.9	169.5	-72.8	-174.7	171	-174.5	-5.1	109.4	Y635 E1075	Y635-R647 PolarHBondContact N-O 2.69Å; Y635-R647 PolarHBondContact O-N 3.09Å; Y635-R647 VanDerWaalsContact O-N 3.08Å; R647-E1075 IonicContact CZ-OE1 3.64Å; R647-E1075 IonicContact NH2-OE1 3.78Å; R647-E1075 PolarHBondContact NH2-OE1 2.9Å; R647-E1075 IonicContact NH2-OE2 3.38Å
648	I	87.8	Confident	71.5	Confident	24 Å²	24	79 Å²	79	12%	0.123	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	127.8	169.7	-58.5	-179.4	0	0	0	107.3	A632 I633 F665 T1062 L1063	A632-I648 HydrophobicContact CB-CG2 3.99Å; I633-I648 WeakPolarHBondContact O-CA 3.34Å; I648-F665 HydrophobicContact CD1-CE1 4.16Å; I648-F665 HydrophobicContact CD1-CE2 4.27Å; I648-F665 HydrophobicContact CD1-CZ 3.58Å; I648-F665 HydrophobicContact CG1-CE2 4.21Å; I648-F665 HydrophobicContact CG1-CZ 3.96Å; I648-F665 HydrophobicContact CG2-CE2 4.03Å; I648-F665 HydrophobicContact CG2-CZ 4.29Å; I648-T1062 HydrophobicContact CD1-CG2 3.65Å; I648-T1062 HydrophobicContact CG1-CG2 4.42Å; I648-L1063 HydrophobicContact CD1-CB 4.12Å; I648-L1063 HydrophobicContact CG2-CD1 3.94Å
649	L	88.6	Confident	73.3	Confident	55 Å²	55	78.8 Å²	78.8	29%	0.288	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120.8	175.4	-60.9	-180	0	0	0	109.1	A632 I633 Y635 P652 L656	A632-L649 CarbonylContact C-O 3.6Å; A632-L649 WeakPolarHBondContact CA-O 3.46Å; A632-L649 WeakPolarHBondContact CB-O 3.27Å; I633-L649 HydrophobicContact CG1-CB 4.49Å; I633-L649 PolarHBondContact N-O 3.19Å; I633-L649 PolarHBondContact O-N 2.7Å; Y635-L649 HydrophobicContact CD1-CD1 4.34Å; Y635-L649 HydrophobicContact CD2-CD1 4.46Å; Y635-L649 HydrophobicContact CG-CD1 3.9Å; L649-P652 HydrophobicContact CB-CB 4.28Å; L649-P652 HydrophobicContact CB-CG 4.23Å; L649-L656 HydrophobicContact CD1-CD1 3.49Å; L649-L656 VanDerWaalsContact CD1-CD1 3.49Å
650	I	91.9	Very high	75.1	Confident	27 Å²	27	80.2 Å²	80.2	14%	0.138	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	124.4	-179.4	-61.5	170.3	0	0	0	108.3	I631 A632 L1063 T1066 L1067 L1179	I631-I650 HydrophobicContact CG2-CG2 4.3Å; A632-I650 HydrophobicContact CB-CG1 4.14Å; I650-L1063 HydrophobicContact CD1-CD1 3.82Å; I650-L1063 HydrophobicContact CG1-CD1 3.68Å; I650-T1066 HydrophobicContact CD1-CG2 3.87Å; I650-L1067 HydrophobicContact CD1-CB 3.8Å; I650-L1067 HydrophobicContact CD1-CD1 4.18Å; I650-L1179 HydrophobicContact CG2-CD1 3.63Å; I650-L1179 HydrophobicContact CG2-CD2 4.2Å
651	N	93.9	Very high	77	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	35%	0.349	C	S	.	.	S	Bend	trans	38.5	60	-175.4	-175.6	31.7	0	0	0	114.9	F615 I631 C1102 N1135 L1137 L1179 Q1181	F615-N651 HydrophobicContact CE1-CB 4.3Å; F615-N651 WeakPolarHBondContact CE1-OD1 3.37Å; I631-N651 PolarHBondContact O-N 2.99Å; N651-C1102 PolarHBondContact ND2-SG 2.85Å; N651-C1102 PolarHBondContact O-SG 3.21Å; N651-C1102 VanDerWaalsContact O-SG 3.4Å; N651-N1135 PolarHBondContact ND2-O 3.33Å; N651-L1137 HydrophobicContact CB-CB 4.33Å; N651-L1137 PolarHBondContact ND2-N 3.31Å; N651-L1179 HydrophobicContact CB-CB 4.11Å; N651-L1179 HydrophobicContact CB-CD1 3.91Å; N651-L1179 PolarHBondContact ND2-O 3Å; N651-L1179 VanDerWaalsContact ND2-O 3.11Å; N651-Q1181 PolarHBondContact ND2-NE2 2.88Å; N651-Q1181 PolarHBondContact O-NE2 3.18Å
652	P	91.3	Very high	79.4	Confident	12 Å²	12	63.8 Å²	63.8	8%	0.078	31%	0.309	C	S	.	.			trans	-68	140.3	178.7	27	-33	0	0	0	112.5	F615 I633 L649 L656	F615-P652 HydrophobicContact CB-CG 3.99Å; F615-P652 HydrophobicContact CD1-CG 4.11Å; F615-P652 VanDerWaalsContact CD1-O 3.28Å; F615-P652 WeakPolarHBondContact CD1-O 3.22Å; F615-P652 HydrophobicContact CD2-CG 3.79Å; F615-P652 HydrophobicContact CE2-CG 4.3Å; F615-P652 HydrophobicContact CG-CG 3.69Å; I633-P652 HydrophobicContact CD1-CG 3.82Å; I633-P652 HydrophobicContact CG1-CG 3.89Å; L649-P652 HydrophobicContact CB-CB 4.28Å; L649-P652 HydrophobicContact CB-CG 4.23Å; P652-L656 HydrophobicContact CB-CB 4.31Å; P652-L656 HydrophobicContact CB-CD1 3.97Å; P652-L656 HydrophobicContact CG-CD1 4.49Å
653	G	86.3	Confident	81.7	Confident	7 Å²	7	62.1 Å²	62.1	7%	0.072	30%	0.297	C	S	.	.			trans	-64.4	169	-176.2	0	0	0	0	0	115.6	H655 L656	G653-H655 PolarHBondContact O-N 3.04Å; G653-L656 PolarHBondContact O-N 2.74Å
654	N	87.8	Confident	84.3	Confident	90 Å²	90	54.7 Å²	54.7	48%	0.481	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-18.6	-176.7	65.6	10.7	0	0	0	115.9	P616 L656 K657	P616-N654 HydrophobicContact CG-CB 4.48Å; N654-L656 VanDerWaalsContact C-N 3.3Å; N654-L656 PolarHBondContact O-N 2.77Å; N654-K657 PolarHBondContact O-NZ 3.45Å
655	H	85.4	Confident	86.8	Confident	126 Å²	126	51 Å²	51	58%	0.583	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-30.9	176	67.8	-111.4	0	0	0	112.3	G653 D1100	G653-H655 PolarHBondContact O-N 3.04Å; H655-D1100 IonicContact CE1-OD2 3.54Å
656	L	87.9	Confident	88.6	Confident	16 Å²	16	45 Å²	45	8%	0.084	22%	0.22	C	C	.	.			trans	-85.6	129.1	-177.9	-167.9	154	0	0	0	110.3	F615 I633 Y635 L649 P652 G653 N654	F615-L656 PolarHBondContact N-O 3.12Å; I633-L656 HydrophobicContact CD1-CD2 3.55Å; Y635-L656 HydrophobicContact CD2-CD1 3.89Å; Y635-L656 HydrophobicContact CD2-CD2 4.34Å; Y635-L656 HydrophobicContact CD2-CG 4.37Å; Y635-L656 HydrophobicContact CE2-CD1 4.05Å; Y635-L656 HydrophobicContact CE2-CD2 4.49Å; Y635-L656 HydrophobicContact CE2-CG 4.24Å; Y635-L656 HydrophobicContact CG-CD1 4.47Å; L649-L656 HydrophobicContact CD1-CD1 3.49Å; L649-L656 VanDerWaalsContact CD1-CD1 3.49Å; P652-L656 HydrophobicContact CB-CB 4.31Å; P652-L656 HydrophobicContact CB-CD1 3.97Å; P652-L656 HydrophobicContact CG-CD1 4.49Å; G653-L656 PolarHBondContact O-N 2.74Å; N654-L656 VanDerWaalsContact C-N 3.3Å; N654-L656 PolarHBondContact O-N 2.77Å
657	K	90.4	Very high	89.9	Confident	95 Å²	95	38.9 Å²	38.9	41%	0.413	19%	0.193	S	C	.	.	B	Isolated β-bridge	trans	-107.1	140.1	176.3	-54.5	-50.5	-175.2	-160.5	0	111.6	L613 S614 N654	L613-K657 CarbonylContact O-C 3.46Å; L613-K657 VanDerWaalsContact O-CA 3.29Å; L613-K657 WeakPolarHBondContact O-CA 3.45Å; S614-K657 PolarHBondContact OG-NZ 2.98Å; N654-K657 PolarHBondContact O-NZ 3.45Å
658	I	92.2	Very high	90.5	Very high	5 Å²	5	33.9 Å²	33.9	3%	0.026	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-65.5	133.3	-178.8	-59.6	-53	0	0	0	110.8	L606 G612 L613 F615 V618 I633	L606-I658 HydrophobicContact CD1-CD1 4.24Å; L606-I658 HydrophobicContact CD1-CG1 4.4Å; L606-I658 HydrophobicContact CD1-CG2 3.63Å; G612-I658 PolarHBondContact N-O 3.3Å; L613-I658 PolarHBondContact O-N 3.06Å; F615-I658 HydrophobicContact CB-CD1 4.36Å; F615-I658 HydrophobicContact CD2-CD1 4.47Å; V618-I658 HydrophobicContact CG2-CG1 4.01Å; I633-I658 HydrophobicContact CD1-CD1 3.82Å; I633-I658 HydrophobicContact CG2-CD1 4.25Å
659	Q	89.4	Confident	90.5	Very high	67 Å²	67	36.1 Å²	36.1	31%	0.313	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-95.8	161.1	178	-60	-175.3	17	0	0	111.6	Y635 K636 G661 T662	Y635-Q659 VanDerWaalsContact CE2-NE2 3.28Å; K636-Q659 PolarHBondContact O-NE2 2.88Å; Q659-G661 PolarHBondContact O-N 3.33Å; Q659-T662 PolarHBondContact O-N 2.97Å; Q659-T662 PolarHBondContact O-OG1 2.73Å
660	E	88.1	Confident	90.3	Very high	136 Å²	136	35.7 Å²	35.7	64%	0.636	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	124.8	171.6	-172.5	177.2	-164	0	0	110.2	V611	V611-E660 HydrophobicContact CG2-CB 4.13Å
661	G	86.9	Confident	89.8	Confident	33 Å²	33	35.2 Å²	35.2	34%	0.34	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	24.6	-176.7	0	0	0	0	0	114.7	K636 Q659	K636-G661 PolarHBondContact NZ-O 3.27Å; Q659-G661 PolarHBondContact O-N 3.33Å
662	T	91.4	Very high	89.4	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.012	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-70.4	130.3	161.7	-74.7	0	0	0	0	110.3	L606 I633 Q659	L606-T662 HydrophobicContact CD1-CG2 3.9Å; L606-T662 PolarHBondContact N-O 2.81Å; L606-T662 VanDerWaalsContact N-O 3.12Å; I633-T662 HydrophobicContact CB-CG2 3.69Å; I633-T662 HydrophobicContact CG2-CG2 3.73Å; Q659-T662 PolarHBondContact O-N 2.97Å; Q659-T662 PolarHBondContact O-OG1 2.73Å
663	L	92.3	Very high	89.2	Confident	8 Å²	8	42.2 Å²	42.2	4%	0.042	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	132.6	165.6	-169.3	76.5	0	0	0	108.8	Y605 I633 E634 F665	Y605-L663 HydrophobicContact CD1-CB 4.26Å; Y605-L663 HydrophobicContact CD1-CD1 4.02Å; Y605-L663 HydrophobicContact CD2-CD1 4.14Å; Y605-L663 HydrophobicContact CE1-CB 4.03Å; Y605-L663 HydrophobicContact CE1-CD1 3.91Å; Y605-L663 HydrophobicContact CE2-CD1 4.03Å; Y605-L663 HydrophobicContact CG-CD1 4.14Å; I633-L663 CarbonylContact C-O 3.55Å; I633-L663 WeakPolarHBondContact CA-O 3.29Å; E634-L663 HydrophobicContact CB-CB 3.76Å; E634-L663 PolarHBondContact N-O 3.45Å; E634-L663 WeakPolarHBondContact OE2-CB 3.38Å; L663-F665 HydrophobicContact CD2-CE2 4.46Å; L663-F665 HydrophobicContact CD2-CZ 4.28Å
664	G	94	Very high	89.4	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	148.1	170.9	0	0	0	0	0	111.2	T603 E604	T603-G664 WeakPolarHBondContact CA-O 3.25Å; E604-G664 PolarHBondContact N-O 3.28Å; E604-G664 PolarHBondContact O-N 3.28Å
665	F	94.9	Very high	89.5	Confident	1 Å²	1	41.5 Å²	41.5	0%	0.004	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	127.4	174.5	-63.6	-102.5	0	0	0	109	Y602 T603 M630 I631 A632 I648 L663 N1059 L1063	Y602-F665 WeakPolarHBondContact O-CA 3.38Å; T603-F665 HydrophobicContact CG2-CD1 3.57Å; T603-F665 HydrophobicContact CG2-CE1 3.68Å; T603-F665 HydrophobicContact CG2-CG 4.44Å; M630-F665 WeakPolarHBondContact CA-O 3.39Å; I631-F665 PolarHBondContact N-O 3.12Å; A632-F665 HydrophobicContact CB-CB 4.04Å; A632-F665 HydrophobicContact CB-CD2 3.93Å; A632-F665 HydrophobicContact CB-CG 4.18Å; A632-F665 PolarHBondContact O-N 2.86Å; I648-F665 HydrophobicContact CD1-CE1 4.16Å; I648-F665 HydrophobicContact CD1-CE2 4.27Å; I648-F665 HydrophobicContact CD1-CZ 3.58Å; I648-F665 HydrophobicContact CG1-CE2 4.21Å; I648-F665 HydrophobicContact CG1-CZ 3.96Å; I648-F665 HydrophobicContact CG2-CE2 4.03Å; I648-F665 HydrophobicContact CG2-CZ 4.29Å; L663-F665 HydrophobicContact CD2-CE2 4.46Å; L663-F665 HydrophobicContact CD2-CZ 4.28Å; F665-N1059 HydrophobicContact CE1-CB 3.6Å; F665-N1059 HydrophobicContact CZ-CB 3.76Å; F665-L1063 HydrophobicContact CB-CD2 3.77Å; F665-L1063 HydrophobicContact CD1-CB 4.24Å; F665-L1063 HydrophobicContact CD1-CD2 3.35Å; F665-L1063 HydrophobicContact CD1-CG 4.39Å; F665-L1063 HydrophobicContact CE1-CB 4.08Å; F665-L1063 HydrophobicContact CE1-CD2 4.06Å; F665-L1063 HydrophobicContact CG-CD2 3.7Å
666	F	94.6	Very high	89.7	Confident	1 Å²	1	36 Å²	36	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	149.4	-170.2	-61.8	-89.2	0	0	0	111.6	M601 Y602 E604 L606 C622 L628 L629 M630 V674 A677	M601-F666 WeakPolarHBondContact CA-O 3.19Å; Y602-F666 PolarHBondContact N-O 3.43Å; Y602-F666 PolarHBondContact O-N 3.15Å; E604-F666 HydrophobicContact CB-CE2 4.3Å; L606-F666 HydrophobicContact CD2-CE2 4.39Å; L606-F666 HydrophobicContact CD2-CZ 3.74Å; C622-F666 HydrophobicContact CB-CE1 4.47Å; L628-F666 HydrophobicContact CB-CD1 3.94Å; L628-F666 HydrophobicContact CB-CE1 4.35Å; L629-F666 CarbonylContact O-C 3.16Å; L629-F666 VanDerWaalsContact O-CA 3.27Å; L629-F666 WeakPolarHBondContact O-CA 3.49Å; M630-F666 HydrophobicContact CB-CD1 3.76Å; M630-F666 HydrophobicContact CB-CE1 3.63Å; M630-F666 HydrophobicContact CB-CZ 4.47Å; M630-F666 HydrophobicContact CG-CD1 4.11Å; M630-F666 HydrophobicContact CG-CE1 3.8Å; M630-F666 HydrophobicContact CG-CZ 4.16Å; M630-F666 HydrophobicContact SD-CE1 4.03Å; M630-F666 HydrophobicContact SD-CZ 3.98Å; F666-V674 HydrophobicContact CB-CG1 4.15Å; F666-V674 HydrophobicContact CD2-CG1 3.7Å; F666-V674 HydrophobicContact CE2-CG1 4.32Å; F666-V674 HydrophobicContact CG-CG1 4.03Å; F666-A677 HydrophobicContact CE1-CB 4.2Å; F666-A677 HydrophobicContact CE2-CB 4.12Å; F666-A677 HydrophobicContact CZ-CB 3.62Å
667	I	94.8	Very high	89.9	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.6	156.3	-60	179.1	0	0	0	108	L575 N599 E600 L629 I631 N1163	L575-I667 HydrophobicContact CD1-CD1 3.51Å; L575-I667 HydrophobicContact CD1-CG1 4.21Å; L575-I667 HydrophobicContact CD2-CD1 3.82Å; L575-I667 HydrophobicContact CD2-CG1 4.12Å; L575-I667 HydrophobicContact CD2-CG2 3.77Å; L575-I667 HydrophobicContact CG-CD1 4.34Å; N599-I667 HydrophobicContact CB-CG2 3.65Å; E600-I667 WeakPolarHBondContact O-CA 3.29Å; L629-I667 HydrophobicContact CB-CB 4.36Å; L629-I667 HydrophobicContact CD2-CB 4.38Å; L629-I667 HydrophobicContact CD2-CD1 4.26Å; L629-I667 PolarHBondContact N-O 3.06Å; L629-I667 PolarHBondContact O-N 2.9Å; I631-I667 HydrophobicContact CD1-CD1 3.37Å; I631-I667 HydrophobicContact CD1-CG1 3.79Å; I667-N1163 HydrophobicContact CG2-CB 3.74Å
668	A	91.2	Very high	90	Very high	4 Å²	4	34 Å²	34	3%	0.033	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	173.2	175.7	0	0	0	0	0	109.8	N599 E600 Y602 L628 V674	N599-A668 CarbonylContact C-O 3.48Å; N599-A668 WeakPolarHBondContact CA-O 3.29Å; E600-A668 PolarHBondContact N-O 3.18Å; E600-A668 PolarHBondContact O-N 3.36Å; Y602-A668 HydrophobicContact CD2-CB 4.29Å; Y602-A668 WeakPolarHBondContact CE2-O 3.38Å; L628-A668 HydrophobicContact CD2-CB 3.72Å; A668-V674 HydrophobicContact CB-CG2 3.55Å
669	S	87.5	Confident	90	Very high	72 Å²	72	36.7 Å²	36.7	50%	0.503	19%	0.189	S	C	.	.	S	Bend	trans	-104.4	7.6	-177.8	57	0	0	0	0	115.8	S598	S598-S669 VanDerWaalsContact O-CA 3.24Å; S598-S669 WeakPolarHBondContact O-CA 3.44Å; S598-S669 WeakPolarHBondContact O-CB 3.44Å
670	D	84	Confident	90	Very high	46 Å²	46	33.9 Å²	33.9	25%	0.246	18%	0.175	C	C	.	.			trans	-164.8	133.6	174.1	179.2	-5.4	0	0	0	109.4	K672 E673	D670-K672 PolarHBondContact O-N 3.01Å; D670-K672 VanDerWaalsContact O-N 3.08Å; D670-K672 WeakPolarHBondContact OD1-CB 3.14Å; D670-K672 VanDerWaalsContact OD1-CG 3.29Å; D670-K672 WeakPolarHBondContact OD1-CG 3.44Å; D670-K672 PolarHBondContact OD1-N 3.17Å; D670-K672 IonicContact OD1-NZ 2.61Å; D670-K672 PolarHBondContact OD1-NZ 2.82Å; D670-K672 WeakPolarHBondContact OD2-CD 3.49Å; D670-K672 IonicContact OD2-NZ 2.61Å; D670-E673 HydrophobicContact CB-CG 3.95Å; D670-E673 WeakPolarHBondContact O-CB 3.37Å; D670-E673 PolarHBondContact O-N 2.88Å
671	A	81.9	Confident	90.1	Very high	17 Å²	17	28.7 Å²	28.7	14%	0.14	15%	0.154	C	C	.	.	H	α-helix	trans	-49.4	-33.1	172.1	0	0	0	0	0	113.6	Y602 V674	Y602-A671 HydrophobicContact CD1-CB 4.08Å; Y602-A671 HydrophobicContact CE1-CB 3.57Å; Y602-A671 PolarHBondContact OH-N 2.81Å; A671-V674 PolarHBondContact O-N 2.96Å
672	K	84.3	Confident	90.1	Very high	107 Å²	107	33.3 Å²	33.3	47%	0.465	16%	0.164	S	C	.	.	H	α-helix	trans	-70.7	-35.1	-178.6	-59.3	163.4	-153.8	59.3	0	112	D434 D670 V674 K675	D434-K672 WeakPolarHBondContact OD1-CE 3.27Å; D434-K672 IonicContact OD1-NZ 3.36Å; D434-K672 PolarHBondContact OD1-NZ 2.71Å; D670-K672 PolarHBondContact O-N 3.01Å; D670-K672 VanDerWaalsContact O-N 3.08Å; D670-K672 WeakPolarHBondContact OD1-CB 3.14Å; D670-K672 VanDerWaalsContact OD1-CG 3.29Å; D670-K672 WeakPolarHBondContact OD1-CG 3.44Å; D670-K672 PolarHBondContact OD1-N 3.17Å; D670-K672 IonicContact OD1-NZ 2.61Å; D670-K672 PolarHBondContact OD1-NZ 2.82Å; D670-K672 WeakPolarHBondContact OD2-CD 3.49Å; D670-K672 IonicContact OD2-NZ 2.61Å; K672-V674 VanDerWaalsContact C-N 3.3Å; K672-V674 PolarHBondContact O-N 2.99Å; K672-K675 WeakPolarHBondContact O-CB 3.38Å; K672-K675 PolarHBondContact O-N 2.89Å
673	E	88.1	Confident	89.8	Confident	51 Å²	51	37.9 Å²	37.9	24%	0.238	20%	0.203	C	C	.	.	H	α-helix	trans	-65.8	-36.3	177.1	-66.1	-74.6	87.2	0	0	110.7	L628 D670 K675 R676	L628-E673 HydrophobicContact CD2-CB 4.37Å; D670-E673 HydrophobicContact CB-CG 3.95Å; D670-E673 WeakPolarHBondContact O-CB 3.37Å; D670-E673 PolarHBondContact O-N 2.88Å; E673-K675 VanDerWaalsContact C-N 3.33Å; E673-K675 PolarHBondContact O-N 3.03Å; E673-R676 VanDerWaalsContact CD-CZ 3.41Å; E673-R676 VanDerWaalsContact CD-NH2 3.3Å; E673-R676 WeakPolarHBondContact O-CB 3.45Å; E673-R676 VanDerWaalsContact O-CG 3.27Å; E673-R676 WeakPolarHBondContact O-CG 3.49Å; E673-R676 PolarHBondContact O-N 2.94Å; E673-R676 PolarHBondContact O-NE 3.35Å; E673-R676 VanDerWaalsContact O-NE 3.14Å; E673-R676 IonicContact OE1-CZ 3.59Å; E673-R676 IonicContact OE1-NH1 2.65Å; E673-R676 PolarHBondContact OE1-NH1 3.2Å; E673-R676 IonicContact OE1-NH2 2.66Å; E673-R676 IonicContact OE2-CZ 2.7Å; E673-R676 IonicContact OE2-NH1 2.61Å; E673-R676 PolarHBondContact OE2-NH1 3.24Å; E673-R676 IonicContact OE2-NH2 2.93Å; E673-R676 PolarHBondContact OE2-NH2 3.24Å
674	V	89.8	Confident	89.5	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.012	22%	0.218	C	C	.	.	H	α-helix	trans	-67.6	-30.6	179.5	-171.5	0	0	0	0	112.3	Y602 E604 L628 F666 A668 A671 K672 R676 A677	Y602-V674 HydrophobicContact CD2-CG2 3.84Å; Y602-V674 HydrophobicContact CG-CG2 3.88Å; E604-V674 HydrophobicContact CB-CG1 3.69Å; E604-V674 HydrophobicContact CG-CG1 4.36Å; L628-V674 HydrophobicContact CD2-CG2 4.17Å; F666-V674 HydrophobicContact CB-CG1 4.15Å; F666-V674 HydrophobicContact CD2-CG1 3.7Å; F666-V674 HydrophobicContact CE2-CG1 4.32Å; F666-V674 HydrophobicContact CG-CG1 4.03Å; A668-V674 HydrophobicContact CB-CG2 3.55Å; A671-V674 PolarHBondContact O-N 2.96Å; K672-V674 VanDerWaalsContact C-N 3.3Å; K672-V674 PolarHBondContact O-N 2.99Å; V674-R676 PolarHBondContact O-N 3.3Å; V674-A677 WeakPolarHBondContact O-CB 3.28Å; V674-A677 PolarHBondContact O-N 3.2Å
675	K	89.6	Confident	89.3	Confident	81 Å²	81	41 Å²	41	35%	0.352	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-22	176.5	-55.5	-60.6	163.9	-168.3	0	113.2	E604 K672 E673 A677 F678 F679	E604-K675 WeakPolarHBondContact OE2-CD 3.48Å; E604-K675 WeakPolarHBondContact OE2-CE 3.31Å; E604-K675 IonicContact OE2-NZ 3.12Å; E604-K675 PolarHBondContact OE2-NZ 3.49Å; K672-K675 WeakPolarHBondContact O-CB 3.38Å; K672-K675 PolarHBondContact O-N 2.89Å; E673-K675 VanDerWaalsContact C-N 3.33Å; E673-K675 PolarHBondContact O-N 3.03Å; K675-A677 PolarHBondContact O-N 3.13Å; K675-F678 PolarHBondContact O-N 3.12Å; K675-F679 HydrophobicContact CB-CD2 4.25Å; K675-F679 HydrophobicContact CB-CE2 3.86Å; K675-F679 WeakPolarHBondContact O-CD2 3.48Å; K675-F679 PolarHBondContact O-N 3.3Å
676	R	91.4	Very high	88.8	Confident	9 Å²	9	43.7 Å²	43.7	3%	0.034	24%	0.237	C	C	.	.	H	α-helix	trans	-58.4	-32.6	173.6	-63.2	-172.1	-67.9	-133	3.1	113.1	L626 E673 V674 F678 F679 Y680 P691 I694	L626-R676 HydrophobicContact CD2-CB 4.39Å; L626-R676 VanDerWaalsContact O-CZ 3.31Å; L626-R676 PolarHBondContact O-NE 3.31Å; L626-R676 PolarHBondContact O-NH2 2.79Å; E673-R676 VanDerWaalsContact CD-CZ 3.41Å; E673-R676 VanDerWaalsContact CD-NH2 3.3Å; E673-R676 WeakPolarHBondContact O-CB 3.45Å; E673-R676 VanDerWaalsContact O-CG 3.27Å; E673-R676 WeakPolarHBondContact O-CG 3.49Å; E673-R676 PolarHBondContact O-N 2.94Å; E673-R676 PolarHBondContact O-NE 3.35Å; E673-R676 VanDerWaalsContact O-NE 3.14Å; E673-R676 IonicContact OE1-CZ 3.59Å; E673-R676 IonicContact OE1-NH1 2.65Å; E673-R676 PolarHBondContact OE1-NH1 3.2Å; E673-R676 IonicContact OE1-NH2 2.66Å; E673-R676 IonicContact OE2-CZ 2.7Å; E673-R676 IonicContact OE2-NH1 2.61Å; E673-R676 PolarHBondContact OE2-NH1 3.24Å; E673-R676 IonicContact OE2-NH2 2.93Å; E673-R676 PolarHBondContact OE2-NH2 3.24Å; V674-R676 PolarHBondContact O-N 3.3Å; R676-F678 VanDerWaalsContact C-N 3.27Å; R676-F678 PolarHBondContact O-N 2.91Å; R676-F679 PolarHBondContact O-N 3.02Å; R676-Y680 WeakPolarHBondContact O-CB 3.47Å; R676-Y680 PolarHBondContact O-N 2.91Å; R676-P691 WeakPolarHBondContact CD-O 3.4Å; R676-I694 HydrophobicContact CB-CG2 4.27Å; R676-I694 HydrophobicContact CG-CB 4.35Å; R676-I694 HydrophobicContact CG-CG2 4.45Å
677	A	92.2	Very high	88.5	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.8	-32.1	177.5	0	0	0	0	0	113	S607 F610 L626 L628 F666 V674 K675	S607-A677 VanDerWaalsContact CB-O 3.28Å; S607-A677 WeakPolarHBondContact CB-O 3.48Å; S607-A677 PolarHBondContact N-O 3.36Å; F610-A677 WeakPolarHBondContact CE2-O 3.29Å; L626-A677 HydrophobicContact CD1-CB 4.4Å; L628-A677 HydrophobicContact CD1-CB 4.11Å; F666-A677 HydrophobicContact CE1-CB 4.2Å; F666-A677 HydrophobicContact CE2-CB 4.12Å; F666-A677 HydrophobicContact CZ-CB 3.62Å; V674-A677 WeakPolarHBondContact O-CB 3.28Å; V674-A677 PolarHBondContact O-N 3.2Å; K675-A677 PolarHBondContact O-N 3.13Å
678	F	92.1	Very high	88	Confident	69 Å²	69	52 Å²	52	30%	0.303	28%	0.282	S	S	.	.	H	α-helix	trans	-82.9	-32.6	174.9	-176.1	-114.3	0	0	0	112.8	E604 Y605 K675 R676	E604-F678 HydrophobicContact CG-CB 4.19Å; Y605-F678 WeakPolarHBondContact O-CA 3.49Å; Y605-F678 WeakPolarHBondContact O-CB 3.4Å; Y605-F678 WeakPolarHBondContact O-CD2 3.41Å; K675-F678 PolarHBondContact O-N 3.12Å; R676-F678 VanDerWaalsContact C-N 3.27Å; R676-F678 PolarHBondContact O-N 2.91Å
679	F	90.9	Very high	87.5	Confident	62 Å²	62	57.6 Å²	57.6	27%	0.272	32%	0.316	S	S	.	.	H	α-helix	trans	-86.4	-12.5	-179.8	-60.6	-35.1	0	0	0	114.8	K675 R676 C681 H685 K696	K675-F679 HydrophobicContact CB-CD2 4.25Å; K675-F679 HydrophobicContact CB-CE2 3.86Å; K675-F679 WeakPolarHBondContact O-CD2 3.48Å; K675-F679 PolarHBondContact O-N 3.3Å; R676-F679 PolarHBondContact O-N 3.02Å; F679-C681 PolarHBondContact O-N 2.73Å; F679-H685 PolarHBondContact O-CE1 3.42Å; F679-K696 HydrophobicContact CD1-CB 3.71Å; F679-K696 HydrophobicContact CD1-CG 3.93Å; F679-K696 HydrophobicContact CD2-CB 4.43Å; F679-K696 HydrophobicContact CE1-CB 3.78Å; F679-K696 HydrophobicContact CE1-CD 4.05Å; F679-K696 HydrophobicContact CE1-CG 3.92Å; F679-K696 HydrophobicContact CE2-CB 4.49Å; F679-K696 HydrophobicContact CG-CB 4.07Å; F679-K696 HydrophobicContact CZ-CB 4.19Å
680	Y	90.9	Very high	87.4	Confident	9 Å²	9	57.4 Å²	57.4	4%	0.035	31%	0.309	C	S	.	.			trans	-58	139.2	-179.5	-170.6	-109.2	0	0	0	112	S607 A609 F610 L626 R676 H685 D686 I694	S607-Y680 VanDerWaalsContact CB-O 3.25Å; S607-Y680 WeakPolarHBondContact CB-O 3.39Å; S607-Y680 PolarHBondContact OG-O 3.33Å; A609-Y680 HydrophobicContact CB-CD1 4.3Å; F610-Y680 AromaticContact CE1-CD1 3.71Å; F610-Y680 HydrophobicContact CE1-CD1 3.71Å; F610-Y680 HydrophobicContact CE1-CE1 4.13Å; F610-Y680 HydrophobicContact CE2-CD1 4.27Å; F610-Y680 AromaticContact CZ-CD1 3.48Å; F610-Y680 HydrophobicContact CZ-CD1 3.48Å; F610-Y680 VanDerWaalsContact CZ-CD1 3.48Å; F610-Y680 HydrophobicContact CZ-CE1 4.29Å; F610-Y680 AromaticContact CZ-CG 3.95Å; F610-Y680 HydrophobicContact CZ-CG 3.95Å; L626-Y680 HydrophobicContact CD2-CD2 3.73Å; L626-Y680 HydrophobicContact CD2-CE2 4.31Å; L626-Y680 HydrophobicContact CD2-CG 4.32Å; R676-Y680 WeakPolarHBondContact O-CB 3.47Å; R676-Y680 PolarHBondContact O-N 2.91Å; Y680-H685 HydrophobicContact CD2-CB 4.2Å; Y680-H685 HydrophobicContact CE2-CB 3.97Å; Y680-D686 PolarHBondContact OH-OD1 3.12Å; Y680-I694 HydrophobicContact CD2-CG2 4.39Å
681	C	89.9	Confident	87.5	Confident	26 Å²	26	55.9 Å²	55.9	18%	0.176	30%	0.302	C	S	.	.			trans	-154.6	114.7	-179.8	-179.8	0	0	0	0	108.7	F679 A683 C684 H685 C697 C699	F679-C681 PolarHBondContact O-N 2.73Å; C681-A683 PolarHBondContact O-N 3.21Å; C681-C684 HydrophobicContact CB-CB 4Å; C681-C684 CarbonylContact O-C 3.39Å; C681-C684 PolarHBondContact O-N 2.92Å; C681-H685 PolarHBondContact N-ND1 3.11Å; C681-H685 WeakPolarHBondContact O-CB 3.23Å; C681-H685 PolarHBondContact O-N 2.87Å; C681-C697 VanDerWaalsContact CB-SG 3.59Å; C681-C699 VanDerWaalsContact SG-SG 3.64Å
682	K	86.1	Confident	87.7	Confident	130 Å²	130	62 Å²	62	57%	0.565	33%	0.325	S	S	*	.	H	α-helix	trans	-51.5	-55.6	-170.9	-162.8	175.1	-179.6	172	0	112.7	C684 H685 D686	K682-C684 PolarHBondContact O-N 3.1Å; K682-H685 PolarHBondContact O-N 3.3Å; K682-D686 VanDerWaalsContact CE-CG 3.44Å; K682-D686 WeakPolarHBondContact CE-OD1 3.33Å; K682-D686 WeakPolarHBondContact CE-OD2 3.34Å; K682-D686 HydrophobicContact CG-CB 4.37Å; K682-D686 VanDerWaalsContact CG-CG 3.44Å; K682-D686 VanDerWaalsContact CG-OD1 3.27Å; K682-D686 WeakPolarHBondContact CG-OD1 3.38Å; K682-D686 WeakPolarHBondContact CG-OD2 3.42Å; K682-D686 IonicContact NZ-OD2 3.52Å; K682-D686 WeakPolarHBondContact O-CB 3.43Å; K682-D686 PolarHBondContact O-N 2.94Å
683	A	85.8	Confident	87.7	Confident	99 Å²	99	64.8 Å²	64.8	82%	0.818	33%	0.333	S	S	*	.	H	α-helix	trans	-66.5	-16.9	-179.5	0	0	0	0	0	115.1	C681	C681-A683 PolarHBondContact O-N 3.21Å
684	C	85.6	Confident	87.6	Confident	54 Å²	54	62.7 Å²	62.7	37%	0.365	32%	0.323	S	S	.	.	H	α-helix	trans	-100.6	-19.3	177.7	-89.6	0	0	0	0	112.2	C681 K682 C697 C699	C681-C684 HydrophobicContact CB-CB 4Å; C681-C684 CarbonylContact O-C 3.39Å; C681-C684 PolarHBondContact O-N 2.92Å; K682-C684 PolarHBondContact O-N 3.1Å; C684-C697 HydrophobicContact CB-CB 3.78Å; C684-C699 HydrophobicContact CB-CB 4.39Å; C684-C699 WeakPolarHBondContact CB-SG 3.3Å; C684-C699 WeakPolarHBondContact SG-CB 3.36Å; C684-C699 CovalentContact SG-SG 2.07Å; C684-C699 PolarHBondContact SG-SG 3.37Å
685	H	89	Confident	87.4	Confident	18 Å²	18	69.8 Å²	69.8	8%	0.083	35%	0.354	C	S	.	.	H	α-helix	trans	-139.8	0.8	-167	-55.8	144	0	0	0	117.2	F679 Y680 C681 K682 D687 V688 K695	F679-H685 PolarHBondContact O-CE1 3.42Å; Y680-H685 HydrophobicContact CD2-CB 4.2Å; Y680-H685 HydrophobicContact CE2-CB 3.97Å; C681-H685 PolarHBondContact N-ND1 3.11Å; C681-H685 WeakPolarHBondContact O-CB 3.23Å; C681-H685 PolarHBondContact O-N 2.87Å; K682-H685 PolarHBondContact O-N 3.3Å; H685-D687 VanDerWaalsContact C-N 3.33Å; H685-D687 PolarHBondContact O-N 3.29Å; H685-V688 HydrophobicContact CB-CG2 4.32Å; H685-V688 WeakPolarHBondContact O-CB 3.42Å; H685-V688 PolarHBondContact O-N 2.69Å; H685-V688 VanDerWaalsContact O-N 3.1Å; H685-K695 PolarHBondContact CE1-O 3.16Å; H685-K695 PolarHBondContact NE2-O 3.39Å
686	D	85.7	Confident	87	Confident	58 Å²	58	74 Å²	74	31%	0.31	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-43.6	-174.3	-122.5	11.3	0	0	0	113.3	K625 Y680 K682 V688	K625-D686 PolarHBondContact NZ-O 3.15Å; Y680-D686 PolarHBondContact OH-OD1 3.12Å; K682-D686 VanDerWaalsContact CE-CG 3.44Å; K682-D686 WeakPolarHBondContact CE-OD1 3.33Å; K682-D686 WeakPolarHBondContact CE-OD2 3.34Å; K682-D686 HydrophobicContact CG-CB 4.37Å; K682-D686 VanDerWaalsContact CG-CG 3.44Å; K682-D686 VanDerWaalsContact CG-OD1 3.27Å; K682-D686 WeakPolarHBondContact CG-OD1 3.38Å; K682-D686 WeakPolarHBondContact CG-OD2 3.42Å; K682-D686 IonicContact NZ-OD2 3.52Å; K682-D686 WeakPolarHBondContact O-CB 3.43Å; K682-D686 PolarHBondContact O-N 2.94Å; D686-V688 VanDerWaalsContact C-N 3.26Å; D686-V688 PolarHBondContact O-N 2.89Å
687	D	86.8	Confident	86.5	Confident	156 Å²	156	75.4 Å²	75.4	83%	0.834	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	2	-177	-54.6	-54.2	0	0	0	113.9	H685	H685-D687 VanDerWaalsContact C-N 3.33Å; H685-D687 PolarHBondContact O-N 3.29Å
688	V	85.3	Confident	85.6	Confident	21 Å²	21	79.2 Å²	79.2	13%	0.127	42%	0.422	C	S	.	.			trans	-77.1	130.9	-179.8	-179.8	0	0	0	0	110.1	K625 H685 D686 D690 R693 I694	K625-V688 PolarHBondContact NZ-O 3.36Å; H685-V688 HydrophobicContact CB-CG2 4.32Å; H685-V688 WeakPolarHBondContact O-CB 3.42Å; H685-V688 PolarHBondContact O-N 2.69Å; H685-V688 VanDerWaalsContact O-N 3.1Å; D686-V688 VanDerWaalsContact C-N 3.26Å; D686-V688 PolarHBondContact O-N 2.89Å; V688-D690 WeakPolarHBondContact CG1-O 3.37Å; V688-R693 HydrophobicContact CG1-CB 3.95Å; V688-I694 HydrophobicContact CB-CG1 4.48Å; V688-I694 HydrophobicContact CG1-CG1 3.96Å
689	T	81.4	Confident	85	Confident	123 Å²	123	78.3 Å²	78.3	76%	0.755	42%	0.424	S	S	*	.			trans	-103	-42	178.3	50.2	0	0	0	0	112.8	P691	T689-P691 WeakPolarHBondContact O-CD 3.49Å
690	D	85.4	Confident	83.6	Confident	68 Å²	68	87.1 Å²	87.1	36%	0.364	46%	0.455	S	S	.	.	S	Bend	trans	-82.9	113.2	172.9	168.4	24.1	0	0	0	110.7	V688 K692 R693	V688-D690 WeakPolarHBondContact CG1-O 3.37Å; D690-K692 PolarHBondContact O-N 3.4Å; D690-K692 WeakPolarHBondContact OD1-CB 3.42Å; D690-K692 PolarHBondContact OD1-N 2.99Å; D690-R693 HydrophobicContact CB-CG 4.33Å; D690-R693 WeakPolarHBondContact O-CB 3.28Å; D690-R693 PolarHBondContact O-N 2.8Å; D690-R693 VanDerWaalsContact O-N 3.14Å
691	P	84.5	Confident	82	Confident	13 Å²	13	94.6 Å²	94.6	8%	0.084	48%	0.483	C	S	.	.	G	3₁₀ helix	trans	-67.1	-18.8	-177.4	31	-37.4	0	0	0	113	K627 R676 T689 R693 I694	K627-P691 HydrophobicContact CD-CG 4.39Å; K627-P691 HydrophobicContact CG-CG 4.41Å; R676-P691 WeakPolarHBondContact CD-O 3.4Å; T689-P691 WeakPolarHBondContact O-CD 3.49Å; P691-R693 PolarHBondContact O-N 3.1Å; P691-I694 HydrophobicContact CB-CD1 4.3Å; P691-I694 WeakPolarHBondContact O-CB 3.25Å; P691-I694 PolarHBondContact O-N 2.61Å
692	K	85.9	Confident	79.9	Confident	145 Å²	145	98.8 Å²	98.8	63%	0.63	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-67	-14.7	175.4	-62	-176	176.2	-176.7	0	113.1	D690 K695	D690-K692 PolarHBondContact O-N 3.4Å; D690-K692 WeakPolarHBondContact OD1-CB 3.42Å; D690-K692 PolarHBondContact OD1-N 2.99Å; K692-K695 WeakPolarHBondContact O-CE 3.42Å
693	R	85.5	Confident	77.5	Confident	167 Å²	167	102.4 Å²	102.4	63%	0.63	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-83.4	-12.8	172.2	-63.6	174.9	65.3	-169.3	-2.6	113.6	V688 D690 P691 K695	V688-R693 HydrophobicContact CG1-CB 3.95Å; D690-R693 HydrophobicContact CB-CG 4.33Å; D690-R693 WeakPolarHBondContact O-CB 3.28Å; D690-R693 PolarHBondContact O-N 2.8Å; D690-R693 VanDerWaalsContact O-N 3.14Å; P691-R693 PolarHBondContact O-N 3.1Å; R693-K695 PolarHBondContact O-N 3.04Å
694	I	85.6	Confident	75.2	Confident	7 Å²	7	103.5 Å²	103.5	4%	0.036	52%	0.515	C	S	.	.			trans	-78.2	88.5	-178.3	-57.3	177.8	0	0	0	109.4	L626 R676 Y680 V688 P691	L626-I694 HydrophobicContact CD2-CD1 3.5Å; L626-I694 VanDerWaalsContact CD2-CD1 3.5Å; L626-I694 HydrophobicContact CD2-CG2 4.44Å; R676-I694 HydrophobicContact CB-CG2 4.27Å; R676-I694 HydrophobicContact CG-CB 4.35Å; R676-I694 HydrophobicContact CG-CG2 4.45Å; Y680-I694 HydrophobicContact CD2-CG2 4.39Å; V688-I694 HydrophobicContact CB-CG1 4.48Å; V688-I694 HydrophobicContact CG1-CG1 3.96Å; P691-I694 HydrophobicContact CB-CD1 4.3Å; P691-I694 WeakPolarHBondContact O-CB 3.25Å; P691-I694 PolarHBondContact O-N 2.61Å
695	K	85	Confident	72.9	Confident	150 Å²	150	104.5 Å²	104.5	65%	0.652	52%	0.523	S	S	*	.			trans	-113.4	172.1	-179	-65.3	-174.8	178.3	-177.4	0	111.1	H685 K692 R693 C697	H685-K695 PolarHBondContact CE1-O 3.16Å; H685-K695 PolarHBondContact NE2-O 3.39Å; K692-K695 WeakPolarHBondContact O-CE 3.42Å; R693-K695 PolarHBondContact O-N 3.04Å; K695-C697 PolarHBondContact O-N 2.79Å
696	K	82.6	Confident	70.7	Confident	171 Å²	171	110 Å²	110	74%	0.743	55%	0.552	S	S	*	*			trans	-58.3	105.5	-179.3	-175.4	-179.4	176.8	-177.9	0	111.6	F679	F679-K696 HydrophobicContact CD1-CB 3.71Å; F679-K696 HydrophobicContact CD1-CG 3.93Å; F679-K696 HydrophobicContact CD2-CB 4.43Å; F679-K696 HydrophobicContact CE1-CB 3.78Å; F679-K696 HydrophobicContact CE1-CD 4.05Å; F679-K696 HydrophobicContact CE1-CG 3.92Å; F679-K696 HydrophobicContact CE2-CB 4.49Å; F679-K696 HydrophobicContact CG-CB 4.07Å; F679-K696 HydrophobicContact CZ-CB 4.19Å
697	C	79.6	Confident	68.5	Low	38 Å²	38	116.7 Å²	116.7	26%	0.257	57%	0.574	S	S	.	*			trans	-74.3	152.9	-175.9	60.2	0	0	0	0	114	C681 C684 K695 C699	C681-C697 VanDerWaalsContact CB-SG 3.59Å; C684-C697 HydrophobicContact CB-CB 3.78Å; K695-C697 PolarHBondContact O-N 2.79Å; C697-C699 VanDerWaalsContact C-N 3.27Å; C697-C699 HydrophobicContact CB-CB 4.32Å; C697-C699 PolarHBondContact O-N 3.16Å
698	G	74.5	Confident	66.2	Low	79 Å²	79	116.5 Å²	116.5	81%	0.814	57%	0.566	S	S	*	*			trans	-76	-7.2	171.1	0	0	0	0	0	115	R700	G698-R700 PolarHBondContact O-N 3.17Å
699	C	77.9	Confident	64	Low	51 Å²	51	125.8 Å²	125.8	35%	0.345	60%	0.598	S	S	.	*			trans	-50.2	109.9	175.2	-83.8	0	0	0	0	110.4	C681 C684 C697 R701	C681-C699 VanDerWaalsContact SG-SG 3.64Å; C684-C699 HydrophobicContact CB-CB 4.39Å; C684-C699 WeakPolarHBondContact CB-SG 3.3Å; C684-C699 WeakPolarHBondContact SG-CB 3.36Å; C684-C699 CovalentContact SG-SG 2.07Å; C684-C699 PolarHBondContact SG-SG 3.37Å; C697-C699 VanDerWaalsContact C-N 3.27Å; C697-C699 HydrophobicContact CB-CB 4.32Å; C697-C699 PolarHBondContact O-N 3.16Å; C699-R701 PolarHBondContact O-N 2.78Å
700	R	62.8	Low	61.7	Low	247 Å²	247	126.2 Å²	126.2	93%	0.932	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-63	126.3	-176.3	-78.5	-174.4	175.8	-178.3	0.5	111	G698	G698-R700 PolarHBondContact O-N 3.17Å
701	R	57.7	Low	59.2	Low	166 Å²	166	133.3 Å²	133.3	63%	0.626	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-55.6	132.6	167.9	-71.4	-175.1	176.8	-176	-3.4	110	C699 K703	C699-R701 PolarHBondContact O-N 2.78Å; R701-K703 PolarHBondContact O-N 2.79Å
702	P	44.4	Very low	57	Low	113 Å²	113	141.9 Å²	141.9	73%	0.734	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-63.2	119.4	176	25.7	-33	0	0	0	109.5	M704	P702-M704 PolarHBondContact O-N 3.18Å
703	K	36.5	Very low	54.6	Low	206 Å²	206	137.7 Å²	137.7	90%	0.896	64%	0.638	S	S	*	*			trans	-69.9	95.5	176.5	-75.3	-174.3	175.7	-177.6	0	109.7	R701 S705	R701-K703 PolarHBondContact O-N 2.79Å; K703-S705 PolarHBondContact O-N 3.16Å
704	M	37.1	Very low	52.3	Low	122 Å²	122	134.7 Å²	134.7	60%	0.601	64%	0.642	S	S	*	*			trans	-48.7	130.4	161.6	-173.4	80.3	70.3	0	0	108.6	P702 K708	P702-M704 PolarHBondContact O-N 3.18Å; M704-K708 HydrophobicContact SD-CD 4.41Å
705	S	37.7	Very low	50	Low	75 Å²	75	139.1 Å²	139.1	52%	0.524	67%	0.672	S	S	.	*			trans	-64.9	141.6	-163.1	61.9	0	0	0	0	113.6	K703 Y707 K708	K703-S705 PolarHBondContact O-N 3.16Å; S705-Y707 PolarHBondContact O-N 3.49Å; S705-K708 PolarHBondContact O-N 2.97Å
706	I	42.7	Very low	47.6	Very low	135 Å²	135	140.8 Å²	140.8	69%	0.692	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.3	-28.2	179.9	-68.1	168.7	0	0	0	111.9	K708 R709 M710	I706-K708 PolarHBondContact O-N 3.21Å; I706-K708 VanDerWaalsContact O-N 3.14Å; I706-R709 WeakPolarHBondContact O-CA 3.4Å; I706-R709 PolarHBondContact O-N 3.38Å; I706-M710 HydrophobicContact CG2-SD 4.42Å; I706-M710 PolarHBondContact O-N 2.98Å
707	Y	39.8	Very low	45.3	Very low	198 Å²	198	139.9 Å²	139.9	78%	0.776	68%	0.683	S	S	*	*	H	α-helix	trans	-46.2	-38.7	172	-123.8	-88.6	0	0	0	114.3	S705 R709 R711	S705-Y707 PolarHBondContact O-N 3.49Å; Y707-R709 VanDerWaalsContact C-N 3.35Å; Y707-R711 PolarHBondContact O-N 3.02Å
708	K	38.6	Very low	43.2	Very low	151 Å²	151	142.9 Å²	142.9	66%	0.657	70%	0.703	S	S	*	*	H	α-helix	trans	-76.4	-18.7	178.6	-110	180	-178.7	175.6	0	113.8	M704 S705 I706	M704-K708 HydrophobicContact SD-CD 4.41Å; S705-K708 PolarHBondContact O-N 2.97Å; I706-K708 PolarHBondContact O-N 3.21Å; I706-K708 VanDerWaalsContact O-N 3.14Å
709	R	39.2	Very low	41.6	Very low	217 Å²	217	142.9 Å²	142.9	82%	0.819	70%	0.703	S	S	*	*	H	α-helix	trans	-90.3	-42.7	177.4	-156.5	173	-169.3	165.8	2.9	111.3	I706 Y707 R711 R712	I706-R709 WeakPolarHBondContact O-CA 3.4Å; I706-R709 PolarHBondContact O-N 3.38Å; Y707-R709 VanDerWaalsContact C-N 3.35Å; R709-R711 VanDerWaalsContact C-N 3.31Å; R709-R711 PolarHBondContact O-N 3.34Å; R709-R712 PolarHBondContact O-N 3.26Å; R709-R712 VanDerWaalsContact O-N 3.11Å
710	M	33.8	Very low	39.4	Very low	131 Å²	131	151.9 Å²	151.9	65%	0.645	73%	0.73	S	S	*	*	H	α-helix	trans	-57.5	-40.4	175.3	-105.6	170.5	159.2	0	0	112.6	I706 R712 A713	I706-M710 HydrophobicContact CG2-SD 4.42Å; I706-M710 PolarHBondContact O-N 2.98Å; M710-R712 PolarHBondContact O-N 3.33Å; M710-A713 PolarHBondContact O-N 2.92Å
711	R	31.6	Very low	38.1	Very low	217 Å²	217	145.1 Å²	145.1	82%	0.819	72%	0.721	S	S	*	*	H	α-helix	trans	-67.4	4.7	177.5	-149.1	-175	-177.5	-170.2	1	115.1	Y707 R709	Y707-R711 PolarHBondContact O-N 3.02Å; R709-R711 VanDerWaalsContact C-N 3.31Å; R709-R711 PolarHBondContact O-N 3.34Å
712	R	39.4	Very low	37	Very low	193 Å²	193	145.5 Å²	145.5	73%	0.728	73%	0.73	S	S	*	*	H	α-helix	trans	-113.2	-15.9	166.9	-75.1	-169.6	178.3	-177.3	1.9	114	R709 M710	R709-R712 PolarHBondContact O-N 3.26Å; R709-R712 VanDerWaalsContact O-N 3.11Å; M710-R712 PolarHBondContact O-N 3.33Å
713	A	35.6	Very low	36.7	Very low	58 Å²	58	150.7 Å²	150.7	48%	0.479	73%	0.734	S	S	.	*	H	α-helix	trans	-77.6	-50.7	-179.9	0	0	0	0	0	111.3	M710 C715 F716	M710-A713 PolarHBondContact O-N 2.92Å; A713-C715 PolarHBondContact O-N 3.42Å; A713-F716 PolarHBondContact O-N 3.37Å; A713-F716 VanDerWaalsContact O-N 3.1Å
714	C	35.8	Very low	36.7	Very low	104 Å²	104	148.5 Å²	148.5	70%	0.703	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	3.6	-176.8	-56.5	0	0	0	0	115.6
715	C	37.2	Very low	36.4	Very low	100 Å²	100	148.1 Å²	148.1	68%	0.676	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	8.1	177.3	-56.6	0	0	0	0	112.9	A713	A713-C715 PolarHBondContact O-N 3.42Å
716	F	35.6	Very low	36.4	Very low	184 Å²	184	150 Å²	150	81%	0.807	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-29.5	178.2	-150.3	-100.2	0	0	0	113	A713	A713-F716 PolarHBondContact O-N 3.37Å; A713-F716 VanDerWaalsContact O-N 3.1Å
717	D	33.6	Very low	35.9	Very low	153 Å²	153	148.8 Å²	148.8	82%	0.818	76%	0.756	S	S	*	*	S	Bend	trans	-87.8	-11.7	179	-65.9	-43.4	0	0	0	114.4	G719	D717-G719 PolarHBondContact O-N 3.41Å
718	C	35.3	Very low	35.4	Very low	100 Å²	100	147.9 Å²	147.9	68%	0.676	76%	0.761	S	S	*	*			trans	-90.5	79.6	175.6	-81.5	0	0	0	0	111.9	R720	C718-R720 VanDerWaalsContact C-N 3.28Å; C718-R720 PolarHBondContact O-N 2.62Å
719	G	41.7	Very low	35.1	Very low	79 Å²	79	146.4 Å²	146.4	81%	0.814	77%	0.77	S	S	*	*			trans	-71.5	67.5	175.2	0	0	0	0	0	114.8	D717	D717-G719 PolarHBondContact O-N 3.41Å
720	R	32	Very low	34.6	Very low	241 Å²	241	139.4 Å²	139.4	91%	0.909	77%	0.765	S	S	*	*	S	Bend	trans	-158.9	168.5	163.7	-108.7	160	-164.4	-158.7	2.2	112	C718	C718-R720 VanDerWaalsContact C-N 3.28Å; C718-R720 PolarHBondContact O-N 2.62Å
721	S	34.3	Very low	34.7	Very low	105 Å²	105	145.2 Å²	145.2	73%	0.734	78%	0.78	S	S	*	*			trans	-59.1	143.5	-164.7	50.9	0	0	0	0	116.2	R723	S721-R723 VanDerWaalsContact C-N 3.32Å; S721-R723 PolarHBondContact O-N 2.78Å
722	E	36.2	Very low	34.5	Very low	174 Å²	174	141.8 Å²	141.8	81%	0.813	78%	0.783	S	S	*	*	S	Bend	trans	-66.1	82.8	168.3	-73.5	-169.2	143	0	0	112.1
723	R	37.9	Very low	33.8	Very low	221 Å²	221	144.1 Å²	144.1	83%	0.834	79%	0.792	S	S	*	*	S	Bend	trans	-153.2	135.2	147.6	-122.1	173.3	-78.5	-168.1	-1.2	108.6	S721	S721-R723 VanDerWaalsContact C-N 3.32Å; S721-R723 PolarHBondContact O-N 2.78Å
724	D	35	Very low	33.4	Very low	160 Å²	160	144.6 Å²	144.6	86%	0.856	80%	0.802	S	S	*	*			trans	58.1	95.8	-179.6	-53.9	-32.2	0	0	0	117.5
725	C	31.7	Very low	32.8	Very low	114 Å²	114	147.3 Å²	147.3	77%	0.77	81%	0.81	S	S	*	*			trans	-143.4	113.3	157.9	-162.2	0	0	0	0	110.3
726	S	37.2	Very low	32.4	Very low	116 Å²	116	147.6 Å²	147.6	81%	0.811	81%	0.808	S	S	*	*			trans	-117.8	44.2	-164.7	47.4	0	0	0	0	113.4	M728	S726-M728 PolarHBondContact O-N 2.98Å
727	C	32.9	Very low	31.9	Very low	109 Å²	109	145.5 Å²	145.5	74%	0.736	81%	0.805	S	S	*	*			trans	-82.5	71.7	-173	46.5	0	0	0	0	115.3
728	M	29.2	Very low	31.6	Very low	179 Å²	179	143.9 Å²	143.9	88%	0.882	80%	0.801	S	S	*	*			trans	66.4	153.2	150.4	-77.5	-71.7	105.6	0	0	121.7	S726	S726-M728 PolarHBondContact O-N 2.98Å
729	S	32.3	Very low	31.1	Very low	120 Å²	120	146.3 Å²	146.3	84%	0.839	81%	0.807	S	S	*	*			trans	-122.4	141.7	176.1	179.2	0	0	0	0	109.4
730	G	28.5	Very low	30.3	Very low	70 Å²	70	148.6 Å²	148.6	72%	0.722	80%	0.796	S	S	*	*			trans	-161.9	128.3	-179.6	0	0	0	0	0	113.5
731	R	35.2	Very low	30	Very low	252 Å²	252	146.8 Å²	146.8	95%	0.951	79%	0.789	S	S	*	*			trans	-83.5	138.6	166.9	-80.7	175.9	163.8	176.3	-4.7	109.5
732	V	28.7	Very low	29.5	Very low	145 Å²	145	148 Å²	148	88%	0.879	79%	0.792	S	S	*	*			trans	-133.6	141	163.7	-177.7	0	0	0	0	109.9
733	R	25.1	Very low	29.1	Very low	243 Å²	243	148.9 Å²	148.9	92%	0.917	79%	0.794	S	S	*	*			trans	-106.1	139.3	171.8	-92.5	178.1	161.5	178.8	-5.9	109.5
734	G	25.6	Very low	29.2	Very low	67 Å²	67	143.4 Å²	143.4	69%	0.691	79%	0.787	S	S	*	*			trans	75.8	140.2	138.5	0	0	0	0	0	119.9
735	N	24.8	Very low	28.8	Very low	162 Å²	162	143 Å²	143	87%	0.866	78%	0.784	S	S	*	*			trans	62.6	156.7	150.7	-77.5	30.6	0	0	0	119.3
736	V	27.1	Very low	28.5	Very low	106 Å²	106	141.9 Å²	141.9	64%	0.642	78%	0.777	S	S	*	*			cis	-166.3	154.4	-32.9	116	0	0	0	0	107
737	D	26.9	Very low	28.1	Very low	139 Å²	139	141.4 Å²	141.4	74%	0.743	77%	0.774	S	S	*	*			trans	67.9	144.3	163.2	-68.4	-13.4	0	0	0	125.2
738	T	25.7	Very low	27.7	Very low	119 Å²	119	142.6 Å²	142.6	73%	0.73	78%	0.777	S	S	*	*			trans	5.1	148	154	58.2	0	0	0	0	121.1
739	L	25.9	Very low	27.6	Very low	152 Å²	152	138.4 Å²	138.4	80%	0.796	77%	0.766	S	S	*	*				-164.2	169.4	59.5	-155.4	69.7	0	0	0	113.7
740	E	24.7	Very low	27.3	Very low	127 Å²	127	138.6 Å²	138.6	59%	0.593	76%	0.762	S	S	*	*			trans	-49.3	175.9	-179.8	-48.8	-176.3	115.7	0	0	122
741	R	25.6	Very low	27.2	Very low	203 Å²	203	141.4 Å²	141.4	77%	0.766	76%	0.76	S	S	*	*			trans	72.4	148.5	154.6	-70	164.8	-149.3	-138.4	2.5	116.4
742	T	23.6	Very low	26.6	Very low	131 Å²	131	136 Å²	136	80%	0.804	75%	0.75	S	S	*	*			cis	-151.6	156.8	-0.5	-8.3	0	0	0	0	111.6
743	F	28	Very low	26.4	Very low	192 Å²	192	135 Å²	135	84%	0.842	75%	0.748	S	S	*	*			trans	-75.7	170.3	156.8	-77	-79.8	0	0	0	110.1
744	P	39.9	Very low	26.4	Very low	105 Å²	105	128.3 Å²	128.3	68%	0.682	74%	0.739	S	S	*	*			cis	-155.4	-176.8	32.6	45.8	-23.4	0	0	0	120.4
745	L	25.9	Very low	26.4	Very low	153 Å²	153	131.6 Å²	131.6	80%	0.801	75%	0.745	S	S	*	*			trans	58.9	105	139.5	-76.5	163.5	0	0	0	124.5
746	S	25.1	Very low	26.3	Very low	89 Å²	89	128.2 Å²	128.2	62%	0.622	73%	0.734	S	S	*	*				63.1	122.6	117.7	68.2	0	0	0	0	125.8
747	S	29.6	Very low	26.1	Very low	106 Å²	106	132.4 Å²	132.4	74%	0.741	74%	0.744	S	S	*	*				79.7	163.9	129.7	72.6	0	0	0	0	122.1
748	V	25.2	Very low	26	Very low	134 Å²	134	136.3 Å²	136.3	81%	0.812	75%	0.749	S	S	*	*			trans	77.3	147.6	175.1	-171.2	0	0	0	0	115.2
749	S	25.8	Very low	25.9	Very low	92 Å²	92	134.2 Å²	134.2	64%	0.643	74%	0.744	S	S	*	*				-169.8	164.4	-64	54	0	0	0	0	111.7
750	V	26.9	Very low	25.9	Very low	124 Å²	124	135.1 Å²	135.1	75%	0.752	74%	0.741	S	S	*	*			trans	62.3	143.1	162.2	-87.5	0	0	0	0	122.4
751	N	26.2	Very low	25.9	Very low	129 Å²	129	135.9 Å²	135.9	69%	0.69	75%	0.745	S	S	*	*			trans	64.7	151.6	155.2	-67.8	37	0	0	0	118.4
752	D	22.4	Very low	25.9	Very low	138 Å²	138	133.7 Å²	133.7	74%	0.738	75%	0.748	S	S	*	*			cis	-157.1	165.9	-7.6	-120.8	-28	0	0	0	112
753	C	24.6	Very low	26	Very low	125 Å²	125	134.2 Å²	134.2	85%	0.845	74%	0.742	S	S	*	*			trans	142.2	143.3	135.6	-161.5	0	0	0	0	114.3
754	S	24.2	Very low	26	Very low	102 Å²	102	132.2 Å²	132.2	71%	0.713	74%	0.735	S	S	*	*			trans	-132.7	145.4	-170.7	60.2	0	0	0	0	113.1
755	T	25.8	Very low	26	Very low	135 Å²	135	132.6 Å²	132.6	83%	0.828	74%	0.737	S	S	*	*			trans	-167.6	132.9	150.9	31.9	0	0	0	0	107.5
756	S	23.2	Very low	26.7	Very low	91 Å²	91	130 Å²	130	64%	0.636	73%	0.73	S	S	*	*			cis	105.7	99	17.5	75.8	0	0	0	0	114.8
757	F	22.3	Very low	26.8	Very low	195 Å²	195	131.5 Å²	131.5	86%	0.855	74%	0.735	S	S	*	*			trans	55.8	157.6	151.3	-69.3	-68.9	0	0	0	119.4
758	R	24.8	Very low	26.6	Very low	221 Å²	221	134.6 Å²	134.6	83%	0.834	74%	0.742	S	S	*	*			cis	-162.8	152	13	-138.7	176.3	-164.8	167.4	3	111.9
759	A	25	Very low	26.9	Very low	75 Å²	75	133 Å²	133	62%	0.62	74%	0.738	S	S	*	*			trans	63.3	169.5	146.3	0	0	0	0	0	119.5
760	F	25.2	Very low	27.6	Very low	170 Å²	170	133.8 Å²	133.8	75%	0.746	74%	0.74	S	S	*	*			cis	-148.5	158.2	9.9	-120.3	-58.7	0	0	0	113
761	E	25.1	Very low	27.6	Very low	144 Å²	144	137.1 Å²	137.1	67%	0.673	75%	0.745	S	S	*	*			trans	55.2	153.5	162.3	-91.2	102.1	-138.4	0	0	119.7
762	D	26	Very low	27.5	Very low	156 Å²	156	139.9 Å²	139.9	83%	0.834	75%	0.751	S	S	*	*			cis	-133.7	172.5	26.9	-146.8	-18.7	0	0	0	115
763	E	24.8	Very low	27.7	Very low	143 Å²	143	142.6 Å²	142.6	67%	0.668	76%	0.756	S	S	*	*			trans	-101.2	176.5	-166.1	-76	-154.1	113.6	0	0	114.9
764	Q	27.2	Very low	27.9	Very low	150 Å²	150	146.1 Å²	146.1	70%	0.701	76%	0.76	S	S	*	*			cis	-157.1	172.5	-1.8	-124.7	174	35.2	0	0	110.8
765	P	40.8	Very low	28	Very low	112 Å²	112	151.2 Å²	151.2	73%	0.727	76%	0.763	S	S	*	*			trans	-102.2	-147.4	175.5	39.4	-25.4	0	0	0	111.4
766	P	40.1	Very low	28.1	Very low	100 Å²	100	151.3 Å²	151.3	65%	0.649	76%	0.759	S	S	*	*			cis	-143.6	165.9	-7	41.9	-21.6	0	0	0	119.9
767	T	27.4	Very low	28.2	Very low	119 Å²	119	150.7 Å²	150.7	73%	0.73	77%	0.767	S	S	*	*			trans	63.2	141.7	142.3	51.7	0	0	0	0	126.5
768	L	26.7	Very low	28.3	Very low	171 Å²	171	144.7 Å²	144.7	90%	0.895	76%	0.76	S	S	*	*			trans	77.9	150.3	141.6	-76.5	164.3	0	0	0	122.5
769	S	31.5	Very low	28.5	Very low	102 Å²	102	142.2 Å²	142.2	71%	0.713	76%	0.76	S	S	*	*			trans	-115.4	162.5	-178.3	73.2	0	0	0	0	111.1
770	P	39.3	Very low	28.7	Very low	108 Å²	108	148.4 Å²	148.4	70%	0.701	77%	0.767	S	S	*	*				-160.7	155.7	89.8	39.8	-19.3	0	0	0	119.8
771	K	26.3	Very low	28.7	Very low	193 Å²	193	146.7 Å²	146.7	84%	0.839	77%	0.766	S	S	*	*			trans	63.6	137.9	141.6	-72.6	171.5	-179.4	167.5	0	123.4
772	K	26	Very low	28.8	Very low	188 Å²	188	145 Å²	145	82%	0.817	77%	0.77	S	S	*	*			trans	81.3	109.9	141.8	-82.3	178.4	176.3	177.4	0	122
773	K	26.1	Very low	29.5	Very low	194 Å²	194	143.5 Å²	143.5	84%	0.843	77%	0.769	S	S	*	*				68.8	101.6	113.2	-168.9	-166.8	-179.1	-173.4	0	119.6
774	Q	28.8	Very low	29.6	Very low	200 Å²	200	143.9 Å²	143.9	94%	0.935	78%	0.776	S	S	*	*			trans	-140.7	165.5	141.4	-137.1	169.7	3.2	0	0	111.4
775	R	26.8	Very low	29.4	Very low	208 Å²	208	143.1 Å²	143.1	79%	0.785	78%	0.781	S	S	*	*			trans	-159.4	152.2	-158.4	-171.3	-156.8	156.2	162.3	0.7	112.1
776	N	26.8	Very low	28.7	Very low	138 Å²	138	142.5 Å²	142.5	74%	0.738	78%	0.78	S	S	*	*			trans	75.6	150.6	172.1	-59	-21.8	0	0	0	116.1
777	G	26.1	Very low	28.5	Very low	77 Å²	77	144 Å²	144	79%	0.794	79%	0.79	S	S	*	*			cis	154.3	150.7	-12.5	0	0	0	0	0	116.1
778	G	24.7	Very low	28.3	Very low	70 Å²	70	147.3 Å²	147.3	72%	0.722	79%	0.794	S	S	*	*			trans	95.9	144.1	-179.8	0	0	0	0	0	112.9
779	M	27	Very low	28.3	Very low	169 Å²	169	146.6 Å²	146.6	83%	0.833	79%	0.79	S	S	*	*			cis	-162.3	173.6	6.2	-133	72.2	157.8	0	0	107.4
780	R	29.7	Very low	28.1	Very low	204 Å²	204	151 Å²	151	77%	0.77	80%	0.801	S	S	*	*			cis	-162.4	157.8	2.5	-154.8	166.1	-170.1	174.5	2.8	109.1
781	N	26.3	Very low	27.6	Very low	135 Å²	135	156 Å²	156	72%	0.722	81%	0.807	S	S	*	*			trans	17.6	140	159.5	-49.6	3.4	0	0	0	121
782	S	27.7	Very low	27.7	Very low	107 Å²	107	154.1 Å²	154.1	75%	0.748	80%	0.8	S	S	*	*				-175.8	-173.9	60.3	-52.3	0	0	0	0	111.3
783	P	39.8	Very low	27.7	Very low	126 Å²	126	151.8 Å²	151.8	82%	0.818	80%	0.797	S	S	*	*				-128.3	-179.7	-73.3	40.9	-24.4	0	0	0	114.9
784	N	25.8	Very low	28.4	Very low	151 Å²	151	147.6 Å²	147.6	81%	0.807	79%	0.789	S	S	*	*			trans	-79.7	156.1	171.4	-72.6	-29.1	0	0	0	113.5
785	T	23.7	Very low	28.7	Very low	134 Å²	134	145.5 Å²	145.5	82%	0.822	78%	0.784	S	S	*	*				177	136.8	114.8	33.1	0	0	0	0	115.8
786	S	26.5	Very low	28.8	Very low	99 Å²	99	143.7 Å²	143.7	69%	0.692	79%	0.789	S	S	*	*			trans	27	154.2	147.8	64.8	0	0	0	0	124
787	P	34.7	Very low	29.3	Very low	132 Å²	132	144.9 Å²	144.9	86%	0.857	79%	0.793	S	S	*	*				-126.6	168.7	111.8	37.4	-33.4	0	0	0	114.8
788	K	24.8	Very low	29.6	Very low	188 Å²	188	147 Å²	147	82%	0.817	79%	0.793	S	S	*	*			trans	-136.2	151.5	178.8	-104.9	-173.8	178	-179	0	110.6
789	L	26.2	Very low	29.7	Very low	156 Å²	156	146.3 Å²	146.3	82%	0.817	79%	0.786	S	S	*	*			trans	56.6	121.1	162.7	-91.8	73.2	0	0	0	118.8
790	M	27.3	Very low	30.2	Very low	193 Å²	193	144.8 Å²	144.8	95%	0.951	78%	0.782	S	S	*	*				-139.2	168.4	116.7	-81.6	-142.2	73.5	0	0	109.6
791	R	28.3	Very low	30.2	Very low	215 Å²	215	142.1 Å²	142.1	81%	0.811	78%	0.782	S	S	*	*			trans	-120.4	141.5	-175.3	-119.3	-179	171.6	174.1	-3.5	109
792	H	29	Very low	30.6	Very low	153 Å²	153	143.7 Å²	143.7	71%	0.708	79%	0.785	S	S	*	*			trans	49	121.4	159.3	-71	-67.6	0	0	0	120.3
793	D	26.3	Very low	31	Very low	139 Å²	139	144.2 Å²	144.2	74%	0.743	78%	0.779	S	S	*	*				41.9	152.2	114.3	-73.6	-52.9	0	0	0	121.9
794	P	40.1	Very low	30.7	Very low	105 Å²	105	145.3 Å²	145.3	68%	0.682	78%	0.778	S	S	*	*			cis	-138.2	-177.8	17.7	45.7	-30	0	0	0	116.6
795	L	35.7	Very low	31.1	Very low	156 Å²	156	144.1 Å²	144.1	82%	0.817	77%	0.772	S	S	*	*			trans	62.7	105.3	158.1	-61	-179.2	0	0	0	119.5
796	L	27.8	Very low	31.7	Very low	170 Å²	170	144.9 Å²	144.9	89%	0.89	77%	0.768	S	S	*	*				-166.4	131.9	125.6	-107.8	164.6	0	0	0	110.6
797	I	37.5	Very low	32.6	Very low	163 Å²	163	145 Å²	145	84%	0.836	76%	0.76	S	S	*	*			trans	-112.1	116.6	176.9	-61.5	171.7	0	0	0	108.8
798	P	33.6	Very low	33.4	Very low	121 Å²	121	142 Å²	142	79%	0.786	74%	0.743	S	S	*	*				-135	166.9	120.6	38.2	-28.8	0	0	0	110.9
799	G	26.6	Very low	35.3	Very low	57 Å²	57	138 Å²	138	59%	0.588	73%	0.73	S	S	*	*			cis	-174.8	158	-0.1	0	0	0	0	0	107.7	D801	G799-D801 VanDerWaalsContact C-N 3.26Å; G799-D801 PolarHBondContact O-N 2.95Å
800	N	37.1	Very low	37.7	Very low	137 Å²	137	134 Å²	134	73%	0.733	71%	0.712	S	S	*	*	S	Bend	trans	-78.6	14.5	-153.7	-154.4	72.6	0	0	0	117.1
801	D	30.6	Very low	40.4	Very low	147 Å²	147	128.6 Å²	128.6	79%	0.786	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	11.8	-160.6	-55	-36.4	0	0	0	115.5	G799	G799-D801 VanDerWaalsContact C-N 3.26Å; G799-D801 PolarHBondContact O-N 2.95Å
802	Q	33.8	Very low	43.2	Very low	168 Å²	168	122.1 Å²	122.1	79%	0.785	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.3	-7.9	-177.2	-68.3	-165.3	2.7	0	0	115.8
803	I	36.6	Very low	46.2	Very low	118 Å²	118	116.3 Å²	116.3	61%	0.605	63%	0.633	S	S	*	*	S	Bend	trans	-75.2	-45.2	-173.8	-62.6	176.2	0	0	0	111.5	N805 M806	I803-N805 PolarHBondContact O-N 3.05Å; I803-N805 VanDerWaalsContact O-N 3.15Å; I803-M806 PolarHBondContact O-N 2.82Å
804	D	33.4	Very low	49.3	Very low	150 Å²	150	109.7 Å²	109.7	80%	0.802	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-21.8	-175.7	-65.3	-17.3	0	0	0	113.9
805	N	33.7	Very low	51.6	Low	126 Å²	126	107 Å²	107	67%	0.674	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	-13.4	-177.4	-108.8	-31.8	0	0	0	114.3	I803 S808	I803-N805 PolarHBondContact O-N 3.05Å; I803-N805 VanDerWaalsContact O-N 3.15Å; N805-S808 PolarHBondContact O-OG 2.92Å
806	M	36.3	Very low	54	Low	150 Å²	150	100.5 Å²	100.5	74%	0.739	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-36.1	176.3	-83.5	-71.2	180	0	0	112.9	I803 S808 N809	I803-M806 PolarHBondContact O-N 2.82Å; M806-S808 PolarHBondContact O-N 2.91Å; M806-N809 PolarHBondContact O-N 3.36Å
807	D	44.5	Very low	56.9	Low	100 Å²	100	92.4 Å²	92.4	54%	0.535	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-75.5	-8.7	-171.1	-155.5	54.4	0	0	0	114.1	K812	D807-K812 VanDerWaalsContact CG-NZ 3.29Å; D807-K812 PolarHBondContact O-NZ 3.1Å; D807-K812 IonicContact OD1-NZ 2.64Å; D807-K812 IonicContact OD2-NZ 2.74Å; D807-K812 PolarHBondContact OD2-NZ 3.13Å
808	S	53.4	Low	59.4	Low	71 Å²	71	85.2 Å²	85.2	50%	0.497	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-74.5	-27.5	175.8	66.5	0	0	0	0	113.9	N805 M806 V810	N805-S808 PolarHBondContact O-OG 2.92Å; M806-S808 PolarHBondContact O-N 2.91Å; S808-V810 VanDerWaalsContact C-N 3.33Å
809	N	63.3	Low	62.3	Low	104 Å²	104	79.5 Å²	79.5	56%	0.556	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-83.5	-5.9	-177.9	-86.9	-54.8	0	0	0	113.9	M806 K811	M806-N809 PolarHBondContact O-N 3.36Å; N809-K811 PolarHBondContact O-N 3.02Å
810	V	77.9	Confident	65.5	Low	71 Å²	71	77.1 Å²	77.1	43%	0.43	41%	0.405	S	S	.	.	S	Bend	trans	-76.4	118.9	-178.4	-173.5	0	0	0	0	110.4	S808 K812	S808-V810 VanDerWaalsContact C-N 3.33Å; V810-K812 HydrophobicContact CB-CD 4.39Å; V810-K812 HydrophobicContact CB-CG 4.34Å; V810-K812 HydrophobicContact CG1-CD 4.49Å; V810-K812 HydrophobicContact CG1-CG 4.01Å; V810-K812 PolarHBondContact O-N 2.8Å
811	K	82.7	Confident	68.3	Low	79 Å²	79	72.6 Å²	72.6	34%	0.343	38%	0.378	S	S	.	.			trans	-67.3	97	172.5	-64.3	-170.6	167.6	-162.4	0	110.4	N809 W821 G1088 G1089 Y1090	N809-K811 PolarHBondContact O-N 3.02Å; K811-W821 HydrophobicContact CB-CE3 3.9Å; K811-W821 HydrophobicContact CB-CZ3 3.69Å; K811-W821 HydrophobicContact CD-CZ3 4.27Å; K811-G1088 WeakPolarHBondContact CD-O 3.31Å; K811-G1088 WeakPolarHBondContact CE-O 3.43Å; K811-G1088 PolarHBondContact NZ-O 3.37Å; K811-G1089 WeakPolarHBondContact CB-O 3.45Å; K811-G1089 WeakPolarHBondContact CG-O 3.43Å; K811-Y1090 HydrophobicContact CG-CD1 4.49Å; K811-Y1090 HydrophobicContact CG-CE1 4.38Å
812	K	87.3	Confident	71.2	Confident	79 Å²	79	66.7 Å²	66.7	34%	0.343	35%	0.348	S	S	.	.			trans	-98.2	-15	-178.1	-71.7	159.4	175.1	158.9	0	113.1	D807 V810 W821	D807-K812 VanDerWaalsContact CG-NZ 3.29Å; D807-K812 PolarHBondContact O-NZ 3.1Å; D807-K812 IonicContact OD1-NZ 2.64Å; D807-K812 IonicContact OD2-NZ 2.74Å; D807-K812 PolarHBondContact OD2-NZ 3.13Å; V810-K812 HydrophobicContact CB-CD 4.39Å; V810-K812 HydrophobicContact CB-CG 4.34Å; V810-K812 HydrophobicContact CG1-CD 4.49Å; V810-K812 HydrophobicContact CG1-CG 4.01Å; V810-K812 PolarHBondContact O-N 2.8Å; K812-W821 PolarHBondContact O-N 3.16Å
813	Y	91.6	Very high	73.9	Confident	31 Å²	31	61.7 Å²	61.7	12%	0.122	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	166.9	-177.3	-59.2	-74.7	0	0	0	111.8	F819 H820 W821 G1089 L1096 R1099	Y813-F819 WeakPolarHBondContact CA-O 3.44Å; Y813-H820 AromaticContact CE1-CE1 3.79Å; Y813-H820 AromaticContact CE1-ND1 3.84Å; Y813-W821 VanDerWaalsContact C-CB 3.41Å; Y813-G1089 PolarHBondContact O-N 3.1Å; Y813-L1096 HydrophobicContact CD2-CD2 4.33Å; Y813-L1096 HydrophobicContact CE2-CD2 3.9Å; Y813-R1099 VanDerWaalsContact OH-CZ 3.3Å; Y813-R1099 PolarHBondContact OH-NH1 3.42Å
814	D	91.2	Very high	76.6	Confident	1 Å²	1	60 Å²	60	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	173.2	170.7	83.5	-70.6	0	0	0	112.3	T816 G817 M818 F819 L1086 R1087	D814-T816 PolarHBondContact O-N 3.44Å; D814-T816 PolarHBondContact OD1-OG1 3.49Å; D814-T816 WeakPolarHBondContact OD2-CA 3.33Å; D814-T816 VanDerWaalsContact OD2-CB 3.3Å; D814-T816 WeakPolarHBondContact OD2-CB 3.22Å; D814-T816 PolarHBondContact OD2-N 3.46Å; D814-T816 PolarHBondContact OD2-OG1 2.88Å; D814-G817 PolarHBondContact O-N 3.4Å; D814-G817 WeakPolarHBondContact OD1-CA 3.32Å; D814-G817 PolarHBondContact OD1-N 2.8Å; D814-M818 PolarHBondContact OD1-N 3.23Å; D814-F819 PolarHBondContact N-O 3.45Å; D814-F819 PolarHBondContact OD1-N 3.3Å; D814-L1086 HydrophobicContact CB-CD2 4Å; D814-R1087 CarbonylContact C-O 3.54Å; D814-R1087 WeakPolarHBondContact CA-O 3.2Å
815	S	88.5	Confident	79.4	Confident	49 Å²	49	55.8 Å²	55.8	34%	0.343	31%	0.307	S	S	.	.	S	Bend	trans	-61.2	-26.1	179.6	54.4	0	0	0	0	114.6	L1079 R1087	S815-L1079 WeakPolarHBondContact OG-CD1 3.01Å; S815-R1087 PolarHBondContact N-O 3.45Å
816	T	87.4	Confident	82.3	Confident	19 Å²	19	55.8 Å²	55.8	12%	0.117	30%	0.302	C	S	.	.	S	Bend	trans	-90.9	-21.8	177.7	72.5	0	0	0	0	113.6	D814 M818 L1076 L1079 N1098	D814-T816 PolarHBondContact O-N 3.44Å; D814-T816 PolarHBondContact OD1-OG1 3.49Å; D814-T816 WeakPolarHBondContact OD2-CA 3.33Å; D814-T816 VanDerWaalsContact OD2-CB 3.3Å; D814-T816 WeakPolarHBondContact OD2-CB 3.22Å; D814-T816 PolarHBondContact OD2-N 3.46Å; D814-T816 PolarHBondContact OD2-OG1 2.88Å; T816-M818 WeakPolarHBondContact OG1-CB 3.44Å; T816-M818 VanDerWaalsContact OG1-CG 3.23Å; T816-M818 WeakPolarHBondContact OG1-CG 3.41Å; T816-M818 PolarHBondContact OG1-N 3.01Å; T816-L1076 HydrophobicContact CG2-CB 4.24Å; T816-L1076 HydrophobicContact CG2-CD1 4.16Å; T816-L1079 HydrophobicContact CG2-CD1 3.71Å; T816-N1098 PolarHBondContact O-ND2 3.24Å
817	G	88.8	Confident	85.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.273	C	S	.	.	S	Bend	trans	82.6	12.4	-175.7	0	0	0	0	0	114.5	D814 S871	D814-G817 PolarHBondContact O-N 3.4Å; D814-G817 WeakPolarHBondContact OD1-CA 3.32Å; D814-G817 PolarHBondContact OD1-N 2.8Å; G817-S871 VanDerWaalsContact O-CB 3.24Å; G817-S871 WeakPolarHBondContact O-CB 3.32Å; G817-S871 PolarHBondContact O-OG 3.24Å
818	M	89.8	Confident	87.5	Confident	12 Å²	12	51 Å²	51	6%	0.059	28%	0.276	C	S	.	.	S	Bend	trans	-87.9	-20.9	-177.5	-61.7	-61.6	-80.1	0	0	112.8	D814 T816 S871 G1071 T1073 N1098 R1101	D814-M818 PolarHBondContact OD1-N 3.23Å; T816-M818 WeakPolarHBondContact OG1-CB 3.44Å; T816-M818 VanDerWaalsContact OG1-CG 3.23Å; T816-M818 WeakPolarHBondContact OG1-CG 3.41Å; T816-M818 PolarHBondContact OG1-N 3.01Å; M818-S871 VanDerWaalsContact C-OG 3.26Å; M818-S871 WeakPolarHBondContact CA-OG 3.48Å; M818-S871 WeakPolarHBondContact O-CB 3.22Å; M818-S871 PolarHBondContact O-N 3.14Å; M818-S871 PolarHBondContact O-OG 3.06Å; M818-S871 VanDerWaalsContact O-OG 3.07Å; M818-G1071 WeakPolarHBondContact CE-O 3.3Å; M818-T1073 HydrophobicContact CE-CG2 4.2Å; M818-N1098 HydrophobicContact SD-CB 3.88Å; M818-R1101 VanDerWaalsContact CE-CZ 3.46Å; M818-R1101 PolarHBondContact O-NH2 3.48Å; M818-R1101 VanDerWaalsContact O-NH2 3.09Å
819	F	94.2	Very high	89.4	Confident	1 Å²	1	54.9 Å²	54.9	0%	0.004	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-137.9	149.8	-175.2	-61.2	-76.2	0	0	0	113.1	Y813 D814 M866 R869 A870 L1076 L1086	Y813-F819 WeakPolarHBondContact CA-O 3.44Å; D814-F819 PolarHBondContact N-O 3.45Å; D814-F819 PolarHBondContact OD1-N 3.3Å; F819-M866 HydrophobicContact CD1-CG 3.61Å; F819-M866 WeakPolarHBondContact CD1-O 3.46Å; F819-M866 HydrophobicContact CD2-CG 4.17Å; F819-M866 HydrophobicContact CD2-SD 4.3Å; F819-M866 HydrophobicContact CE1-CG 3.52Å; F819-M866 WeakPolarHBondContact CE1-O 3.44Å; F819-M866 HydrophobicContact CE1-SD 4.36Å; F819-M866 HydrophobicContact CE2-CG 4.07Å; F819-M866 HydrophobicContact CE2-SD 3.93Å; F819-M866 HydrophobicContact CG-CG 3.97Å; F819-M866 HydrophobicContact CZ-CG 3.76Å; F819-M866 HydrophobicContact CZ-SD 3.97Å; F819-R869 WeakPolarHBondContact CA-O 3.21Å; F819-A870 HydrophobicContact CD1-CB 4.22Å; F819-A870 HydrophobicContact CE1-CB 3.98Å; F819-L1076 HydrophobicContact CD2-CD2 3.9Å; F819-L1076 HydrophobicContact CE2-CD2 3.51Å; F819-L1086 HydrophobicContact CD2-CD2 4.41Å
820	H	94.1	Very high	90.9	Very high	6 Å²	6	50.2 Å²	50.2	3%	0.028	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-71.4	137.1	170.3	-73.3	-99	0	0	0	110.4	Y813 R869 A870 F873 Y875 L878 P901	Y813-H820 AromaticContact CE1-CE1 3.79Å; Y813-H820 AromaticContact CE1-ND1 3.84Å; H820-R869 PolarHBondContact CD2-O 2.91Å; H820-R869 PolarHBondContact N-O 3.38Å; H820-A870 PolarHBondContact CD2-O 2.83Å; H820-F873 PolarHBondContact CE1-O 3.35Å; H820-F873 PolarHBondContact NE2-O 2.88Å; H820-Y875 AromaticContact ND1-CD2 3.95Å; H820-L878 HydrophobicContact CB-CD1 4.25Å; H820-P901 HydrophobicContact CB-CG 4.01Å
821	W	94.6	Very high	91.7	Very high	42 Å²	42	48.6 Å²	48.6	16%	0.159	25%	0.247	C	C	.	.			trans	-132.3	145.9	-174.5	-175.9	93.9	0	0	0	111.1	K811 K812 Y813 N899 L1086 G1088	K811-W821 HydrophobicContact CB-CE3 3.9Å; K811-W821 HydrophobicContact CB-CZ3 3.69Å; K811-W821 HydrophobicContact CD-CZ3 4.27Å; K812-W821 PolarHBondContact O-N 3.16Å; Y813-W821 VanDerWaalsContact C-CB 3.41Å; W821-N899 WeakPolarHBondContact CZ2-ND2 3.42Å; W821-N899 PolarHBondContact NE1-ND2 3.15Å; W821-L1086 PolarHBondContact NE1-O 3.4Å; W821-G1088 VanDerWaalsContact CD2-CA 3.44Å
822	C	92.6	Very high	92.3	Very high	24 Å²	24	46.3 Å²	46.3	16%	0.162	24%	0.239	C	C	.	.			trans	-131.6	163.1	165.9	73	0	0	0	0	112.1	N899	C822-N899 PolarHBondContact N-O 2.84Å; C822-N899 PolarHBondContact O-ND2 3.13Å; C822-N899 VanDerWaalsContact SG-C 3.57Å; C822-N899 PolarHBondContact SG-O 3.19Å; C822-N899 VanDerWaalsContact SG-O 3.41Å
823	A	90.9	Very high	92.6	Very high	62 Å²	62	46 Å²	46	51%	0.512	24%	0.244	S	C	.	.			trans	-52.8	145	169.5	0	0	0	0	0	110.9	K825	A823-K825 PolarHBondContact O-N 3Å
824	P	92.1	Very high	92.7	Very high	84 Å²	84	50.3 Å²	50.3	55%	0.545	26%	0.26	S	S	.	.			trans	-61.5	134.2	-176.8	26.1	-34.7	0	0	0	111	H898	P824-H898 WeakPolarHBondContact CA-O 3.43Å
825	K	93.2	Very high	92.7	Very high	61 Å²	61	54.2 Å²	54.2	27%	0.265	29%	0.287	S	S	.	.			trans	-107.2	132.3	-179.5	-65	172.1	-173.8	159	0	111.7	A823 V830 W894 H898 F900	A823-K825 PolarHBondContact O-N 3Å; K825-V830 HydrophobicContact CD-CG1 3.97Å; K825-W894 HydrophobicContact CB-CZ2 4.31Å; K825-W894 PolarHBondContact O-NE1 2.78Å; K825-H898 PolarHBondContact N-O 2.86Å; K825-H898 VanDerWaalsContact N-O 3.12Å; K825-F900 PolarHBondContact NZ-O 2.83Å
826	E	94.1	Very high	92.9	Very high	125 Å²	125	56 Å²	56	58%	0.584	29%	0.29	S	S	*	.			trans	-59.4	141.1	162.3	-64.8	153.1	167.2	0	0	109.8	E828 K829	E826-E828 VanDerWaalsContact C-N 3.27Å; E826-E828 PolarHBondContact O-N 2.97Å; E826-K829 HydrophobicContact CB-CD 4.4Å; E826-K829 WeakPolarHBondContact O-CB 3.4Å; E826-K829 PolarHBondContact O-N 3.45Å; E826-K829 WeakPolarHBondContact OE2-CE 3.28Å; E826-K829 IonicContact OE2-NZ 3.63Å; E826-K829 PolarHBondContact OE2-NZ 3.16Å
827	I	94.9	Very high	93	Very high	22 Å²	22	55.1 Å²	55.1	11%	0.113	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-62	-33.8	-172.5	-161.5	174.8	0	0	0	112.8	K829 V830 I831 I887 K891 W894 I905	I827-K829 PolarHBondContact O-N 2.96Å; I827-V830 HydrophobicContact CG1-CG2 4.29Å; I827-V830 WeakPolarHBondContact O-CG2 2.98Å; I827-V830 PolarHBondContact O-N 3.46Å; I827-I831 HydrophobicContact CG1-CD1 4.14Å; I827-I831 HydrophobicContact CG1-CG1 4.31Å; I827-I831 HydrophobicContact CG2-CD1 4.3Å; I827-I831 WeakPolarHBondContact O-CG1 3.37Å; I827-I831 PolarHBondContact O-N 2.86Å; I827-I831 VanDerWaalsContact O-N 3.15Å; I827-I887 HydrophobicContact CD1-CD1 3.97Å; I827-K891 HydrophobicContact CD1-CG 3.66Å; I827-W894 HydrophobicContact CB-CG 4.13Å; I827-W894 HydrophobicContact CD1-CB 4.03Å; I827-W894 HydrophobicContact CD1-CD2 4.46Å; I827-W894 HydrophobicContact CD1-CG 3.98Å; I827-W894 HydrophobicContact CG1-CD2 4.07Å; I827-W894 HydrophobicContact CG1-CG 3.92Å; I827-I905 HydrophobicContact CD1-CD1 3.95Å; I827-I905 HydrophobicContact CG1-CD1 3.85Å
828	E	93.9	Very high	92.9	Very high	129 Å²	129	57.3 Å²	57.3	60%	0.603	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-62	-15.7	177.2	-48.7	-55.9	146.7	0	0	113.3	E826	E826-E828 VanDerWaalsContact C-N 3.27Å; E826-E828 PolarHBondContact O-N 2.97Å
829	K	93.6	Very high	92.7	Very high	151 Å²	151	63.4 Å²	63.4	66%	0.657	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-88.6	-1.5	175.5	-69	169.8	172.6	158	0	113.9	E826 I827	E826-K829 HydrophobicContact CB-CD 4.4Å; E826-K829 WeakPolarHBondContact O-CB 3.4Å; E826-K829 PolarHBondContact O-N 3.45Å; E826-K829 WeakPolarHBondContact OE2-CE 3.28Å; E826-K829 IonicContact OE2-NZ 3.63Å; E826-K829 PolarHBondContact OE2-NZ 3.16Å; I827-K829 PolarHBondContact O-N 2.96Å
830	V	94.9	Very high	92.4	Very high	6 Å²	6	66.2 Å²	66.2	4%	0.036	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	-13.3	176.4	-61.2	0	0	0	0	113.5	K825 I827 W894 V903 S904 I905	K825-V830 HydrophobicContact CD-CG1 3.97Å; I827-V830 HydrophobicContact CG1-CG2 4.29Å; I827-V830 WeakPolarHBondContact O-CG2 2.98Å; I827-V830 PolarHBondContact O-N 3.46Å; V830-W894 HydrophobicContact CB-CH2 4.16Å; V830-W894 HydrophobicContact CB-CZ2 4.35Å; V830-W894 HydrophobicContact CG1-CH2 3.88Å; V830-W894 HydrophobicContact CG1-CZ2 3.92Å; V830-W894 HydrophobicContact CG2-CH2 3.52Å; V830-W894 HydrophobicContact CG2-CZ2 3.53Å; V830-W894 HydrophobicContact CG2-CZ3 4.02Å; V830-V903 WeakPolarHBondContact CG1-O 3.31Å; V830-S904 CarbonylContact O-C 3.45Å; V830-S904 VanDerWaalsContact O-CA 3.29Å; V830-S904 WeakPolarHBondContact O-CA 3.45Å; V830-I905 HydrophobicContact CG2-CD1 4.04Å; V830-I905 HydrophobicContact CG2-CG1 4.34Å; V830-I905 PolarHBondContact O-N 2.93Å
831	I	95.9	Very high	91.9	Very high	37 Å²	37	70.9 Å²	70.9	19%	0.19	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-66.7	133.7	170.8	-69.3	166.3	0	0	0	109.1	I827 I887 I905 P907	I827-I831 HydrophobicContact CG1-CD1 4.14Å; I827-I831 HydrophobicContact CG1-CG1 4.31Å; I827-I831 HydrophobicContact CG2-CD1 4.3Å; I827-I831 WeakPolarHBondContact O-CG1 3.37Å; I827-I831 PolarHBondContact O-N 2.86Å; I827-I831 VanDerWaalsContact O-N 3.15Å; I831-I887 HydrophobicContact CD1-CD1 3.8Å; I831-I887 HydrophobicContact CD1-CG1 4.42Å; I831-I887 HydrophobicContact CG1-CD1 4.15Å; I831-I905 CarbonylContact C-O 3.55Å; I831-I905 WeakPolarHBondContact CA-O 3.49Å; I831-I905 HydrophobicContact CG1-CB 4.3Å; I831-I905 HydrophobicContact CG1-CG2 4.39Å; I831-P907 HydrophobicContact CG2-CG 4.17Å
832	L	94.1	Very high	91.6	Very high	32 Å²	32	69.5 Å²	69.5	17%	0.168	38%	0.375	C	S	.	.			trans	-121	134.5	173	-59	177.1	0	0	0	108.6	E836 A837 I905 L906 P907	L832-E836 HydrophobicContact CB-CB 4.44Å; L832-E836 HydrophobicContact CD2-CB 4.41Å; L832-A837 HydrophobicContact CB-CB 4.47Å; L832-I905 PolarHBondContact N-O 2.87Å; L832-L906 VanDerWaalsContact O-CD1 3.31Å; L832-L906 WeakPolarHBondContact O-CD1 3.27Å; L832-P907 WeakPolarHBondContact O-CD 3.2Å
833	T	94.3	Very high	91.5	Very high	73 Å²	73	71.5 Å²	71.5	45%	0.448	39%	0.389	S	S	.	.			trans	-70.7	161.8	163	64.4	0	0	0	0	110.6	S835 E836 A837	T833-S835 PolarHBondContact O-N 2.92Å; T833-S835 VanDerWaalsContact O-N 3.13Å; T833-E836 VanDerWaalsContact CB-OE2 3.25Å; T833-E836 WeakPolarHBondContact CB-OE2 3.23Å; T833-E836 VanDerWaalsContact CG2-OE2 3.29Å; T833-E836 WeakPolarHBondContact CG2-OE2 3.48Å; T833-E836 PolarHBondContact N-OE2 3.4Å; T833-E836 PolarHBondContact O-N 3.06Å; T833-E836 VanDerWaalsContact OG1-CD 3.27Å; T833-E836 WeakPolarHBondContact OG1-CG 3.3Å; T833-E836 PolarHBondContact OG1-N 2.65Å; T833-E836 PolarHBondContact OG1-OE2 3.32Å; T833-A837 PolarHBondContact O-N 3.16Å
834	R	93.3	Very high	91.5	Very high	121 Å²	121	69.8 Å²	69.8	46%	0.457	38%	0.377	S	S	.	.	H	α-helix	trans	-52.3	-35.6	175.3	-168.2	-177.2	-67.2	152.5	-0	112.9	A838 D915 A918	R834-A838 WeakPolarHBondContact O-CB 3.29Å; R834-A838 PolarHBondContact O-N 3.27Å; R834-A838 VanDerWaalsContact O-N 3.11Å; R834-D915 IonicContact CZ-OD1 2.69Å; R834-D915 IonicContact CZ-OD2 3.66Å; R834-D915 IonicContact NE-OD1 2.82Å; R834-D915 PolarHBondContact NE-OD1 3.44Å; R834-D915 IonicContact NE-OD2 3.57Å; R834-D915 IonicContact NH2-OD1 3.92Å; R834-D915 PolarHBondContact NH2-OD1 3.09Å; R834-D915 IonicContact NH2-OD2 3.19Å; R834-D915 PolarHBondContact NH2-OD2 3.4Å; R834-A918 HydrophobicContact CB-CB 4.46Å; R834-A918 HydrophobicContact CG-CB 3.42Å; R834-A918 VanDerWaalsContact CG-CB 3.42Å
835	S	91.6	Very high	91.7	Very high	83 Å²	83	65.9 Å²	65.9	58%	0.58	35%	0.351	S	S	*	.	H	α-helix	trans	-71.9	-40.7	177.5	-55.6	0	0	0	0	112.6	T833 A838 M839	T833-S835 PolarHBondContact O-N 2.92Å; T833-S835 VanDerWaalsContact O-N 3.13Å; S835-A838 PolarHBondContact O-N 2.64Å; S835-M839 WeakPolarHBondContact O-CG 3.36Å; S835-M839 PolarHBondContact O-N 2.78Å
836	E	91.9	Very high	91.9	Very high	85 Å²	85	63 Å²	63	40%	0.397	34%	0.339	S	S	.	.	H	α-helix	trans	-71.8	-35.8	178.2	-68.7	157.4	139.9	0	0	111.9	L832 T833 M839 T840	L832-E836 HydrophobicContact CB-CB 4.44Å; L832-E836 HydrophobicContact CD2-CB 4.41Å; T833-E836 VanDerWaalsContact CB-OE2 3.25Å; T833-E836 WeakPolarHBondContact CB-OE2 3.23Å; T833-E836 VanDerWaalsContact CG2-OE2 3.29Å; T833-E836 WeakPolarHBondContact CG2-OE2 3.48Å; T833-E836 PolarHBondContact N-OE2 3.4Å; T833-E836 PolarHBondContact O-N 3.06Å; T833-E836 VanDerWaalsContact OG1-CD 3.27Å; T833-E836 WeakPolarHBondContact OG1-CG 3.3Å; T833-E836 PolarHBondContact OG1-N 2.65Å; T833-E836 PolarHBondContact OG1-OE2 3.32Å; E836-M839 HydrophobicContact CB-CE 4.46Å; E836-M839 HydrophobicContact CG-CE 3.97Å; E836-M839 PolarHBondContact O-N 3.35Å; E836-T840 WeakPolarHBondContact O-CB 3.15Å; E836-T840 PolarHBondContact O-N 3.17Å; E836-T840 PolarHBondContact O-OG1 3.16Å
837	A	90.8	Very high	92.1	Very high	1 Å²	1	57 Å²	57	1%	0.008	31%	0.311	C	S	.	.	H	α-helix	trans	-58.7	-49.4	168.8	0	0	0	0	0	110.9	L832 T833 M839 T840 A918	L832-A837 HydrophobicContact CB-CB 4.47Å; T833-A837 PolarHBondContact O-N 3.16Å; A837-M839 VanDerWaalsContact C-N 3.31Å; A837-M839 PolarHBondContact O-N 3.26Å; A837-T840 CarbonylContact O-C 3.55Å; A837-T840 WeakPolarHBondContact O-CA 3.46Å; A837-T840 WeakPolarHBondContact O-CB 3.41Å; A837-T840 PolarHBondContact O-N 3.25Å; A837-A918 CarbonylContact C-O 3.51Å; A837-A918 HydrophobicContact CB-CB 4.33Å
838	A	87.1	Confident	92.3	Very high	46 Å²	46	56 Å²	56	38%	0.38	31%	0.306	S	S	.	.	H	α-helix	trans	-67.3	-25.7	178.8	0	0	0	0	0	114.4	R834 S835 T840 A918	R834-A838 WeakPolarHBondContact O-CB 3.29Å; R834-A838 PolarHBondContact O-N 3.27Å; R834-A838 VanDerWaalsContact O-N 3.11Å; S835-A838 PolarHBondContact O-N 2.64Å; A838-T840 VanDerWaalsContact C-N 3.34Å; A838-A918 HydrophobicContact CB-CB 4.47Å; A838-A918 PolarHBondContact N-O 3.01Å
839	M	85.4	Confident	92.5	Very high	141 Å²	141	49.8 Å²	49.8	70%	0.695	28%	0.277	S	S	*	.	H	α-helix	trans	-77.3	-19.7	169.6	-71.9	-172.9	-62.3	0	0	112.9	S835 E836 A837	S835-M839 WeakPolarHBondContact O-CG 3.36Å; S835-M839 PolarHBondContact O-N 2.78Å; E836-M839 HydrophobicContact CB-CE 4.46Å; E836-M839 HydrophobicContact CG-CE 3.97Å; E836-M839 PolarHBondContact O-N 3.35Å; A837-M839 VanDerWaalsContact C-N 3.31Å; A837-M839 PolarHBondContact O-N 3.26Å
840	T	87.1	Confident	92.6	Very high	59 Å²	59	42.8 Å²	42.8	36%	0.362	25%	0.246	S	C	.	.	S	Bend	trans	-91.5	107.9	179.3	-54.6	0	0	0	0	109.3	E836 A837 A838 L842	E836-T840 WeakPolarHBondContact O-CB 3.15Å; E836-T840 PolarHBondContact O-N 3.17Å; E836-T840 PolarHBondContact O-OG1 3.16Å; A837-T840 CarbonylContact O-C 3.55Å; A837-T840 WeakPolarHBondContact O-CA 3.46Å; A837-T840 WeakPolarHBondContact O-CB 3.41Å; A837-T840 PolarHBondContact O-N 3.25Å; A838-T840 VanDerWaalsContact C-N 3.34Å; T840-L842 HydrophobicContact CG2-CD2 3.87Å; T840-L842 HydrophobicContact CG2-CG 3.95Å; T840-L842 PolarHBondContact O-N 3.25Å
841	V	84.2	Confident	92.6	Very high	105 Å²	105	43.1 Å²	43.1	64%	0.636	25%	0.248	S	C	*	.			trans	-71.2	91.1	179.2	-176.2	0	0	0	0	110
842	L	86.9	Confident	92.3	Very high	13 Å²	13	41.7 Å²	41.7	7%	0.068	24%	0.242	C	C	.	.			trans	-92.8	121.4	177.2	-65.1	174.1	0	0	0	110.2	T840 V882	T840-L842 HydrophobicContact CG2-CD2 3.87Å; T840-L842 HydrophobicContact CG2-CG 3.95Å; T840-L842 PolarHBondContact O-N 3.25Å; L842-V882 HydrophobicContact CD1-CG2 3.68Å
843	S	91.3	Very high	91.9	Very high	66 Å²	66	44 Å²	44	46%	0.462	25%	0.254	S	S	.	.			trans	-149.7	147.3	176.4	174.6	0	0	0	0	108.3	L923	S843-L923 WeakPolarHBondContact CA-O 3.46Å
844	G	91.5	Very high	91.7	Very high	26 Å²	26	45.4 Å²	45.4	27%	0.268	26%	0.263	S	S	.	.	S	Bend	trans	66.8	39	-174.6	0	0	0	0	0	112.4	L923 D925	G844-L923 PolarHBondContact N-O 3.35Å; G844-L923 VanDerWaalsContact N-O 3.09Å; G844-D925 WeakPolarHBondContact CA-OD1 3.14Å
845	H	95.6	Very high	91.4	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	165.1	-168.1	78.9	-84.5	0	0	0	111.7	V847 H880 V919 C924 D925	H845-V847 WeakPolarHBondContact NE2-CG2 3.32Å; H845-H880 HydrophobicContact CB-CB 4.26Å; H845-H880 WeakPolarHBondContact CB-O 3.47Å; H845-V919 PolarHBondContact CE1-O 3.22Å; H845-V919 PolarHBondContact NE2-O 2.91Å; H845-C924 CarbonylContact O-C 3.58Å; H845-C924 VanDerWaalsContact O-CA 3.31Å; H845-C924 WeakPolarHBondContact O-CA 3.33Å; H845-C924 VanDerWaalsContact O-CB 3.32Å; H845-C924 WeakPolarHBondContact O-CB 3.38Å; H845-D925 PolarHBondContact O-N 3.21Å
846	V	98.1	Very high	91.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	126.5	178.2	-178.7	0	0	0	0	109.3	C563 V848 K879 H880 I881 V882 M926 V928	C563-V846 HydrophobicContact CB-CG2 4.08Å; V846-V848 HydrophobicContact CG1-CG2 3.97Å; V846-K879 HydrophobicContact CG2-CB 4.15Å; V846-K879 HydrophobicContact CG2-CD 4.13Å; V846-H880 PolarHBondContact N-O 3.45Å; V846-I881 HydrophobicContact CB-CG1 4.38Å; V846-I881 WeakPolarHBondContact O-CA 3.42Å; V846-V882 PolarHBondContact O-N 3.14Å; V846-M926 WeakPolarHBondContact CA-O 3.35Å; V846-V928 HydrophobicContact CG1-CG2 4.1Å
847	V	98.1	Very high	90.9	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	128	171.2	-177.9	0	0	0	0	107.9	H845 V884 V919 C924 M926 C927 V928	H845-V847 WeakPolarHBondContact NE2-CG2 3.32Å; V847-V884 HydrophobicContact CG1-CG2 3.95Å; V847-V919 HydrophobicContact CG1-CG2 4.24Å; V847-V919 HydrophobicContact CG2-CB 4.49Å; V847-V919 HydrophobicContact CG2-CG2 3.9Å; V847-C924 HydrophobicContact CG2-CB 3.99Å; V847-M926 PolarHBondContact N-O 3.01Å; V847-C927 CarbonylContact O-C 3.59Å; V847-C927 WeakPolarHBondContact O-CA 3.4Å; V847-V928 PolarHBondContact O-N 3.43Å
848	V	98.2	Very high	90.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	102.7	177.8	-172.3	0	0	0	0	108.9	V846 I850 L864 I881 V882 F883 V884 V928 L930	V846-V848 HydrophobicContact CG1-CG2 3.97Å; V848-I850 HydrophobicContact CG1-CD1 4.21Å; V848-I850 HydrophobicContact CG1-CG1 4.08Å; V848-L864 HydrophobicContact CB-CD2 4.43Å; V848-L864 HydrophobicContact CG1-CD2 3.73Å; V848-L864 HydrophobicContact CG2-CD2 3.78Å; V848-I881 HydrophobicContact CG2-CG2 4.03Å; V848-V882 PolarHBondContact N-O 2.87Å; V848-F883 HydrophobicContact CB-CD1 3.64Å; V848-F883 HydrophobicContact CB-CE1 3.88Å; V848-F883 HydrophobicContact CG1-CD1 3.86Å; V848-F883 HydrophobicContact CG1-CE1 3.88Å; V848-F883 HydrophobicContact CG2-CD1 4.31Å; V848-F883 HydrophobicContact CG2-CE1 4.15Å; V848-F883 WeakPolarHBondContact O-CA 3.37Å; V848-V884 PolarHBondContact O-N 2.91Å; V848-V928 CarbonylContact C-O 3.53Å; V848-V928 WeakPolarHBondContact CA-O 3.26Å; V848-V928 HydrophobicContact CG1-CB 4.3Å; V848-V928 HydrophobicContact CG1-CG1 4.38Å; V848-V928 HydrophobicContact CG2-CB 4.33Å; V848-L930 HydrophobicContact CG1-CD1 4.07Å
849	C	97.8	Very high	91	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	121.9	177	-71	0	0	0	0	109.7	P910 V928 I929 L930	C849-P910 HydrophobicContact CB-CB 3.68Å; C849-P910 HydrophobicContact CB-CG 3.59Å; C849-V928 PolarHBondContact N-O 2.98Å; C849-I929 HydrophobicContact CB-CG1 4.2Å; C849-L930 PolarHBondContact O-N 3.42Å
850	I	96.3	Very high	91.4	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	124.5	-176.4	-64.4	162.7	0	0	0	110	V848 L861 F883 V884 Y889 L890	V848-I850 HydrophobicContact CG1-CD1 4.21Å; V848-I850 HydrophobicContact CG1-CG1 4.08Å; I850-L861 HydrophobicContact CD1-CD1 3.57Å; I850-L861 HydrophobicContact CD1-CD2 3.81Å; I850-L861 HydrophobicContact CD1-CG 4.35Å; I850-L861 HydrophobicContact CG1-CD2 4.48Å; I850-F883 HydrophobicContact CD1-CD1 3.53Å; I850-F883 HydrophobicContact CD1-CE1 4.11Å; I850-F883 HydrophobicContact CD1-CG 4.42Å; I850-V884 PolarHBondContact N-O 3.49Å; I850-Y889 HydrophobicContact CG2-CD1 3.95Å; I850-Y889 HydrophobicContact CG2-CE1 3.98Å; I850-L890 HydrophobicContact CD1-CD2 3.88Å
851	F	94.2	Very high	91.7	Very high	14 Å²	14	29.3 Å²	29.3	6%	0.061	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	111.8	164.7	-66.8	-78.7	0	0	0	109.1	P910 L911 I929 L930 A932 E946 A950	F851-P910 HydrophobicContact CE1-CB 4.35Å; F851-P910 HydrophobicContact CE1-CG 4.27Å; F851-P910 HydrophobicContact CE2-CB 4.04Å; F851-P910 HydrophobicContact CE2-CG 4.11Å; F851-P910 HydrophobicContact CZ-CB 3.7Å; F851-P910 HydrophobicContact CZ-CG 3.95Å; F851-L911 HydrophobicContact CE1-CD1 4.17Å; F851-L911 HydrophobicContact CE1-CD2 4.39Å; F851-L911 HydrophobicContact CE1-CG 3.89Å; F851-L911 HydrophobicContact CZ-CD2 3.98Å; F851-L911 HydrophobicContact CZ-CG 3.93Å; F851-I929 HydrophobicContact CE2-CG2 4.22Å; F851-L930 PolarHBondContact N-O 3.03Å; F851-A932 WeakPolarHBondContact O-CB 3.34Å; F851-A932 PolarHBondContact O-N 3.45Å; F851-E946 HydrophobicContact CB-CB 4.47Å; F851-E946 HydrophobicContact CD1-CB 3.85Å; F851-E946 HydrophobicContact CD2-CB 3.97Å; F851-E946 HydrophobicContact CE1-CB 4.01Å; F851-E946 HydrophobicContact CE2-CB 4.12Å; F851-E946 WeakPolarHBondContact CE2-O 3.21Å; F851-E946 HydrophobicContact CG-CB 3.82Å; F851-E946 HydrophobicContact CZ-CB 4.13Å; F851-A950 HydrophobicContact CE2-CB 3.78Å; F851-A950 HydrophobicContact CZ-CB 3.88Å
852	G	89.9	Confident	92.2	Very high	7 Å²	7	24.8 Å²	24.8	7%	0.072	16%	0.162	C	C	.	.			trans	-173	145.2	-177.8	0	0	0	0	0	112.3	S886	G852-S886 VanDerWaalsContact O-CB 3.27Å; G852-S886 WeakPolarHBondContact O-CB 3.26Å
853	D	86.8	Confident	92.6	Very high	79 Å²	79	24.7 Å²	24.7	42%	0.422	16%	0.161	S	C	.	.			trans	-120.9	176	-171.2	-70.4	-63.7	0	0	0	112.4	S855 S856 R892 N933	D853-S855 PolarHBondContact O-N 2.99Å; D853-S856 PolarHBondContact N-OG 3.39Å; D853-S856 PolarHBondContact O-N 2.91Å; D853-S856 VanDerWaalsContact O-N 3.16Å; D853-S856 PolarHBondContact O-OG 3.43Å; D853-R892 PolarHBondContact O-NH1 3.2Å; D853-R892 VanDerWaalsContact O-NH1 3.17Å; D853-N933 PolarHBondContact OD2-ND2 2.9Å; D853-N933 PolarHBondContact OD2-OD1 3.42Å
854	V	88.8	Confident	92.9	Very high	103 Å²	103	21.6 Å²	21.6	62%	0.624	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-35.9	177.6	-163.8	0	0	0	0	112.6	E888 R892	V854-E888 HydrophobicContact CG2-CB 3.81Å; V854-E888 HydrophobicContact CG2-CG 4.12Å; V854-R892 PolarHBondContact O-NH1 2.85Å; V854-R892 VanDerWaalsContact O-NH1 3.16Å
855	S	87.2	Confident	93.1	Very high	100 Å²	100	20.3 Å²	20.3	70%	0.699	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-9.9	-177.9	50.8	0	0	0	0	115	D853	D853-S855 PolarHBondContact O-N 2.99Å
856	S	87.9	Confident	93.1	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.014	13%	0.128	C	C	.	.	S	Bend	trans	-68.9	152.8	-177.2	65.2	0	0	0	0	112.2	D853 Y889 R892 N933	D853-S856 PolarHBondContact N-OG 3.39Å; D853-S856 PolarHBondContact O-N 2.91Å; D853-S856 VanDerWaalsContact O-N 3.16Å; D853-S856 PolarHBondContact O-OG 3.43Å; S856-Y889 WeakPolarHBondContact OG-CD2 3.46Å; S856-Y889 WeakPolarHBondContact OG-CE2 3.34Å; S856-R892 VanDerWaalsContact O-CZ 3.26Å; S856-R892 PolarHBondContact O-NH1 2.89Å; S856-R892 PolarHBondContact O-NH2 3.04Å; S856-N933 WeakPolarHBondContact CB-OD1 3.45Å
857	A	86.6	Confident	92.9	Very high	22 Å²	22	20.9 Å²	20.9	18%	0.182	13%	0.129	C	C	.	.	P	Polyproline II helix	trans	-64.6	155.7	175.1	0	0	0	0	0	111.1	P498	P498-A857 HydrophobicContact CG-CB 3.85Å
858	L	89.5	Confident	92.8	Very high	50 Å²	50	21.2 Å²	21.2	26%	0.262	13%	0.131	S	C	.	.	P	Polyproline II helix	trans	-75.4	141.4	173.8	-62.6	178.8	0	0	0	110.4	Q527 Y889 R892 E893	Q527-L858 PolarHBondContact NE2-O 3.22Å; L858-Y889 HydrophobicContact CD2-CE2 4.41Å; L858-R892 HydrophobicContact CD2-CB 3.91Å; L858-E893 HydrophobicContact CD2-CG 4.22Å
859	I	90.1	Very high	92.7	Very high	10 Å²	10	21.2 Å²	21.2	5%	0.051	13%	0.131	C	C	.	.			trans	-87.8	-29.9	174.4	-58.1	176.5	0	0	0	109.8	L556 L861 Y889 E893 L930 A932	L556-I859 HydrophobicContact CD1-CG2 3.93Å; L556-I859 HydrophobicContact CD2-CG2 3.96Å; L556-I859 HydrophobicContact CG-CG2 4.38Å; I859-L861 HydrophobicContact CB-CD2 4.44Å; I859-L861 HydrophobicContact CG2-CD2 4.41Å; I859-Y889 WeakPolarHBondContact CG1-OH 3.37Å; I859-Y889 PolarHBondContact N-OH 2.94Å; I859-E893 PolarHBondContact N-OE1 3.41Å; I859-E893 VanDerWaalsContact N-OE1 3.08Å; I859-L930 HydrophobicContact CD1-CB 4.1Å; I859-A932 HydrophobicContact CD1-CB 3.87Å; I859-A932 HydrophobicContact CG1-CB 3.85Å
860	G	92.3	Very high	92.5	Very high	14 Å²	14	21.3 Å²	21.3	14%	0.144	13%	0.132	C	C	.	.			trans	79.7	53.6	-175.6	0	0	0	0	0	111.5	L556 R862 N863 E893	L556-G860 VanDerWaalsContact CD1-O 3.27Å; L556-G860 WeakPolarHBondContact CD1-O 3.23Å; G860-R862 PolarHBondContact O-N 2.71Å; G860-N863 PolarHBondContact O-N 3.17Å; G860-E893 PolarHBondContact N-OE1 2.96Å
861	L	95.4	Very high	92.3	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-22	-174	-64.8	173.6	0	0	0	113.7	I850 I859 N863 L864 V865 F883 Y889 L890 E893 L897 L930	I850-L861 HydrophobicContact CD1-CD1 3.57Å; I850-L861 HydrophobicContact CD1-CD2 3.81Å; I850-L861 HydrophobicContact CD1-CG 4.35Å; I850-L861 HydrophobicContact CG1-CD2 4.48Å; I859-L861 HydrophobicContact CB-CD2 4.44Å; I859-L861 HydrophobicContact CG2-CD2 4.41Å; L861-N863 PolarHBondContact O-N 3.48Å; L861-N863 VanDerWaalsContact O-N 3.16Å; L861-L864 WeakPolarHBondContact O-CB 3.41Å; L861-L864 PolarHBondContact O-N 3.31Å; L861-V865 PolarHBondContact O-N 2.72Å; L861-V865 VanDerWaalsContact O-N 3.08Å; L861-F883 HydrophobicContact CB-CE1 4.46Å; L861-F883 HydrophobicContact CB-CZ 4.44Å; L861-F883 HydrophobicContact CD1-CD1 4.33Å; L861-F883 HydrophobicContact CD1-CE1 3.96Å; L861-F883 HydrophobicContact CD1-CZ 4.38Å; L861-F883 HydrophobicContact CD2-CE1 4.28Å; L861-F883 HydrophobicContact CG-CE1 4.47Å; L861-Y889 HydrophobicContact CD1-CE1 4.32Å; L861-L890 HydrophobicContact CD1-CD2 3.82Å; L861-E893 WeakPolarHBondContact CB-OE2 3.34Å; L861-E893 HydrophobicContact CD1-CB 4.01Å; L861-E893 HydrophobicContact CD1-CG 3.77Å; L861-E893 HydrophobicContact CG-CG 4.12Å; L861-E893 PolarHBondContact N-OE2 3.46Å; L861-L897 HydrophobicContact CB-CD1 4.19Å; L861-L897 HydrophobicContact CB-CD2 4.32Å; L861-L897 HydrophobicContact CD1-CD1 4.36Å; L861-L930 HydrophobicContact CD2-CD1 3.98Å
862	R	94.4	Very high	92.1	Very high	11 Å²	11	20.9 Å²	20.9	4%	0.042	13%	0.13	C	C	.	.	H	α-helix	trans	-46.9	-37.1	167.6	173.7	177.9	176.3	-174.4	13.9	113.1	G860 L864 V865 M866 L897 F900 N1084	G860-R862 PolarHBondContact O-N 2.71Å; R862-L864 VanDerWaalsContact C-N 3.3Å; R862-L864 PolarHBondContact O-N 2.79Å; R862-V865 PolarHBondContact O-N 3.14Å; R862-M866 HydrophobicContact CG-CE 3.68Å; R862-M866 WeakPolarHBondContact O-CB 3.43Å; R862-M866 PolarHBondContact O-N 2.91Å; R862-L897 HydrophobicContact CB-CD2 4.3Å; R862-F900 HydrophobicContact CG-CE2 4.42Å; R862-N1084 VanDerWaalsContact CZ-O 3.24Å; R862-N1084 PolarHBondContact NH1-O 3.37Å; R862-N1084 PolarHBondContact NH1-OD1 3.13Å; R862-N1084 VanDerWaalsContact NH1-OD1 3.1Å; R862-N1084 PolarHBondContact NH2-O 3.08Å; R862-N1084 VanDerWaalsContact NH2-O 3.08Å
863	N	95.1	Very high	92.2	Very high	10 Å²	10	21.6 Å²	21.6	5%	0.053	13%	0.131	C	C	.	.	H	α-helix	trans	-72.6	-22.3	179.8	-60.8	-30.6	0	0	0	113	L556 G860 L861 P867	L556-N863 HydrophobicContact CB-CB 3.93Å; L556-N863 HydrophobicContact CD1-CB 3.82Å; G860-N863 PolarHBondContact O-N 3.17Å; L861-N863 PolarHBondContact O-N 3.48Å; L861-N863 VanDerWaalsContact O-N 3.16Å; N863-P867 WeakPolarHBondContact O-CD 3.39Å; N863-P867 WeakPolarHBondContact O-CG 3.31Å
864	L	96.9	Very high	92.4	Very high	1 Å²	1	19 Å²	19	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-80.5	-41	170.9	-174.5	73.6	0	0	0	111.2	L556 I559 A560 V848 L861 R862 L930	L556-L864 HydrophobicContact CB-CB 4.13Å; L556-L864 HydrophobicContact CD2-CB 4.42Å; L556-L864 WeakPolarHBondContact O-CD1 3.3Å; I559-L864 HydrophobicContact CB-CD1 4.18Å; I559-L864 HydrophobicContact CG2-CD1 3.71Å; A560-L864 HydrophobicContact CB-CD1 4.11Å; A560-L864 WeakPolarHBondContact CB-O 3.24Å; V848-L864 HydrophobicContact CB-CD2 4.43Å; V848-L864 HydrophobicContact CG1-CD2 3.73Å; V848-L864 HydrophobicContact CG2-CD2 3.78Å; L861-L864 WeakPolarHBondContact O-CB 3.41Å; L861-L864 PolarHBondContact O-N 3.31Å; R862-L864 VanDerWaalsContact C-N 3.3Å; R862-L864 PolarHBondContact O-N 2.79Å; L864-L930 HydrophobicContact CD2-CD1 4.35Å
865	V	96.7	Very high	92.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-77.7	-37.7	-175.6	179.5	0	0	0	0	112.4	L861 R862 L868 R869 I881 F883 L897 F900 V903	L861-V865 PolarHBondContact O-N 2.72Å; L861-V865 VanDerWaalsContact O-N 3.08Å; R862-V865 PolarHBondContact O-N 3.14Å; V865-L868 CarbonylContact O-C 3.54Å; V865-L868 PolarHBondContact O-N 3.35Å; V865-R869 HydrophobicContact CG1-CG 3.91Å; V865-R869 VanDerWaalsContact O-CG 3.3Å; V865-R869 WeakPolarHBondContact O-CG 3.49Å; V865-R869 PolarHBondContact O-N 2.7Å; V865-R869 VanDerWaalsContact O-N 3.13Å; V865-I881 HydrophobicContact CB-CD1 4.46Å; V865-I881 HydrophobicContact CG1-CD1 4.13Å; V865-I881 HydrophobicContact CG2-CD1 4.14Å; V865-F883 HydrophobicContact CG2-CE2 4.32Å; V865-F883 HydrophobicContact CG2-CZ 3.71Å; V865-L897 HydrophobicContact CB-CD2 4.25Å; V865-L897 HydrophobicContact CG2-CD2 3.91Å; V865-F900 HydrophobicContact CB-CD2 4.21Å; V865-F900 HydrophobicContact CB-CE2 4.34Å; V865-F900 HydrophobicContact CG1-CB 3.84Å; V865-F900 HydrophobicContact CG1-CD1 4.1Å; V865-F900 HydrophobicContact CG1-CD2 3.5Å; V865-F900 VanDerWaalsContact CG1-CD2 3.5Å; V865-F900 HydrophobicContact CG1-CE2 4.03Å; V865-F900 HydrophobicContact CG1-CG 3.54Å; V865-V903 HydrophobicContact CG1-CG2 4.44Å
866	M	93.8	Very high	92.6	Very high	8 Å²	8	21.1 Å²	21.1	4%	0.039	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-47.7	-174.2	-167	-175.1	-37.8	0	0	113.1	F819 R862 L868 R869 A870 F900 L1076 L1086	F819-M866 HydrophobicContact CD1-CG 3.61Å; F819-M866 WeakPolarHBondContact CD1-O 3.46Å; F819-M866 HydrophobicContact CD2-CG 4.17Å; F819-M866 HydrophobicContact CD2-SD 4.3Å; F819-M866 HydrophobicContact CE1-CG 3.52Å; F819-M866 WeakPolarHBondContact CE1-O 3.44Å; F819-M866 HydrophobicContact CE1-SD 4.36Å; F819-M866 HydrophobicContact CE2-CG 4.07Å; F819-M866 HydrophobicContact CE2-SD 3.93Å; F819-M866 HydrophobicContact CG-CG 3.97Å; F819-M866 HydrophobicContact CZ-CG 3.76Å; F819-M866 HydrophobicContact CZ-SD 3.97Å; R862-M866 HydrophobicContact CG-CE 3.68Å; R862-M866 WeakPolarHBondContact O-CB 3.43Å; R862-M866 PolarHBondContact O-N 2.91Å; M866-L868 VanDerWaalsContact C-N 3.33Å; M866-L868 PolarHBondContact O-N 2.95Å; M866-R869 CarbonylContact O-C 3.56Å; M866-R869 WeakPolarHBondContact O-CA 3.35Å; M866-R869 PolarHBondContact O-N 3.42Å; M866-A870 PolarHBondContact O-N 3.24Å; M866-F900 HydrophobicContact CB-CE1 4.5Å; M866-F900 HydrophobicContact CB-CZ 4.06Å; M866-F900 HydrophobicContact CG-CZ 4.28Å; M866-L1076 HydrophobicContact SD-CD2 4.45Å; M866-L1086 HydrophobicContact CE-CD1 4.16Å
867	P	95.3	Very high	92.8	Very high	4 Å²	4	24 Å²	24	3%	0.026	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-64.1	-37.8	177.1	-18.4	32	0	0	0	112.3	A560 N863 R869 A870	A560-P867 HydrophobicContact CB-CB 3.95Å; A560-P867 HydrophobicContact CB-CG 3.94Å; N863-P867 WeakPolarHBondContact O-CD 3.39Å; N863-P867 WeakPolarHBondContact O-CG 3.31Å; P867-R869 PolarHBondContact O-N 2.91Å; P867-R869 VanDerWaalsContact O-N 3.12Å; P867-A870 WeakPolarHBondContact O-CB 3.46Å; P867-A870 PolarHBondContact O-N 3.11Å
868	L	95.8	Very high	93.2	Very high	7 Å²	7	23.2 Å²	23.2	4%	0.037	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-68.2	-3.1	173.3	-67	177.4	0	0	0	113.8	A560 C563 L564 V865 M866 I881	A560-L868 HydrophobicContact CB-CG 4.18Å; A560-L868 WeakPolarHBondContact O-CD2 3.48Å; C563-L868 HydrophobicContact CB-CD1 4.45Å; C563-L868 HydrophobicContact CB-CD2 4.1Å; L564-L868 HydrophobicContact CD1-CD2 4.31Å; L564-L868 HydrophobicContact CD2-CD2 3.73Å; L564-L868 HydrophobicContact CG-CD2 3.81Å; V865-L868 CarbonylContact O-C 3.54Å; V865-L868 PolarHBondContact O-N 3.35Å; M866-L868 VanDerWaalsContact C-N 3.33Å; M866-L868 PolarHBondContact O-N 2.95Å; L868-I881 HydrophobicContact CB-CD1 4.1Å; L868-I881 HydrophobicContact CD1-CD1 3.79Å; L868-I881 HydrophobicContact CD1-CG1 4.35Å
869	R	95.5	Very high	93.5	Very high	1 Å²	1	22.8 Å²	22.8	0%	0.004	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-123.6	17.8	176.6	-61.9	-65.1	175.8	-99	4.7	112.5	F819 H820 V865 M866 P867 K879 F900 P901 K902	F819-R869 WeakPolarHBondContact CA-O 3.21Å; H820-R869 PolarHBondContact CD2-O 2.91Å; H820-R869 PolarHBondContact N-O 3.38Å; V865-R869 HydrophobicContact CG1-CG 3.91Å; V865-R869 VanDerWaalsContact O-CG 3.3Å; V865-R869 WeakPolarHBondContact O-CG 3.49Å; V865-R869 PolarHBondContact O-N 2.7Å; V865-R869 VanDerWaalsContact O-N 3.13Å; M866-R869 CarbonylContact O-C 3.56Å; M866-R869 WeakPolarHBondContact O-CA 3.35Å; M866-R869 PolarHBondContact O-N 3.42Å; P867-R869 PolarHBondContact O-N 2.91Å; P867-R869 VanDerWaalsContact O-N 3.12Å; R869-K879 VanDerWaalsContact CZ-O 3.28Å; R869-K879 PolarHBondContact NH1-O 2.59Å; R869-K879 PolarHBondContact NH2-O 3.15Å; R869-F900 HydrophobicContact CB-CD1 3.84Å; R869-F900 HydrophobicContact CB-CE1 4.15Å; R869-F900 HydrophobicContact CG-CB 4.38Å; R869-F900 HydrophobicContact CG-CD1 3.8Å; R869-F900 HydrophobicContact CG-CE1 4.47Å; R869-F900 HydrophobicContact CG-CG 4.32Å; R869-P901 PolarHBondContact NE-O 3.18Å; R869-P901 PolarHBondContact NH2-O 3.01Å; R869-K902 PolarHBondContact NH2-O 3.45Å
870	A	93.8	Very high	93.8	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.008	11%	0.113	C	C	.	.	B	Isolated β-bridge	trans	-60.6	144.9	174.9	0	0	0	0	0	112.7	F819 H820 M866 P867 N872 F873	F819-A870 HydrophobicContact CD1-CB 4.22Å; F819-A870 HydrophobicContact CE1-CB 3.98Å; H820-A870 PolarHBondContact CD2-O 2.83Å; M866-A870 PolarHBondContact O-N 3.24Å; P867-A870 WeakPolarHBondContact O-CB 3.46Å; P867-A870 PolarHBondContact O-N 3.11Å; A870-N872 WeakPolarHBondContact CB-OD1 3.37Å; A870-N872 PolarHBondContact O-N 3.4Å; A870-F873 PolarHBondContact O-N 2.7Å
871	S	92.1	Very high	94.1	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-5.9	-170.8	64.2	0	0	0	0	115.2	G817 M818 F873 R1099 R1101	G817-S871 VanDerWaalsContact O-CB 3.24Å; G817-S871 WeakPolarHBondContact O-CB 3.32Å; G817-S871 PolarHBondContact O-OG 3.24Å; M818-S871 VanDerWaalsContact C-OG 3.26Å; M818-S871 WeakPolarHBondContact CA-OG 3.48Å; M818-S871 WeakPolarHBondContact O-CB 3.22Å; M818-S871 PolarHBondContact O-N 3.14Å; M818-S871 PolarHBondContact O-OG 3.06Å; M818-S871 VanDerWaalsContact O-OG 3.07Å; S871-F873 PolarHBondContact O-N 3.4Å; S871-R1099 VanDerWaalsContact O-CZ 3.27Å; S871-R1099 PolarHBondContact O-NE 3.22Å; S871-R1099 PolarHBondContact O-NH2 2.85Å; S871-R1101 PolarHBondContact OG-NH2 3.25Å
872	N	90.1	Very high	94.2	Very high	8 Å²	8	24 Å²	24	4%	0.043	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	2.2	170.3	60.4	-13.7	0	0	0	113.6	A870 R1101 C1102 R1103 F1182	A870-N872 WeakPolarHBondContact CB-OD1 3.37Å; A870-N872 PolarHBondContact O-N 3.4Å; N872-R1101 WeakPolarHBondContact CB-O 3.33Å; N872-C1102 PolarHBondContact ND2-O 3.47Å; N872-R1103 PolarHBondContact O-NH1 3.43Å; N872-F1182 VanDerWaalsContact O-CD2 3.29Å; N872-F1182 WeakPolarHBondContact O-CD2 3.32Å
873	F	91.4	Very high	94.4	Very high	23 Å²	23	23.5 Å²	23.5	10%	0.101	11%	0.105	C	C	.	.	S	Bend	trans	-105.1	147.3	163.6	-67	-80.5	0	0	0	111	L564 H820 A870 S871 E877 L878 R1103	L564-F873 HydrophobicContact CD1-CE2 3.95Å; L564-F873 HydrophobicContact CD1-CZ 3.82Å; L564-F873 HydrophobicContact CD2-CE1 4.41Å; L564-F873 HydrophobicContact CD2-CE2 4.36Å; L564-F873 HydrophobicContact CD2-CZ 3.89Å; L564-F873 HydrophobicContact CG-CZ 4.43Å; H820-F873 PolarHBondContact CE1-O 3.35Å; H820-F873 PolarHBondContact NE2-O 2.88Å; A870-F873 PolarHBondContact O-N 2.7Å; S871-F873 PolarHBondContact O-N 3.4Å; F873-E877 HydrophobicContact CB-CB 4.49Å; F873-E877 HydrophobicContact CD1-CB 4.35Å; F873-L878 HydrophobicContact CB-CD2 3.78Å; F873-R1103 HydrophobicContact CE1-CB 4.46Å; F873-R1103 HydrophobicContact CE2-CB 4.45Å; F873-R1103 HydrophobicContact CZ-CB 4.03Å
874	H	91.4	Very high	94.5	Very high	24 Å²	24	23 Å²	23	11%	0.111	10%	0.103	C	C	.	.			trans	-75.4	151.8	166.5	-64.5	86.7	0	0	0	110.5	H876 E877 L878 F1182 D1183	H874-H876 PolarHBondContact O-N 2.81Å; H874-H876 VanDerWaalsContact O-N 3.08Å; H874-E877 HydrophobicContact CB-CG 4.06Å; H874-E877 WeakPolarHBondContact CB-OE2 3.44Å; H874-E877 IonicContact CG-OE2 2.88Å; H874-E877 PolarHBondContact N-OE2 3.24Å; H874-E877 IonicContact ND1-OE2 2.71Å; H874-E877 PolarHBondContact ND1-OE2 3.17Å; H874-E877 WeakPolarHBondContact O-CB 3.27Å; H874-E877 PolarHBondContact O-N 3.16Å; H874-L878 PolarHBondContact O-N 3.45Å; H874-F1182 AromaticContact CE1-CE2 3.38Å; H874-F1182 WeakPolarHBondContact CE1-CE2 3.33Å; H874-F1182 AromaticContact CE1-CZ 3.57Å; H874-F1182 AromaticContact ND1-CE2 3.84Å; H874-F1182 AromaticContact NE2-CE2 3.77Å; H874-F1182 AromaticContact NE2-CZ 3.49Å; H874-F1182 WeakPolarHBondContact NE2-CZ 3.34Å; H874-D1183 PolarHBondContact CE1-O 3.33Å; H874-D1183 VanDerWaalsContact CE1-O 3.31Å
875	Y	91.5	Very high	94.4	Very high	135 Å²	135	23 Å²	23	53%	0.529	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-29.2	-177.9	-169.8	-93.8	0	0	0	113.6	H820 L878 P901 K902	H820-Y875 AromaticContact ND1-CD2 3.95Å; Y875-L878 HydrophobicContact CD2-CD1 3.96Å; Y875-L878 HydrophobicContact CE2-CD1 4.44Å; Y875-P901 HydrophobicContact CE2-CB 3.57Å; Y875-P901 HydrophobicContact CE2-CG 3.94Å; Y875-K902 WeakPolarHBondContact O-CE 3.33Å; Y875-K902 PolarHBondContact O-NZ 3.3Å
876	H	89.9	Confident	94.4	Very high	112 Å²	112	24.1 Å²	24.1	52%	0.519	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-36.9	174.1	63.7	-100.6	0	0	0	112.7	H874 L878 K902	H874-H876 PolarHBondContact O-N 2.81Å; H874-H876 VanDerWaalsContact O-N 3.08Å; H876-L878 VanDerWaalsContact C-N 3.29Å; H876-L878 PolarHBondContact O-N 2.92Å; H876-K902 PolarHBondContact O-NZ 3.17Å; H876-K902 VanDerWaalsContact O-NZ 3.12Å
877	E	91.6	Very high	94.5	Very high	64 Å²	64	25.1 Å²	25.1	30%	0.299	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-19.1	177.2	-60.5	175.6	120	0	0	113.7	F873 H874 K879 R1103	F873-E877 HydrophobicContact CB-CB 4.49Å; F873-E877 HydrophobicContact CD1-CB 4.35Å; H874-E877 HydrophobicContact CB-CG 4.06Å; H874-E877 WeakPolarHBondContact CB-OE2 3.44Å; H874-E877 IonicContact CG-OE2 2.88Å; H874-E877 PolarHBondContact N-OE2 3.24Å; H874-E877 IonicContact ND1-OE2 2.71Å; H874-E877 PolarHBondContact ND1-OE2 3.17Å; H874-E877 WeakPolarHBondContact O-CB 3.27Å; H874-E877 PolarHBondContact O-N 3.16Å; E877-K879 PolarHBondContact O-N 3.15Å; E877-K879 VanDerWaalsContact O-N 3.08Å; E877-R1103 IonicContact OE1-CZ 2.79Å; E877-R1103 VanDerWaalsContact OE1-CZ 3.27Å; E877-R1103 IonicContact OE1-NH1 3.22Å; E877-R1103 PolarHBondContact OE1-NH1 2.84Å; E877-R1103 IonicContact OE1-NH2 3.87Å; E877-R1103 PolarHBondContact OE1-NH2 3.34Å; E877-R1103 IonicContact OE2-CZ 3.2Å; E877-R1103 IonicContact OE2-NH1 3.69Å; E877-R1103 PolarHBondContact OE2-NH1 3.09Å
878	L	94.6	Very high	94.4	Very high	4 Å²	4	30 Å²	30	2%	0.021	14%	0.138	C	C	.	.	S	Bend	trans	-60.1	112.7	178.5	-64.8	179	0	0	0	111.4	H820 F873 H874 Y875 H876 H880 P901 K902	H820-L878 HydrophobicContact CB-CD1 4.25Å; F873-L878 HydrophobicContact CB-CD2 3.78Å; H874-L878 PolarHBondContact O-N 3.45Å; Y875-L878 HydrophobicContact CD2-CD1 3.96Å; Y875-L878 HydrophobicContact CE2-CD1 4.44Å; H876-L878 VanDerWaalsContact C-N 3.29Å; H876-L878 PolarHBondContact O-N 2.92Å; L878-H880 PolarHBondContact O-N 3Å; L878-P901 HydrophobicContact CD1-CG 4.16Å; L878-K902 HydrophobicContact CB-CD 4.13Å; L878-K902 WeakPolarHBondContact O-CD 3.36Å; L878-K902 PolarHBondContact O-NZ 3.39Å
879	K	95.3	Very high	94.4	Very high	41 Å²	41	29.7 Å²	29.7	18%	0.178	14%	0.137	C	C	.	.			trans	-59.5	130.1	173.2	-53.5	-169.6	-176.3	-162.2	0	110.3	C563 V846 R869 E877 D925	C563-K879 WeakPolarHBondContact O-CE 3.31Å; C563-K879 PolarHBondContact O-NZ 3.16Å; V846-K879 HydrophobicContact CG2-CB 4.15Å; V846-K879 HydrophobicContact CG2-CD 4.13Å; R869-K879 VanDerWaalsContact CZ-O 3.28Å; R869-K879 PolarHBondContact NH1-O 2.59Å; R869-K879 PolarHBondContact NH2-O 3.15Å; E877-K879 PolarHBondContact O-N 3.15Å; E877-K879 VanDerWaalsContact O-N 3.08Å; K879-D925 HydrophobicContact CD-CB 4.16Å; K879-D925 WeakPolarHBondContact CD-OD2 3.3Å; K879-D925 WeakPolarHBondContact CE-OD2 3.25Å; K879-D925 IonicContact NZ-OD2 3.79Å; K879-D925 PolarHBondContact NZ-OD2 2.85Å
880	H	96.9	Very high	94.4	Very high	47 Å²	47	29.7 Å²	29.7	22%	0.218	14%	0.137	C	C	.	.			trans	-68.3	142.8	175.5	-162.5	99.3	0	0	0	109.8	H845 V846 L878 K902 S904	H845-H880 HydrophobicContact CB-CB 4.26Å; H845-H880 WeakPolarHBondContact CB-O 3.47Å; V846-H880 PolarHBondContact N-O 3.45Å; L878-H880 PolarHBondContact O-N 3Å; H880-K902 HydrophobicContact CB-CB 4.37Å; H880-K902 WeakPolarHBondContact ND1-CB 3.07Å; H880-S904 PolarHBondContact NE2-OG 3.48Å
881	I	98.3	Very high	94.5	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.5	-179.4	-64.1	168.5	0	0	0	108.7	V846 V848 V865 L868 F883 K902 V903 S904	V846-I881 HydrophobicContact CB-CG1 4.38Å; V846-I881 WeakPolarHBondContact O-CA 3.42Å; V848-I881 HydrophobicContact CG2-CG2 4.03Å; V865-I881 HydrophobicContact CB-CD1 4.46Å; V865-I881 HydrophobicContact CG1-CD1 4.13Å; V865-I881 HydrophobicContact CG2-CD1 4.14Å; L868-I881 HydrophobicContact CB-CD1 4.1Å; L868-I881 HydrophobicContact CD1-CD1 3.79Å; L868-I881 HydrophobicContact CD1-CG1 4.35Å; I881-F883 HydrophobicContact CG2-CD2 4.37Å; I881-F883 HydrophobicContact CG2-CE1 4.39Å; I881-F883 HydrophobicContact CG2-CE2 3.98Å; I881-F883 HydrophobicContact CG2-CZ 4Å; I881-K902 PolarHBondContact N-O 3.04Å; I881-V903 CarbonylContact O-C 3.59Å; I881-V903 WeakPolarHBondContact O-CA 3.28Å; I881-S904 PolarHBondContact O-N 3.38Å
882	V	97.9	Very high	94.5	Very high	2 Å²	2	39 Å²	39	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.8	173	-172	0	0	0	0	109.6	L842 V846 V848 V884 S904 L906 V919	L842-V882 HydrophobicContact CD1-CG2 3.68Å; V846-V882 PolarHBondContact O-N 3.14Å; V848-V882 PolarHBondContact N-O 2.87Å; V882-V884 HydrophobicContact CG1-CG2 4.4Å; V882-S904 WeakPolarHBondContact CA-O 3.43Å; V882-L906 HydrophobicContact CG1-CB 4.36Å; V882-V919 HydrophobicContact CG1-CG1 3.9Å
883	F	98.1	Very high	94.7	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	134.1	170.9	-66	-72.8	0	0	0	110.5	V848 I850 L861 V865 I881 L890 L897 V903 S904 I905 L906	V848-F883 HydrophobicContact CB-CD1 3.64Å; V848-F883 HydrophobicContact CB-CE1 3.88Å; V848-F883 HydrophobicContact CG1-CD1 3.86Å; V848-F883 HydrophobicContact CG1-CE1 3.88Å; V848-F883 HydrophobicContact CG2-CD1 4.31Å; V848-F883 HydrophobicContact CG2-CE1 4.15Å; V848-F883 WeakPolarHBondContact O-CA 3.37Å; I850-F883 HydrophobicContact CD1-CD1 3.53Å; I850-F883 HydrophobicContact CD1-CE1 4.11Å; I850-F883 HydrophobicContact CD1-CG 4.42Å; L861-F883 HydrophobicContact CB-CE1 4.46Å; L861-F883 HydrophobicContact CB-CZ 4.44Å; L861-F883 HydrophobicContact CD1-CD1 4.33Å; L861-F883 HydrophobicContact CD1-CE1 3.96Å; L861-F883 HydrophobicContact CD1-CZ 4.38Å; L861-F883 HydrophobicContact CD2-CE1 4.28Å; L861-F883 HydrophobicContact CG-CE1 4.47Å; V865-F883 HydrophobicContact CG2-CE2 4.32Å; V865-F883 HydrophobicContact CG2-CZ 3.71Å; I881-F883 HydrophobicContact CG2-CD2 4.37Å; I881-F883 HydrophobicContact CG2-CE1 4.39Å; I881-F883 HydrophobicContact CG2-CE2 3.98Å; I881-F883 HydrophobicContact CG2-CZ 4Å; F883-L890 HydrophobicContact CB-CD1 3.91Å; F883-L890 HydrophobicContact CB-CD2 4.15Å; F883-L890 HydrophobicContact CD1-CD2 4.49Å; F883-L890 HydrophobicContact CG-CD2 4.26Å; F883-L897 HydrophobicContact CE2-CD1 3.97Å; F883-L897 HydrophobicContact CZ-CD1 4.15Å; F883-V903 HydrophobicContact CD2-CG1 3.93Å; F883-V903 HydrophobicContact CE2-CG1 3.66Å; F883-S904 PolarHBondContact N-O 2.97Å; F883-I905 HydrophobicContact CB-CG1 4.36Å; F883-I905 HydrophobicContact CD2-CG1 4.43Å; F883-L906 PolarHBondContact O-N 3.39Å
884	V	97.6	Very high	94.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	113.4	177	-175.1	0	0	0	0	108.7	V847 V848 I850 V882 L906 V919	V847-V884 HydrophobicContact CG1-CG2 3.95Å; V848-V884 PolarHBondContact O-N 2.91Å; I850-V884 PolarHBondContact N-O 3.49Å; V882-V884 HydrophobicContact CG1-CG2 4.4Å; V884-L906 HydrophobicContact CG2-CB 4.39Å; V884-V919 HydrophobicContact CG2-CG1 4.27Å
885	G	95.8	Very high	94.9	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.6	-168.3	-176.1	0	0	0	0	0	113.4	G908	G885-G908 CarbonylContact C-O 3.4Å; G885-G908 WeakPolarHBondContact CA-O 3.43Å; G885-G908 PolarHBondContact O-N 3.25Å; G885-G908 VanDerWaalsContact O-O 3.1Å
886	S	95.6	Very high	94.9	Very high	23 Å²	23	39 Å²	39	16%	0.161	18%	0.181	C	C	.	.			trans	-59.3	134.9	176.2	159.4	0	0	0	0	111.5	G852 E888 Y889 L890	G852-S886 VanDerWaalsContact O-CB 3.27Å; G852-S886 WeakPolarHBondContact O-CB 3.26Å; S886-E888 PolarHBondContact OG-N 2.96Å; S886-E888 PolarHBondContact OG-OE2 3.01Å; S886-Y889 PolarHBondContact OG-N 3.48Å; S886-Y889 VanDerWaalsContact OG-N 3.1Å; S886-L890 WeakPolarHBondContact O-CG 3.06Å; S886-L890 PolarHBondContact O-N 3.43Å; S886-L890 VanDerWaalsContact O-N 3.16Å
887	I	95.1	Very high	95.1	Very high	29 Å²	29	33.7 Å²	33.7	15%	0.149	16%	0.157	C	C	.	.	H	α-helix	trans	-76.6	-26	172.9	-168.2	56.6	0	0	0	112.3	I827 I831 K891 I905 P907	I827-I887 HydrophobicContact CD1-CD1 3.97Å; I831-I887 HydrophobicContact CD1-CD1 3.8Å; I831-I887 HydrophobicContact CD1-CG1 4.42Å; I831-I887 HydrophobicContact CG1-CD1 4.15Å; I887-K891 HydrophobicContact CD1-CG 4.42Å; I887-K891 HydrophobicContact CG1-CD 4.21Å; I887-K891 HydrophobicContact CG1-CG 4.38Å; I887-K891 VanDerWaalsContact O-CB 3.29Å; I887-K891 WeakPolarHBondContact O-CB 3.32Å; I887-K891 WeakPolarHBondContact O-CD 3.31Å; I887-K891 WeakPolarHBondContact O-CG 3.44Å; I887-K891 PolarHBondContact O-N 3.14Å; I887-I905 HydrophobicContact CD1-CG2 4.09Å; I887-P907 HydrophobicContact CB-CB 4.04Å
888	E	94.6	Very high	95.3	Very high	106 Å²	106	33 Å²	33	50%	0.495	15%	0.154	S	C	.	.	H	α-helix	trans	-66.5	-42.1	173.9	-57.9	77.9	-157.2	0	0	111.3	V854 S886	V854-E888 HydrophobicContact CG2-CB 3.81Å; V854-E888 HydrophobicContact CG2-CG 4.12Å; S886-E888 PolarHBondContact OG-N 2.96Å; S886-E888 PolarHBondContact OG-OE2 3.01Å
889	Y	95.1	Very high	95.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.8	-53.7	173	-179.3	-90.7	0	0	0	111.2	I850 S856 L858 I859 L861 S886 K891 R892 E893 A932	I850-Y889 HydrophobicContact CG2-CD1 3.95Å; I850-Y889 HydrophobicContact CG2-CE1 3.98Å; S856-Y889 WeakPolarHBondContact OG-CD2 3.46Å; S856-Y889 WeakPolarHBondContact OG-CE2 3.34Å; L858-Y889 HydrophobicContact CD2-CE2 4.41Å; I859-Y889 WeakPolarHBondContact CG1-OH 3.37Å; I859-Y889 PolarHBondContact N-OH 2.94Å; L861-Y889 HydrophobicContact CD1-CE1 4.32Å; S886-Y889 PolarHBondContact OG-N 3.48Å; S886-Y889 VanDerWaalsContact OG-N 3.1Å; Y889-K891 PolarHBondContact O-N 3.04Å; Y889-R892 WeakPolarHBondContact O-CB 3.37Å; Y889-R892 PolarHBondContact O-N 3.42Å; Y889-E893 HydrophobicContact CD1-CG 4.43Å; Y889-E893 HydrophobicContact CE1-CG 3.62Å; Y889-E893 PolarHBondContact O-N 3.47Å; Y889-E893 PolarHBondContact OH-OE1 3.35Å; Y889-A932 HydrophobicContact CD2-CB 4.49Å; Y889-A932 HydrophobicContact CE2-CB 3.8Å
890	L	95.5	Very high	95.3	Very high	2 Å²	2	32 Å²	32	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-64	-26.9	-175.9	-72.1	170.9	0	0	0	113.5	I850 L861 F883 S886 R892 E893 W894 I905	I850-L890 HydrophobicContact CD1-CD2 3.88Å; L861-L890 HydrophobicContact CD1-CD2 3.82Å; F883-L890 HydrophobicContact CB-CD1 3.91Å; F883-L890 HydrophobicContact CB-CD2 4.15Å; F883-L890 HydrophobicContact CD1-CD2 4.49Å; F883-L890 HydrophobicContact CG-CD2 4.26Å; S886-L890 WeakPolarHBondContact O-CG 3.06Å; S886-L890 PolarHBondContact O-N 3.43Å; S886-L890 VanDerWaalsContact O-N 3.16Å; L890-R892 PolarHBondContact O-N 3.26Å; L890-E893 PolarHBondContact O-N 2.95Å; L890-W894 WeakPolarHBondContact O-CB 3.39Å; L890-W894 PolarHBondContact O-N 3.15Å; L890-I905 HydrophobicContact CB-CD1 4.38Å; L890-I905 HydrophobicContact CD1-CG1 4.36Å; L890-I905 HydrophobicContact CD1-CG2 3.64Å
891	K	95.1	Very high	95.2	Very high	114 Å²	114	29.9 Å²	29.9	50%	0.496	14%	0.14	S	C	.	.	H	α-helix	trans	-62.1	-27.2	171.9	-85.2	170.9	174.8	173.3	0	113.6	I827 I887 Y889	I827-K891 HydrophobicContact CD1-CG 3.66Å; I887-K891 HydrophobicContact CD1-CG 4.42Å; I887-K891 HydrophobicContact CG1-CD 4.21Å; I887-K891 HydrophobicContact CG1-CG 4.38Å; I887-K891 VanDerWaalsContact O-CB 3.29Å; I887-K891 WeakPolarHBondContact O-CB 3.32Å; I887-K891 WeakPolarHBondContact O-CD 3.31Å; I887-K891 WeakPolarHBondContact O-CG 3.44Å; I887-K891 PolarHBondContact O-N 3.14Å; Y889-K891 PolarHBondContact O-N 3.04Å
892	R	93.3	Very high	95.1	Very high	81 Å²	81	32.1 Å²	32.1	31%	0.306	15%	0.15	S	C	.	.	H	α-helix	trans	-78	-44.3	175.7	-61.8	160.4	59.4	-153.6	-2.7	111.4	D853 V854 S856 L858 Y889 L890 W894	D853-R892 PolarHBondContact O-NH1 3.2Å; D853-R892 VanDerWaalsContact O-NH1 3.17Å; V854-R892 PolarHBondContact O-NH1 2.85Å; V854-R892 VanDerWaalsContact O-NH1 3.16Å; S856-R892 VanDerWaalsContact O-CZ 3.26Å; S856-R892 PolarHBondContact O-NH1 2.89Å; S856-R892 PolarHBondContact O-NH2 3.04Å; L858-R892 HydrophobicContact CD2-CB 3.91Å; Y889-R892 WeakPolarHBondContact O-CB 3.37Å; Y889-R892 PolarHBondContact O-N 3.42Å; L890-R892 PolarHBondContact O-N 3.26Å; R892-W894 VanDerWaalsContact C-N 3.33Å; R892-W894 PolarHBondContact O-N 2.98Å
893	E	93.8	Very high	95	Very high	3 Å²	3	32.3 Å²	32.3	1%	0.014	15%	0.151	C	C	.	.	H	α-helix	trans	-69.3	-26.6	178.2	-72	-90.8	-173.7	0	0	113.5	L858 I859 G860 L861 Y889 L890 E895 T896 L897	L858-E893 HydrophobicContact CD2-CG 4.22Å; I859-E893 PolarHBondContact N-OE1 3.41Å; I859-E893 VanDerWaalsContact N-OE1 3.08Å; G860-E893 PolarHBondContact N-OE1 2.96Å; L861-E893 WeakPolarHBondContact CB-OE2 3.34Å; L861-E893 HydrophobicContact CD1-CB 4.01Å; L861-E893 HydrophobicContact CD1-CG 3.77Å; L861-E893 HydrophobicContact CG-CG 4.12Å; L861-E893 PolarHBondContact N-OE2 3.46Å; Y889-E893 HydrophobicContact CD1-CG 4.43Å; Y889-E893 HydrophobicContact CE1-CG 3.62Å; Y889-E893 PolarHBondContact O-N 3.47Å; Y889-E893 PolarHBondContact OH-OE1 3.35Å; L890-E893 PolarHBondContact O-N 2.95Å; E893-E895 VanDerWaalsContact C-N 3.27Å; E893-E895 PolarHBondContact O-N 3.49Å; E893-E895 VanDerWaalsContact O-N 3.15Å; E893-T896 PolarHBondContact O-N 3.41Å; E893-T896 PolarHBondContact O-OG1 3.14Å; E893-L897 HydrophobicContact CB-CD1 4.37Å
894	W	95.3	Very high	95	Very high	18 Å²	18	32.9 Å²	32.9	7%	0.068	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-60.2	-29.2	-167.6	-170	-110.8	0	0	0	115	K825 I827 V830 L890 R892 T896 L897 H898 V903 I905	K825-W894 HydrophobicContact CB-CZ2 4.31Å; K825-W894 PolarHBondContact O-NE1 2.78Å; I827-W894 HydrophobicContact CB-CG 4.13Å; I827-W894 HydrophobicContact CD1-CB 4.03Å; I827-W894 HydrophobicContact CD1-CD2 4.46Å; I827-W894 HydrophobicContact CD1-CG 3.98Å; I827-W894 HydrophobicContact CG1-CD2 4.07Å; I827-W894 HydrophobicContact CG1-CG 3.92Å; V830-W894 HydrophobicContact CB-CH2 4.16Å; V830-W894 HydrophobicContact CB-CZ2 4.35Å; V830-W894 HydrophobicContact CG1-CH2 3.88Å; V830-W894 HydrophobicContact CG1-CZ2 3.92Å; V830-W894 HydrophobicContact CG2-CH2 3.52Å; V830-W894 HydrophobicContact CG2-CZ2 3.53Å; V830-W894 HydrophobicContact CG2-CZ3 4.02Å; L890-W894 WeakPolarHBondContact O-CB 3.39Å; L890-W894 PolarHBondContact O-N 3.15Å; R892-W894 VanDerWaalsContact C-N 3.33Å; R892-W894 PolarHBondContact O-N 2.98Å; W894-T896 PolarHBondContact O-N 3.48Å; W894-L897 HydrophobicContact CD2-CB 4.44Å; W894-L897 HydrophobicContact CE3-CB 3.74Å; W894-L897 HydrophobicContact CE3-CD1 4.18Å; W894-L897 HydrophobicContact CZ3-CB 3.84Å; W894-L897 HydrophobicContact CZ3-CD1 4.44Å; W894-L897 PolarHBondContact O-N 3.41Å; W894-H898 HydrophobicContact CD2-CB 4.49Å; W894-H898 HydrophobicContact CZ2-CB 4.05Å; W894-H898 PolarHBondContact O-N 3.3Å; W894-V903 HydrophobicContact CH2-CB 4.45Å; W894-V903 HydrophobicContact CH2-CG1 4.13Å; W894-V903 HydrophobicContact CZ3-CG1 3.85Å; W894-I905 HydrophobicContact CE3-CD1 3.89Å; W894-I905 HydrophobicContact CZ3-CD1 4.16Å
895	E	91.2	Very high	95	Very high	133 Å²	133	33 Å²	33	62%	0.621	16%	0.156	S	C	*	.	G	3₁₀ helix	trans	-58.4	-28.4	174.9	66	179.7	-154.8	0	0	112.8	E893	E893-E895 VanDerWaalsContact C-N 3.27Å; E893-E895 PolarHBondContact O-N 3.49Å; E893-E895 VanDerWaalsContact O-N 3.15Å
896	T	92	Very high	95	Very high	36 Å²	36	33 Å²	33	22%	0.221	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-87.9	-12.7	177.7	76.4	0	0	0	0	113.4	E893 W894	E893-T896 PolarHBondContact O-N 3.41Å; E893-T896 PolarHBondContact O-OG1 3.14Å; W894-T896 PolarHBondContact O-N 3.48Å
897	L	95.1	Very high	95	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-22.5	-169.5	-63.4	-179.2	0	0	0	114.2	L861 R862 V865 F883 E893 W894 N899 F900	L861-L897 HydrophobicContact CB-CD1 4.19Å; L861-L897 HydrophobicContact CB-CD2 4.32Å; L861-L897 HydrophobicContact CD1-CD1 4.36Å; R862-L897 HydrophobicContact CB-CD2 4.3Å; V865-L897 HydrophobicContact CB-CD2 4.25Å; V865-L897 HydrophobicContact CG2-CD2 3.91Å; F883-L897 HydrophobicContact CE2-CD1 3.97Å; F883-L897 HydrophobicContact CZ-CD1 4.15Å; E893-L897 HydrophobicContact CB-CD1 4.37Å; W894-L897 HydrophobicContact CD2-CB 4.44Å; W894-L897 HydrophobicContact CE3-CB 3.74Å; W894-L897 HydrophobicContact CE3-CD1 4.18Å; W894-L897 HydrophobicContact CZ3-CB 3.84Å; W894-L897 HydrophobicContact CZ3-CD1 4.44Å; W894-L897 PolarHBondContact O-N 3.41Å; L897-N899 PolarHBondContact O-N 2.93Å; L897-F900 HydrophobicContact CD2-CD2 4.39Å; L897-F900 HydrophobicContact CD2-CE2 4.49Å; L897-F900 WeakPolarHBondContact O-CD2 3.45Å; L897-F900 PolarHBondContact O-N 2.95Å
898	H	94.6	Very high	94.9	Very high	50 Å²	50	34.4 Å²	34.4	23%	0.231	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-8.7	-166.5	63.3	28.4	0	0	0	116.5	P824 K825 W894	P824-H898 WeakPolarHBondContact CA-O 3.43Å; K825-H898 PolarHBondContact N-O 2.86Å; K825-H898 VanDerWaalsContact N-O 3.12Å; W894-H898 HydrophobicContact CD2-CB 4.49Å; W894-H898 HydrophobicContact CZ2-CB 4.05Å; W894-H898 PolarHBondContact O-N 3.3Å
899	N	94.8	Very high	95	Very high	19 Å²	19	32.2 Å²	32.2	10%	0.102	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	1.2	175.5	-70.9	108.5	0	0	0	114.7	W821 C822 L897	W821-N899 WeakPolarHBondContact CZ2-ND2 3.42Å; W821-N899 PolarHBondContact NE1-ND2 3.15Å; C822-N899 PolarHBondContact N-O 2.84Å; C822-N899 PolarHBondContact O-ND2 3.13Å; C822-N899 VanDerWaalsContact SG-C 3.57Å; C822-N899 PolarHBondContact SG-O 3.19Å; C822-N899 VanDerWaalsContact SG-O 3.41Å; L897-N899 PolarHBondContact O-N 2.93Å
900	F	95.8	Very high	95	Very high	6 Å²	6	32.3 Å²	32.3	3%	0.026	17%	0.167	C	C	.	.			trans	-93	138.9	-179.9	-65.9	-65.8	0	0	0	113.3	K825 R862 V865 M866 R869 L897 V903 L1086	K825-F900 PolarHBondContact NZ-O 2.83Å; R862-F900 HydrophobicContact CG-CE2 4.42Å; V865-F900 HydrophobicContact CB-CD2 4.21Å; V865-F900 HydrophobicContact CB-CE2 4.34Å; V865-F900 HydrophobicContact CG1-CB 3.84Å; V865-F900 HydrophobicContact CG1-CD1 4.1Å; V865-F900 HydrophobicContact CG1-CD2 3.5Å; V865-F900 VanDerWaalsContact CG1-CD2 3.5Å; V865-F900 HydrophobicContact CG1-CE2 4.03Å; V865-F900 HydrophobicContact CG1-CG 3.54Å; M866-F900 HydrophobicContact CB-CE1 4.5Å; M866-F900 HydrophobicContact CB-CZ 4.06Å; M866-F900 HydrophobicContact CG-CZ 4.28Å; R869-F900 HydrophobicContact CB-CD1 3.84Å; R869-F900 HydrophobicContact CB-CE1 4.15Å; R869-F900 HydrophobicContact CG-CB 4.38Å; R869-F900 HydrophobicContact CG-CD1 3.8Å; R869-F900 HydrophobicContact CG-CE1 4.47Å; R869-F900 HydrophobicContact CG-CG 4.32Å; L897-F900 HydrophobicContact CD2-CD2 4.39Å; L897-F900 HydrophobicContact CD2-CE2 4.49Å; L897-F900 WeakPolarHBondContact O-CD2 3.45Å; L897-F900 PolarHBondContact O-N 2.95Å; F900-V903 HydrophobicContact CB-CG2 4.02Å; F900-L1086 HydrophobicContact CZ-CD1 4.04Å
901	P	95.1	Very high	95	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.006	18%	0.184	C	C	.	.	S	Bend	trans	-77	160.8	172.7	31.8	-34.5	0	0	0	112.1	H820 R869 Y875 L878 V903	H820-P901 HydrophobicContact CB-CG 4.01Å; R869-P901 PolarHBondContact NE-O 3.18Å; R869-P901 PolarHBondContact NH2-O 3.01Å; Y875-P901 HydrophobicContact CE2-CB 3.57Å; Y875-P901 HydrophobicContact CE2-CG 3.94Å; L878-P901 HydrophobicContact CD1-CG 4.16Å; P901-V903 PolarHBondContact O-N 3.14Å
902	K	95.6	Very high	95.1	Very high	49 Å²	49	31.6 Å²	31.6	21%	0.213	17%	0.17	C	C	.	.	S	Bend	trans	49.9	55	177.9	-61	-169.6	-170.2	179.4	0	114.2	R869 Y875 H876 L878 H880 I881	R869-K902 PolarHBondContact NH2-O 3.45Å; Y875-K902 WeakPolarHBondContact O-CE 3.33Å; Y875-K902 PolarHBondContact O-NZ 3.3Å; H876-K902 PolarHBondContact O-NZ 3.17Å; H876-K902 VanDerWaalsContact O-NZ 3.12Å; L878-K902 HydrophobicContact CB-CD 4.13Å; L878-K902 WeakPolarHBondContact O-CD 3.36Å; L878-K902 PolarHBondContact O-NZ 3.39Å; H880-K902 HydrophobicContact CB-CB 4.37Å; H880-K902 WeakPolarHBondContact ND1-CB 3.07Å; I881-K902 PolarHBondContact N-O 3.04Å
903	V	97	Very high	95.2	Very high	6 Å²	6	32.5 Å²	32.5	4%	0.036	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	136	174.3	-178.1	0	0	0	0	108.4	V830 V865 I881 F883 W894 F900 P901	V830-V903 WeakPolarHBondContact CG1-O 3.31Å; V865-V903 HydrophobicContact CG1-CG2 4.44Å; I881-V903 CarbonylContact O-C 3.59Å; I881-V903 WeakPolarHBondContact O-CA 3.28Å; F883-V903 HydrophobicContact CD2-CG1 3.93Å; F883-V903 HydrophobicContact CE2-CG1 3.66Å; W894-V903 HydrophobicContact CH2-CB 4.45Å; W894-V903 HydrophobicContact CH2-CG1 4.13Å; W894-V903 HydrophobicContact CZ3-CG1 3.85Å; F900-V903 HydrophobicContact CB-CG2 4.02Å; P901-V903 PolarHBondContact O-N 3.14Å
904	S	96.8	Very high	95.2	Very high	13 Å²	13	34.5 Å²	34.5	9%	0.091	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	158.8	175.6	-65.6	0	0	0	0	111.2	V830 H880 I881 V882 F883	V830-S904 CarbonylContact O-C 3.45Å; V830-S904 VanDerWaalsContact O-CA 3.29Å; V830-S904 WeakPolarHBondContact O-CA 3.45Å; H880-S904 PolarHBondContact NE2-OG 3.48Å; I881-S904 PolarHBondContact O-N 3.38Å; V882-S904 WeakPolarHBondContact CA-O 3.43Å; F883-S904 PolarHBondContact N-O 2.97Å
905	I	97.7	Very high	95.2	Very high	1 Å²	1	34 Å²	34	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.8	177.3	-65.1	171.2	0	0	0	108.6	I827 V830 I831 L832 F883 I887 L890 W894	I827-I905 HydrophobicContact CD1-CD1 3.95Å; I827-I905 HydrophobicContact CG1-CD1 3.85Å; V830-I905 HydrophobicContact CG2-CD1 4.04Å; V830-I905 HydrophobicContact CG2-CG1 4.34Å; V830-I905 PolarHBondContact O-N 2.93Å; I831-I905 CarbonylContact C-O 3.55Å; I831-I905 WeakPolarHBondContact CA-O 3.49Å; I831-I905 HydrophobicContact CG1-CB 4.3Å; I831-I905 HydrophobicContact CG1-CG2 4.39Å; L832-I905 PolarHBondContact N-O 2.87Å; F883-I905 HydrophobicContact CB-CG1 4.36Å; F883-I905 HydrophobicContact CD2-CG1 4.43Å; I887-I905 HydrophobicContact CD1-CG2 4.09Å; L890-I905 HydrophobicContact CB-CD1 4.38Å; L890-I905 HydrophobicContact CD1-CG1 4.36Å; L890-I905 HydrophobicContact CD1-CG2 3.64Å; W894-I905 HydrophobicContact CE3-CD1 3.89Å; W894-I905 HydrophobicContact CZ3-CD1 4.16Å
906	L	97.2	Very high	95.5	Very high	3 Å²	3	27.6 Å²	27.6	2%	0.016	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	104.6	165.8	176.4	59.8	0	0	0	108.2	L832 V882 F883 V884 G908 D915 V919	L832-L906 VanDerWaalsContact O-CD1 3.31Å; L832-L906 WeakPolarHBondContact O-CD1 3.27Å; V882-L906 HydrophobicContact CG1-CB 4.36Å; F883-L906 PolarHBondContact O-N 3.39Å; V884-L906 HydrophobicContact CG2-CB 4.39Å; L906-G908 PolarHBondContact O-N 3.12Å; L906-D915 HydrophobicContact CD2-CB 3.85Å; L906-V919 HydrophobicContact CD2-CG1 3.56Å
907	P	95.7	Very high	95.6	Very high	49 Å²	49	31 Å²	31	32%	0.318	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	121.2	177.9	29	-34.6	0	0	0	109.9	I831 L832 I887	I831-P907 HydrophobicContact CG2-CG 4.17Å; L832-P907 WeakPolarHBondContact O-CD 3.2Å; I887-P907 HydrophobicContact CB-CB 4.04Å
908	G	92.9	Very high	95.5	Very high	32 Å²	32	31.2 Å²	31.2	33%	0.33	17%	0.17	S	C	.	.	S	Bend	trans	172.8	-152.6	-172.9	0	0	0	0	0	112.7	G885 L906	G885-G908 CarbonylContact C-O 3.4Å; G885-G908 WeakPolarHBondContact CA-O 3.43Å; G885-G908 PolarHBondContact O-N 3.25Å; G885-G908 VanDerWaalsContact O-O 3.1Å; L906-G908 PolarHBondContact O-N 3.12Å
909	T	94.7	Very high	95.5	Very high	60 Å²	60	28.9 Å²	28.9	37%	0.368	16%	0.159	S	C	.	.			trans	-134.4	137.8	174.9	173.2	0	0	0	0	110.9	L911 S912	T909-L911 PolarHBondContact O-N 3.39Å; T909-L911 VanDerWaalsContact O-N 3.11Å; T909-L911 PolarHBondContact OG1-N 3.31Å; T909-S912 VanDerWaalsContact O-CB 3.28Å; T909-S912 WeakPolarHBondContact O-CB 3.4Å; T909-S912 PolarHBondContact O-N 3.01Å
910	P	95.4	Very high	95.4	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.013	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-21.6	174.7	-27.6	36.3	0	0	0	115.2	C849 F851 S912 L916	C849-P910 HydrophobicContact CB-CB 3.68Å; C849-P910 HydrophobicContact CB-CG 3.59Å; F851-P910 HydrophobicContact CE1-CB 4.35Å; F851-P910 HydrophobicContact CE1-CG 4.27Å; F851-P910 HydrophobicContact CE2-CB 4.04Å; F851-P910 HydrophobicContact CE2-CG 4.11Å; F851-P910 HydrophobicContact CZ-CB 3.7Å; F851-P910 HydrophobicContact CZ-CG 3.95Å; P910-S912 VanDerWaalsContact C-N 3.25Å; P910-S912 PolarHBondContact O-N 3.05Å; P910-L916 VanDerWaalsContact O-CD1 3.29Å; P910-L916 WeakPolarHBondContact O-CD1 3.35Å
911	L	96.1	Very high	95.3	Very high	73 Å²	73	29.4 Å²	29.4	38%	0.382	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-18.6	176.8	-59.4	175.9	0	0	0	112.3	F851 T909 R913 L949 A950 N953	F851-L911 HydrophobicContact CE1-CD1 4.17Å; F851-L911 HydrophobicContact CE1-CD2 4.39Å; F851-L911 HydrophobicContact CE1-CG 3.89Å; F851-L911 HydrophobicContact CZ-CD2 3.98Å; F851-L911 HydrophobicContact CZ-CG 3.93Å; T909-L911 PolarHBondContact O-N 3.39Å; T909-L911 VanDerWaalsContact O-N 3.11Å; T909-L911 PolarHBondContact OG1-N 3.31Å; L911-R913 PolarHBondContact O-N 3.5Å; L911-L949 HydrophobicContact CD2-CB 4.2Å; L911-A950 HydrophobicContact CD2-CB 4.25Å; L911-N953 PolarHBondContact O-ND2 3.23Å
912	S	96.9	Very high	95.2	Very high	28 Å²	28	30.8 Å²	30.8	20%	0.196	17%	0.17	C	C	.	.			trans	-76.8	101.4	179	175.1	0	0	0	0	111.4	T909 P910 A914 D915 L916	T909-S912 VanDerWaalsContact O-CB 3.28Å; T909-S912 WeakPolarHBondContact O-CB 3.4Å; T909-S912 PolarHBondContact O-N 3.01Å; P910-S912 VanDerWaalsContact C-N 3.25Å; P910-S912 PolarHBondContact O-N 3.05Å; S912-A914 PolarHBondContact O-N 2.63Å; S912-D915 WeakPolarHBondContact CB-OD2 3.42Å; S912-D915 PolarHBondContact O-N 3.32Å; S912-D915 PolarHBondContact OG-N 3.34Å; S912-D915 PolarHBondContact OG-OD2 2.88Å; S912-L916 PolarHBondContact O-N 3.34Å; S912-L916 VanDerWaalsContact O-N 3.13Å
913	R	95.2	Very high	95	Very high	100 Å²	100	31 Å²	31	38%	0.377	17%	0.173	S	C	.	.	H	α-helix	trans	-53.7	-25.8	172.4	-65.7	-175.5	-176.4	-139.9	-15.3	113.1	L911 R917 N953 S956 M957	L911-R913 PolarHBondContact O-N 3.5Å; R913-R917 WeakPolarHBondContact O-CB 3.44Å; R913-R917 VanDerWaalsContact O-CG 3.26Å; R913-R917 WeakPolarHBondContact O-CG 3.33Å; R913-R917 PolarHBondContact O-N 3.36Å; R913-N953 VanDerWaalsContact CZ-OD1 3.27Å; R913-N953 PolarHBondContact NE-OD1 3.01Å; R913-N953 PolarHBondContact NH2-O 3.02Å; R913-N953 PolarHBondContact NH2-OD1 3.47Å; R913-S956 PolarHBondContact NH1-O 3.23Å; R913-S956 VanDerWaalsContact NH1-O 3.1Å; R913-S956 PolarHBondContact NH2-OG 3.08Å; R913-M957 HydrophobicContact CB-CE 4.31Å; R913-M957 HydrophobicContact CG-CG 4.42Å; R913-M957 HydrophobicContact CG-SD 4.36Å
914	A	94.6	Very high	94.9	Very high	45 Å²	45	31.1 Å²	31.1	37%	0.372	17%	0.174	S	C	.	.	H	α-helix	trans	-70.1	-35.8	177.2	0	0	0	0	0	112.7	S912 A918	S912-A914 PolarHBondContact O-N 2.63Å; A914-A918 WeakPolarHBondContact O-CB 3.23Å; A914-A918 PolarHBondContact O-N 3.06Å
915	D	96	Very high	94.8	Very high	6 Å²	6	32.7 Å²	32.7	3%	0.032	18%	0.181	C	C	.	.	H	α-helix	trans	-78.1	-41.3	177.1	-63.4	-56.8	0	0	0	110.9	R834 L906 S912 R917 A918 V919	R834-D915 IonicContact CZ-OD1 2.69Å; R834-D915 IonicContact CZ-OD2 3.66Å; R834-D915 IonicContact NE-OD1 2.82Å; R834-D915 PolarHBondContact NE-OD1 3.44Å; R834-D915 IonicContact NE-OD2 3.57Å; R834-D915 IonicContact NH2-OD1 3.92Å; R834-D915 PolarHBondContact NH2-OD1 3.09Å; R834-D915 IonicContact NH2-OD2 3.19Å; R834-D915 PolarHBondContact NH2-OD2 3.4Å; L906-D915 HydrophobicContact CD2-CB 3.85Å; S912-D915 WeakPolarHBondContact CB-OD2 3.42Å; S912-D915 PolarHBondContact O-N 3.32Å; S912-D915 PolarHBondContact OG-N 3.34Å; S912-D915 PolarHBondContact OG-OD2 2.88Å; D915-R917 VanDerWaalsContact C-N 3.33Å; D915-R917 PolarHBondContact O-N 3.13Å; D915-A918 PolarHBondContact O-N 3.43Å; D915-A918 VanDerWaalsContact O-N 3.12Å; D915-V919 PolarHBondContact O-N 2.95Å
916	L	95.8	Very high	94.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.4	-38.3	172.9	-60.6	-179.6	0	0	0	112.9	P910 S912 V919 I921 I954 M957	P910-L916 VanDerWaalsContact O-CD1 3.29Å; P910-L916 WeakPolarHBondContact O-CD1 3.35Å; S912-L916 PolarHBondContact O-N 3.34Å; S912-L916 VanDerWaalsContact O-N 3.13Å; L916-V919 VanDerWaalsContact O-CG2 3.32Å; L916-V919 WeakPolarHBondContact O-CG2 3.39Å; L916-I921 HydrophobicContact CB-CD1 4.49Å; L916-I921 HydrophobicContact CB-CG2 4.19Å; L916-I921 HydrophobicContact CD2-CD1 3.96Å; L916-I921 WeakPolarHBondContact O-CB 3.45Å; L916-I921 VanDerWaalsContact O-CG2 3.29Å; L916-I921 WeakPolarHBondContact O-CG2 3.42Å; L916-I921 PolarHBondContact O-N 2.96Å; L916-I954 HydrophobicContact CD1-CG1 3.74Å; L916-M957 HydrophobicContact CB-CE 4.11Å; L916-M957 HydrophobicContact CB-SD 4.15Å; L916-M957 HydrophobicContact CD1-SD 3.87Å
917	R	93.8	Very high	94.8	Very high	106 Å²	106	32.6 Å²	32.6	40%	0.4	18%	0.181	S	C	.	.	H	α-helix	trans	-67.1	-40.1	172.2	-77.4	-174	-172.3	-69.4	7.1	112.2	R913 D915 V919 N920 M957 Q958 F959	R913-R917 WeakPolarHBondContact O-CB 3.44Å; R913-R917 VanDerWaalsContact O-CG 3.26Å; R913-R917 WeakPolarHBondContact O-CG 3.33Å; R913-R917 PolarHBondContact O-N 3.36Å; D915-R917 VanDerWaalsContact C-N 3.33Å; D915-R917 PolarHBondContact O-N 3.13Å; R917-V919 VanDerWaalsContact C-N 3.3Å; R917-V919 PolarHBondContact O-N 3.46Å; R917-N920 PolarHBondContact O-N 3.37Å; R917-M957 HydrophobicContact CG-CE 3.59Å; R917-Q958 VanDerWaalsContact CZ-O 3.24Å; R917-Q958 PolarHBondContact NH1-O 2.68Å; R917-Q958 PolarHBondContact NH2-O 3.09Å; R917-F959 HydrophobicContact CG-CE1 4.41Å
918	A	93.3	Very high	94.9	Very high	7 Å²	7	30.3 Å²	30.3	6%	0.058	17%	0.166	C	C	.	.	H	α-helix	trans	-68.4	-24.7	-176.7	0	0	0	0	0	114.3	R834 A837 A838 A914 D915 N920	R834-A918 HydrophobicContact CB-CB 4.46Å; R834-A918 HydrophobicContact CG-CB 3.42Å; R834-A918 VanDerWaalsContact CG-CB 3.42Å; A837-A918 CarbonylContact C-O 3.51Å; A837-A918 HydrophobicContact CB-CB 4.33Å; A838-A918 HydrophobicContact CB-CB 4.47Å; A838-A918 PolarHBondContact N-O 3.01Å; A914-A918 WeakPolarHBondContact O-CB 3.23Å; A914-A918 PolarHBondContact O-N 3.06Å; D915-A918 PolarHBondContact O-N 3.43Å; D915-A918 VanDerWaalsContact O-N 3.12Å; A918-N920 VanDerWaalsContact C-N 3.32Å
919	V	94.5	Very high	95.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-2.3	170.8	-57.9	0	0	0	0	113.6	H845 V847 V882 V884 L906 D915 L916 R917 I921	H845-V919 PolarHBondContact CE1-O 3.22Å; H845-V919 PolarHBondContact NE2-O 2.91Å; V847-V919 HydrophobicContact CG1-CG2 4.24Å; V847-V919 HydrophobicContact CG2-CB 4.49Å; V847-V919 HydrophobicContact CG2-CG2 3.9Å; V882-V919 HydrophobicContact CG1-CG1 3.9Å; V884-V919 HydrophobicContact CG2-CG1 4.27Å; L906-V919 HydrophobicContact CD2-CG1 3.56Å; D915-V919 PolarHBondContact O-N 2.95Å; L916-V919 VanDerWaalsContact O-CG2 3.32Å; L916-V919 WeakPolarHBondContact O-CG2 3.39Å; R917-V919 VanDerWaalsContact C-N 3.3Å; R917-V919 PolarHBondContact O-N 3.46Å; V919-I921 HydrophobicContact CG2-CB 4.35Å
920	N	93.3	Very high	95.1	Very high	36 Å²	36	26 Å²	26	19%	0.193	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	52.7	-173	-46.4	-72.7	0	0	0	112.7	R917 A918 N922 L923	R917-N920 PolarHBondContact O-N 3.37Å; A918-N920 VanDerWaalsContact C-N 3.32Å; N920-N922 PolarHBondContact O-N 3.43Å; N920-L923 HydrophobicContact CB-CB 4.45Å; N920-L923 HydrophobicContact CB-CD1 4.33Å; N920-L923 PolarHBondContact O-N 3.07Å
921	I	94.6	Very high	94.8	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-56.9	-23.1	-177.8	-167.2	163.2	0	0	0	114.4	L916 V919 L923 C924 C927 I954 M957 F959 I1003	L916-I921 HydrophobicContact CB-CD1 4.49Å; L916-I921 HydrophobicContact CB-CG2 4.19Å; L916-I921 HydrophobicContact CD2-CD1 3.96Å; L916-I921 WeakPolarHBondContact O-CB 3.45Å; L916-I921 VanDerWaalsContact O-CG2 3.29Å; L916-I921 WeakPolarHBondContact O-CG2 3.42Å; L916-I921 PolarHBondContact O-N 2.96Å; V919-I921 HydrophobicContact CG2-CB 4.35Å; I921-L923 PolarHBondContact O-N 3.33Å; I921-C924 PolarHBondContact O-N 3.13Å; I921-C924 PolarHBondContact O-SG 3.3Å; I921-C927 HydrophobicContact CD1-CB 4.19Å; I921-I954 HydrophobicContact CD1-CD1 3.95Å; I921-I954 HydrophobicContact CD1-CG1 4Å; I921-I954 HydrophobicContact CD1-CG2 4.03Å; I921-M957 HydrophobicContact CG2-CE 4.4Å; I921-F959 HydrophobicContact CG2-CE1 4.06Å; I921-F959 HydrophobicContact CG2-CZ 3.76Å; I921-I1003 HydrophobicContact CG1-CD1 4.44Å; I921-I1003 HydrophobicContact CG1-CG2 4.27Å; I921-I1003 HydrophobicContact CG2-CD1 4.19Å
922	N	91.8	Very high	94.3	Very high	30 Å²	30	22.9 Å²	22.9	16%	0.16	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-74.3	-1.9	173.3	65.3	-45	0	0	0	114.3	N920 F959 I997 I1003	N920-N922 PolarHBondContact O-N 3.43Å; N922-F959 HydrophobicContact CB-CB 4.5Å; N922-F959 HydrophobicContact CB-CD1 3.7Å; N922-F959 HydrophobicContact CB-CD2 3.85Å; N922-F959 HydrophobicContact CB-CE1 3.77Å; N922-F959 HydrophobicContact CB-CE2 3.93Å; N922-F959 HydrophobicContact CB-CG 3.76Å; N922-F959 HydrophobicContact CB-CZ 3.88Å; N922-F959 VanDerWaalsContact CG-CD1 3.45Å; N922-I997 HydrophobicContact CB-CB 4.27Å; N922-I1003 HydrophobicContact CB-CD1 4.45Å
923	L	92.4	Very high	93.3	Very high	54 Å²	54	22.4 Å²	22.4	28%	0.283	11%	0.113	S	C	.	.	G	3₁₀ helix	trans	-124.1	17.3	176	-56.8	178.2	0	0	0	112	S843 G844 N920 I921	S843-L923 WeakPolarHBondContact CA-O 3.46Å; G844-L923 PolarHBondContact N-O 3.35Å; G844-L923 VanDerWaalsContact N-O 3.09Å; N920-L923 HydrophobicContact CB-CB 4.45Å; N920-L923 HydrophobicContact CB-CD1 4.33Å; N920-L923 PolarHBondContact O-N 3.07Å; I921-L923 PolarHBondContact O-N 3.33Å
924	C	94.7	Very high	91.9	Very high	9 Å²	9	19 Å²	19	6%	0.061	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	151.1	172.2	80.9	0	0	0	0	111.3	H845 V847 I921 M926	H845-C924 CarbonylContact O-C 3.58Å; H845-C924 VanDerWaalsContact O-CA 3.31Å; H845-C924 WeakPolarHBondContact O-CA 3.33Å; H845-C924 VanDerWaalsContact O-CB 3.32Å; H845-C924 WeakPolarHBondContact O-CB 3.38Å; V847-C924 HydrophobicContact CG2-CB 3.99Å; I921-C924 PolarHBondContact O-N 3.13Å; I921-C924 PolarHBondContact O-SG 3.3Å; C924-M926 VanDerWaalsContact SG-C 3.54Å
925	D	94.1	Very high	90.4	Very high	46 Å²	46	18.5 Å²	18.5	25%	0.246	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-22.6	171.9	-79.4	0.1	0	0	0	111.9	G844 H845 K879 P1004	G844-D925 WeakPolarHBondContact CA-OD1 3.14Å; H845-D925 PolarHBondContact O-N 3.21Å; K879-D925 HydrophobicContact CD-CB 4.16Å; K879-D925 WeakPolarHBondContact CD-OD2 3.3Å; K879-D925 WeakPolarHBondContact CE-OD2 3.25Å; K879-D925 IonicContact NZ-OD2 3.79Å; K879-D925 PolarHBondContact NZ-OD2 2.85Å; D925-P1004 VanDerWaalsContact O-CG 3.25Å; D925-P1004 WeakPolarHBondContact O-CG 3.48Å
926	M	96.7	Very high	88.5	Confident	2 Å²	2	23 Å²	23	1%	0.01	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	135.8	174.6	-166.8	56.5	60.7	0	0	110.4	C563 Q566 V846 V847 C924 V928 P1004 I1006	C563-M926 HydrophobicContact CB-CB 4.09Å; C563-M926 HydrophobicContact CB-CG 4.34Å; C563-M926 VanDerWaalsContact SG-CG 3.59Å; Q566-M926 HydrophobicContact CB-CE 3.93Å; Q566-M926 HydrophobicContact CG-CE 3.75Å; V846-M926 WeakPolarHBondContact CA-O 3.35Å; V847-M926 PolarHBondContact N-O 3.01Å; C924-M926 VanDerWaalsContact SG-C 3.54Å; M926-V928 HydrophobicContact CG-CG2 4.03Å; M926-P1004 HydrophobicContact CE-CB 3.88Å; M926-P1004 HydrophobicContact SD-CB 4.03Å; M926-I1006 HydrophobicContact CG-CG2 3.81Å; M926-I1006 HydrophobicContact SD-CB 4.07Å; M926-I1006 HydrophobicContact SD-CG2 3.78Å
927	C	97.7	Very high	87.1	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120	159.9	-175.5	0	0	0	0	108.9	V847 I921 P1004 I1005 I1006	V847-C927 CarbonylContact O-C 3.59Å; V847-C927 WeakPolarHBondContact O-CA 3.4Å; I921-C927 HydrophobicContact CD1-CB 4.19Å; C927-P1004 PolarHBondContact N-O 2.87Å; C927-I1005 HydrophobicContact CB-CG1 4.26Å; C927-I1005 CarbonylContact O-C 3.54Å; C927-I1005 WeakPolarHBondContact O-CA 3.14Å; C927-I1006 PolarHBondContact O-N 2.92Å
928	V	98.3	Very high	85.7	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.4	176.5	-179.3	0	0	0	0	108.5	I559 C563 V846 V847 V848 C849 M926 L930 I1006	I559-V928 HydrophobicContact CG2-CB 4.36Å; I559-V928 HydrophobicContact CG2-CG1 3.47Å; I559-V928 VanDerWaalsContact CG2-CG1 3.47Å; I559-V928 HydrophobicContact CG2-CG2 3.91Å; C563-V928 WeakPolarHBondContact SG-CG2 3.24Å; V846-V928 HydrophobicContact CG1-CG2 4.1Å; V847-V928 PolarHBondContact O-N 3.43Å; V848-V928 CarbonylContact C-O 3.53Å; V848-V928 WeakPolarHBondContact CA-O 3.26Å; V848-V928 HydrophobicContact CG1-CB 4.3Å; V848-V928 HydrophobicContact CG1-CG1 4.38Å; V848-V928 HydrophobicContact CG2-CB 4.33Å; C849-V928 PolarHBondContact N-O 2.98Å; M926-V928 HydrophobicContact CG-CG2 4.03Å; V928-L930 HydrophobicContact CG1-CD1 4.34Å; V928-L930 HydrophobicContact CG1-CD2 3.74Å; V928-L930 HydrophobicContact CG1-CG 3.88Å; V928-I1006 WeakPolarHBondContact CA-O 3.23Å; V928-I1006 HydrophobicContact CB-CG2 4.37Å; V928-I1006 HydrophobicContact CG1-CG2 4.45Å; V928-I1006 HydrophobicContact CG2-CG2 3.9Å
929	I	97.6	Very high	84.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	118.1	179.3	-54.5	177.8	0	0	0	109.4	C849 F851 C947 A950 I954 I1005 I1006 T1007 E1008	C849-I929 HydrophobicContact CB-CG1 4.2Å; F851-I929 HydrophobicContact CE2-CG2 4.22Å; I929-C947 HydrophobicContact CG2-CB 4.16Å; I929-A950 HydrophobicContact CD1-CB 4.03Å; I929-A950 HydrophobicContact CG2-CB 4.15Å; I929-I954 HydrophobicContact CD1-CD1 3.89Å; I929-I1005 HydrophobicContact CD1-CG2 3.62Å; I929-I1005 HydrophobicContact CG1-CG2 4.13Å; I929-I1006 PolarHBondContact N-O 3.35Å; I929-T1007 HydrophobicContact CB-CG2 4.29Å; I929-T1007 HydrophobicContact CG2-CG2 4.43Å; I929-E1008 PolarHBondContact O-N 2.9Å
930	L	95	Very high	84	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	148.8	-177.2	-50.9	176.7	0	0	0	111.3	L556 I559 V848 C849 F851 I859 L861 L864 V928 E1008	L556-L930 HydrophobicContact CD2-CD1 3.92Å; L556-L930 HydrophobicContact CD2-CD2 4.25Å; I559-L930 HydrophobicContact CD1-CD2 4.01Å; V848-L930 HydrophobicContact CG1-CD1 4.07Å; C849-L930 PolarHBondContact O-N 3.42Å; F851-L930 PolarHBondContact N-O 3.03Å; I859-L930 HydrophobicContact CD1-CB 4.1Å; L861-L930 HydrophobicContact CD2-CD1 3.98Å; L864-L930 HydrophobicContact CD2-CD1 4.35Å; V928-L930 HydrophobicContact CG1-CD1 4.34Å; V928-L930 HydrophobicContact CG1-CD2 3.74Å; V928-L930 HydrophobicContact CG1-CG 3.88Å; L930-E1008 HydrophobicContact CD2-CB 4.06Å; L930-E1008 WeakPolarHBondContact CD2-OE2 3.45Å
931	S	89.6	Confident	83.4	Confident	3 Å²	3	36.4 Å²	36.4	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134.5	170.6	-179.8	0	0	0	0	111.1	N933 Q934	S931-N933 PolarHBondContact OG-N 2.81Å; S931-N933 VanDerWaalsContact OG-N 3.14Å; S931-Q934 WeakPolarHBondContact O-CG 3.35Å; S931-Q934 PolarHBondContact O-NE2 3.25Å
932	A	84.1	Confident	83	Confident	7 Å²	7	40.6 Å²	40.6	6%	0.058	22%	0.224	C	C	.	.	S	Bend	trans	-98.2	-11.6	165.5	0	0	0	0	0	111.8	F851 I859 Y889 Q934	F851-A932 WeakPolarHBondContact O-CB 3.34Å; F851-A932 PolarHBondContact O-N 3.45Å; I859-A932 HydrophobicContact CD1-CB 3.87Å; I859-A932 HydrophobicContact CG1-CB 3.85Å; Y889-A932 HydrophobicContact CD2-CB 4.49Å; Y889-A932 HydrophobicContact CE2-CB 3.8Å; A932-Q934 PolarHBondContact O-N 3.47Å
933	N	77.4	Confident	82.6	Confident	19 Å²	19	40.2 Å²	40.2	10%	0.102	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-86.1	10.2	-175	-81.2	-12.5	0	0	0	113.8	D853 S856 S931 N935 N936	D853-N933 PolarHBondContact OD2-ND2 2.9Å; D853-N933 PolarHBondContact OD2-OD1 3.42Å; S856-N933 WeakPolarHBondContact CB-OD1 3.45Å; S931-N933 PolarHBondContact OG-N 2.81Å; S931-N933 VanDerWaalsContact OG-N 3.14Å; N933-N935 PolarHBondContact O-N 2.88Å; N933-N936 PolarHBondContact O-N 3.49Å
934	Q	65.3	Low	82.5	Confident	28 Å²	28	37.7 Å²	37.7	13%	0.131	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-52.6	-31	-176.1	-57.1	-178.5	-31.4	0	0	113.3	S931 A932 E1008 V1010	S931-Q934 WeakPolarHBondContact O-CG 3.35Å; S931-Q934 PolarHBondContact O-NE2 3.25Å; A932-Q934 PolarHBondContact O-N 3.47Å; Q934-E1008 PolarHBondContact NE2-OE1 2.83Å; Q934-V1010 HydrophobicContact CB-CG2 3.99Å; Q934-V1010 HydrophobicContact CG-CG2 3.58Å
935	N	61.9	Low	82.4	Confident	35 Å²	35	41.6 Å²	41.6	19%	0.187	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-94.4	-2.3	-168	-49.1	-10.7	0	0	0	114.7	C495 A496 N933	C495-N935 VanDerWaalsContact O-CG 3.22Å; C495-N935 PolarHBondContact O-ND2 3.1Å; A496-N935 PolarHBondContact O-ND2 3.38Å; A496-N935 VanDerWaalsContact O-ND2 3.08Å; N933-N935 PolarHBondContact O-N 2.88Å
936	N	57.7	Low	82.3	Confident	101 Å²	101	41.9 Å²	41.9	54%	0.54	22%	0.224	S	C	.	.	S	Bend	trans	-105.6	12.4	-168	-72.8	-32.8	0	0	0	114.3	N933	N933-N936 PolarHBondContact O-N 3.49Å
937	I	64.6	Low	82.1	Confident	38 Å²	38	41.8 Å²	41.8	20%	0.195	22%	0.224	C	C	.	.			trans	-132.3	117.2	-173.7	-58.6	173.7	0	0	0	109.4	D939 L942 Q943 K945	I937-D939 HydrophobicContact CG2-CB 4.4Å; I937-D939 PolarHBondContact O-N 3.31Å; I937-L942 HydrophobicContact CG2-CB 4.09Å; I937-Q943 HydrophobicContact CB-CG 4.16Å; I937-Q943 PolarHBondContact O-NE2 3.12Å; I937-Q943 VanDerWaalsContact O-NE2 3.15Å; I937-K945 HydrophobicContact CD1-CD 4.4Å
938	D	64.4	Low	82	Confident	178 Å²	178	42.7 Å²	42.7	95%	0.952	23%	0.228	S	C	*	.	S	Bend	trans	-65.2	-24.8	-178.1	-59.8	-50.3	0	0	0	113.6
939	D	77.6	Confident	81.9	Confident	73 Å²	73	47.5 Å²	47.5	39%	0.39	25%	0.254	S	S	.	.			trans	-91.8	110.1	177.3	-172.8	-27.6	0	0	0	110.7	I937 S941 L942	I937-D939 HydrophobicContact CG2-CB 4.4Å; I937-D939 PolarHBondContact O-N 3.31Å; D939-S941 PolarHBondContact O-N 3.25Å; D939-S941 WeakPolarHBondContact OD1-CB 3.31Å; D939-S941 PolarHBondContact OD1-N 3.49Å; D939-S941 PolarHBondContact OD1-OG 2.84Å; D939-L942 HydrophobicContact CB-CB 4.31Å; D939-L942 HydrophobicContact CB-CD1 4.14Å; D939-L942 HydrophobicContact CB-CG 4.28Å; D939-L942 PolarHBondContact O-N 3.37Å; D939-L942 VanDerWaalsContact O-N 3.08Å
940	T	75.6	Confident	81.8	Confident	89 Å²	89	47.5 Å²	47.5	55%	0.546	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-17.1	179.9	51.3	0	0	0	0	114.4	N1011	T940-N1011 PolarHBondContact O-ND2 3.31Å
941	S	79.9	Confident	81.8	Confident	52 Å²	52	47.6 Å²	47.6	36%	0.364	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-32	173.4	71.8	0	0	0	0	112.2	D939 N1014	D939-S941 PolarHBondContact O-N 3.25Å; D939-S941 WeakPolarHBondContact OD1-CB 3.31Å; D939-S941 PolarHBondContact OD1-N 3.49Å; D939-S941 PolarHBondContact OD1-OG 2.84Å; S941-N1014 PolarHBondContact O-ND2 3.13Å
942	L	85.8	Confident	82.1	Confident	88 Å²	88	49.8 Å²	49.8	46%	0.461	27%	0.265	S	S	.	.	S	Bend	trans	-90.3	1.9	-172.3	-64.8	178.5	0	0	0	114.5	I937 D939 K945	I937-L942 HydrophobicContact CG2-CB 4.09Å; D939-L942 HydrophobicContact CB-CB 4.31Å; D939-L942 HydrophobicContact CB-CD1 4.14Å; D939-L942 HydrophobicContact CB-CG 4.28Å; D939-L942 PolarHBondContact O-N 3.37Å; D939-L942 VanDerWaalsContact O-N 3.08Å; L942-K945 WeakPolarHBondContact O-CB 3.23Å; L942-K945 WeakPolarHBondContact O-CD 3.35Å; L942-K945 WeakPolarHBondContact O-CG 3.49Å
943	Q	84.4	Confident	82.7	Confident	22 Å²	22	50.6 Å²	50.6	10%	0.103	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-37.1	-178.3	-71.8	173.3	-3.7	0	0	112.8	I937 K945 V1010	I937-Q943 HydrophobicContact CB-CG 4.16Å; I937-Q943 PolarHBondContact O-NE2 3.12Å; I937-Q943 VanDerWaalsContact O-NE2 3.15Å; Q943-K945 PolarHBondContact O-N 3.38Å; Q943-V1010 HydrophobicContact CB-CB 4.45Å
944	D	90.3	Very high	83.5	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	0.5	-176.8	-62.6	-58.3	0	0	0	114.9	E946 C947 I948 L1009 V1010 N1011 N1014	D944-E946 PolarHBondContact O-N 3.38Å; D944-C947 WeakPolarHBondContact O-CB 3.39Å; D944-C947 PolarHBondContact O-N 3.29Å; D944-I948 HydrophobicContact CB-CD1 3.85Å; D944-I948 HydrophobicContact CB-CG1 4.24Å; D944-I948 WeakPolarHBondContact O-CG1 3.32Å; D944-I948 PolarHBondContact O-N 2.83Å; D944-L1009 HydrophobicContact CB-CD2 4.01Å; D944-L1009 WeakPolarHBondContact OD1-CA 3.49Å; D944-V1010 WeakPolarHBondContact OD1-CG2 3.42Å; D944-V1010 PolarHBondContact OD1-N 3.38Å; D944-V1010 PolarHBondContact OD2-N 3.36Å; D944-N1011 PolarHBondContact OD2-N 3.02Å; D944-N1011 VanDerWaalsContact OD2-N 3.08Å; D944-N1014 HydrophobicContact CB-CB 4.25Å; D944-N1014 PolarHBondContact OD2-ND2 3.47Å
945	K	91.6	Very high	84.9	Confident	91 Å²	91	50.5 Å²	50.5	40%	0.396	27%	0.267	S	S	.	.	H	α-helix	trans	-50.3	-38.5	-170.7	72.3	-169.1	176.9	-168.8	0	113.7	I937 L942 Q943 L949	I937-K945 HydrophobicContact CD1-CD 4.4Å; L942-K945 WeakPolarHBondContact O-CB 3.23Å; L942-K945 WeakPolarHBondContact O-CD 3.35Å; L942-K945 WeakPolarHBondContact O-CG 3.49Å; Q943-K945 PolarHBondContact O-N 3.38Å; K945-L949 VanDerWaalsContact O-CB 3.28Å; K945-L949 WeakPolarHBondContact O-CB 3.22Å; K945-L949 WeakPolarHBondContact O-CD1 3.31Å; K945-L949 WeakPolarHBondContact O-CG 3.14Å; K945-L949 PolarHBondContact O-N 2.9Å
946	E	92.1	Very high	86.4	Confident	51 Å²	51	52 Å²	52	24%	0.238	28%	0.28	C	S	.	.	H	α-helix	trans	-77.2	-38.4	-175.8	-53.2	-170.8	149.7	0	0	111.2	F851 D944 A950	F851-E946 HydrophobicContact CB-CB 4.47Å; F851-E946 HydrophobicContact CD1-CB 3.85Å; F851-E946 HydrophobicContact CD2-CB 3.97Å; F851-E946 HydrophobicContact CE1-CB 4.01Å; F851-E946 HydrophobicContact CE2-CB 4.12Å; F851-E946 WeakPolarHBondContact CE2-O 3.21Å; F851-E946 HydrophobicContact CG-CB 3.82Å; F851-E946 HydrophobicContact CZ-CB 4.13Å; D944-E946 PolarHBondContact O-N 3.38Å; E946-A950 VanDerWaalsContact O-CB 3.3Å; E946-A950 WeakPolarHBondContact O-CB 3.36Å; E946-A950 PolarHBondContact O-N 2.73Å
947	C	94.1	Very high	88.1	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-63.1	-46.3	173.4	-72	0	0	0	0	111.9	I929 D944 A950 S951 T1007	I929-C947 HydrophobicContact CG2-CB 4.16Å; D944-C947 WeakPolarHBondContact O-CB 3.39Å; D944-C947 PolarHBondContact O-N 3.29Å; C947-A950 PolarHBondContact O-N 2.82Å; C947-S951 WeakPolarHBondContact O-CB 3.46Å; C947-S951 PolarHBondContact O-N 3.45Å; C947-S951 PolarHBondContact O-OG 2.98Å; C947-T1007 HydrophobicContact CB-CG2 3.66Å
948	I	95.1	Very high	89.3	Confident	19 Å²	19	52.4 Å²	52.4	10%	0.097	28%	0.278	C	S	.	.	H	α-helix	trans	-65.4	-49.4	178.7	-61.2	161.7	0	0	0	110.3	D944 A950 S951 L952 N1014 F1017 L1018	D944-I948 HydrophobicContact CB-CD1 3.85Å; D944-I948 HydrophobicContact CB-CG1 4.24Å; D944-I948 WeakPolarHBondContact O-CG1 3.32Å; D944-I948 PolarHBondContact O-N 2.83Å; I948-A950 VanDerWaalsContact C-N 3.31Å; I948-A950 PolarHBondContact O-N 2.56Å; I948-S951 WeakPolarHBondContact O-CB 3.21Å; I948-S951 PolarHBondContact O-N 2.9Å; I948-S951 VanDerWaalsContact O-N 3.12Å; I948-L952 HydrophobicContact CG2-CD1 3.95Å; I948-L952 HydrophobicContact CG2-CG 4.42Å; I948-L952 WeakPolarHBondContact O-CG 3.41Å; I948-L952 PolarHBondContact O-N 3.45Å; I948-N1014 HydrophobicContact CD1-CB 4.16Å; I948-F1017 HydrophobicContact CD1-CB 4.29Å; I948-F1017 HydrophobicContact CD1-CD2 4.17Å; I948-F1017 HydrophobicContact CG2-CB 3.88Å; I948-L1018 HydrophobicContact CG1-CD2 4.29Å
949	L	95.3	Very high	90.5	Very high	102 Å²	102	44.7 Å²	44.7	53%	0.534	24%	0.236	S	C	.	.	H	α-helix	trans	-60.3	-39.1	178.3	-74.6	170.7	0	0	0	112.2	L911 K945 N953	L911-L949 HydrophobicContact CD2-CB 4.2Å; K945-L949 VanDerWaalsContact O-CB 3.28Å; K945-L949 WeakPolarHBondContact O-CB 3.22Å; K945-L949 WeakPolarHBondContact O-CD1 3.31Å; K945-L949 WeakPolarHBondContact O-CG 3.14Å; K945-L949 PolarHBondContact O-N 2.9Å; L949-N953 WeakPolarHBondContact O-CB 3.37Å; L949-N953 PolarHBondContact O-N 3.29Å
950	A	96	Very high	90.6	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-44.2	173.4	0	0	0	0	0	112.4	F851 L911 I929 E946 C947 I948 N953 I954	F851-A950 HydrophobicContact CE2-CB 3.78Å; F851-A950 HydrophobicContact CZ-CB 3.88Å; L911-A950 HydrophobicContact CD2-CB 4.25Å; I929-A950 HydrophobicContact CD1-CB 4.03Å; I929-A950 HydrophobicContact CG2-CB 4.15Å; E946-A950 VanDerWaalsContact O-CB 3.3Å; E946-A950 WeakPolarHBondContact O-CB 3.36Å; E946-A950 PolarHBondContact O-N 2.73Å; C947-A950 PolarHBondContact O-N 2.82Å; I948-A950 VanDerWaalsContact C-N 3.31Å; I948-A950 PolarHBondContact O-N 2.56Å; A950-N953 WeakPolarHBondContact O-CB 3.27Å; A950-N953 PolarHBondContact O-N 3.05Å; A950-I954 WeakPolarHBondContact O-CD1 3.24Å; A950-I954 WeakPolarHBondContact O-CG1 3.37Å; A950-I954 PolarHBondContact O-N 3.01Å
951	S	95.8	Very high	90.1	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.007	24%	0.244	C	C	.	.	H	α-helix	trans	-58.7	-50.5	178.6	-56.3	0	0	0	0	111.3	C947 I948 N953 I954 K955 T1007	C947-S951 WeakPolarHBondContact O-CB 3.46Å; C947-S951 PolarHBondContact O-N 3.45Å; C947-S951 PolarHBondContact O-OG 2.98Å; I948-S951 WeakPolarHBondContact O-CB 3.21Å; I948-S951 PolarHBondContact O-N 2.9Å; I948-S951 VanDerWaalsContact O-N 3.12Å; S951-N953 PolarHBondContact O-N 3.13Å; S951-I954 PolarHBondContact O-N 3.4Å; S951-K955 WeakPolarHBondContact O-CG 3.39Å; S951-K955 PolarHBondContact O-N 3.18Å; S951-T1007 PolarHBondContact OG-OG1 3.44Å
952	L	95.1	Very high	88.9	Confident	49 Å²	49	47.3 Å²	47.3	26%	0.257	25%	0.248	S	C	.	.	H	α-helix	trans	-67.6	-34.2	177.6	-63.5	175.5	0	0	0	112.3	I948 S956	I948-L952 HydrophobicContact CG2-CD1 3.95Å; I948-L952 HydrophobicContact CG2-CG 4.42Å; I948-L952 WeakPolarHBondContact O-CG 3.41Å; I948-L952 PolarHBondContact O-N 3.45Å; L952-S956 WeakPolarHBondContact O-CB 3.38Å; L952-S956 PolarHBondContact O-N 3.4Å; L952-S956 VanDerWaalsContact O-N 3.08Å; L952-S956 PolarHBondContact O-OG 2.94Å
953	N	96	Very high	87.3	Confident	24 Å²	24	48 Å²	48	13%	0.128	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-43.1	175.4	-173.9	42.1	0	0	0	111.7	L911 R913 L949 A950 S951 S956 M957	L911-N953 PolarHBondContact O-ND2 3.23Å; R913-N953 VanDerWaalsContact CZ-OD1 3.27Å; R913-N953 PolarHBondContact NE-OD1 3.01Å; R913-N953 PolarHBondContact NH2-O 3.02Å; R913-N953 PolarHBondContact NH2-OD1 3.47Å; L949-N953 WeakPolarHBondContact O-CB 3.37Å; L949-N953 PolarHBondContact O-N 3.29Å; A950-N953 WeakPolarHBondContact O-CB 3.27Å; A950-N953 PolarHBondContact O-N 3.05Å; S951-N953 PolarHBondContact O-N 3.13Å; N953-S956 PolarHBondContact O-OG 2.63Å; N953-M957 WeakPolarHBondContact O-CG 3.22Å
954	I	95.4	Very high	85.5	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-69.5	-49.1	177	-63.2	157.3	0	0	0	110.8	L916 I921 I929 A950 S951 S956 M957 G1000 I1003 I1005	L916-I954 HydrophobicContact CD1-CG1 3.74Å; I921-I954 HydrophobicContact CD1-CD1 3.95Å; I921-I954 HydrophobicContact CD1-CG1 4Å; I921-I954 HydrophobicContact CD1-CG2 4.03Å; I929-I954 HydrophobicContact CD1-CD1 3.89Å; A950-I954 WeakPolarHBondContact O-CD1 3.24Å; A950-I954 WeakPolarHBondContact O-CG1 3.37Å; A950-I954 PolarHBondContact O-N 3.01Å; S951-I954 PolarHBondContact O-N 3.4Å; I954-S956 PolarHBondContact O-N 3.47Å; I954-S956 VanDerWaalsContact O-N 3.13Å; I954-M957 WeakPolarHBondContact O-CB 3.35Å; I954-M957 PolarHBondContact O-N 3.05Å; I954-G1000 WeakPolarHBondContact O-CA 3.48Å; I954-I1003 HydrophobicContact CG2-CB 4.26Å; I954-I1003 HydrophobicContact CG2-CD1 3.8Å; I954-I1003 HydrophobicContact CG2-CG2 4.15Å; I954-I1005 HydrophobicContact CB-CD1 3.87Å; I954-I1005 HydrophobicContact CD1-CD1 4.39Å; I954-I1005 HydrophobicContact CG2-CD1 3.69Å; I954-I1005 HydrophobicContact CG2-CG1 4.28Å
955	K	93.4	Very high	83.2	Confident	44 Å²	44	54 Å²	54	19%	0.191	30%	0.3	C	S	.	.	H	α-helix	trans	-55.7	-32.1	179	-73.4	-177.6	178.3	178.2	0	112.6	S951 G1000 V1001 I1005 L1018 D1019	S951-K955 WeakPolarHBondContact O-CG 3.39Å; S951-K955 PolarHBondContact O-N 3.18Å; K955-G1000 CarbonylContact O-C 3.53Å; K955-V1001 PolarHBondContact O-N 3.44Å; K955-V1001 VanDerWaalsContact O-N 3.11Å; K955-I1005 HydrophobicContact CG-CD1 3.99Å; K955-L1018 PolarHBondContact NZ-O 2.92Å; K955-D1019 IonicContact NZ-OD1 2.7Å; K955-D1019 PolarHBondContact NZ-OD1 2.92Å
956	S	93.4	Very high	80.7	Confident	66 Å²	66	55.4 Å²	55.4	46%	0.462	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	15.6	177.4	62.1	0	0	0	0	115.7	R913 L952 N953 I954	R913-S956 PolarHBondContact NH1-O 3.23Å; R913-S956 VanDerWaalsContact NH1-O 3.1Å; R913-S956 PolarHBondContact NH2-OG 3.08Å; L952-S956 WeakPolarHBondContact O-CB 3.38Å; L952-S956 PolarHBondContact O-N 3.4Å; L952-S956 VanDerWaalsContact O-N 3.08Å; L952-S956 PolarHBondContact O-OG 2.94Å; N953-S956 PolarHBondContact O-OG 2.63Å; I954-S956 PolarHBondContact O-N 3.47Å; I954-S956 VanDerWaalsContact O-N 3.13Å
957	M	93.5	Very high	78.6	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.015	32%	0.322	C	S	.	.			trans	-83.5	153.9	170.2	-68.1	178.1	70.2	0	0	112.1	R913 L916 R917 I921 N953 I954 F959 G1000	R913-M957 HydrophobicContact CB-CE 4.31Å; R913-M957 HydrophobicContact CG-CG 4.42Å; R913-M957 HydrophobicContact CG-SD 4.36Å; L916-M957 HydrophobicContact CB-CE 4.11Å; L916-M957 HydrophobicContact CB-SD 4.15Å; L916-M957 HydrophobicContact CD1-SD 3.87Å; R917-M957 HydrophobicContact CG-CE 3.59Å; I921-M957 HydrophobicContact CG2-CE 4.4Å; N953-M957 WeakPolarHBondContact O-CG 3.22Å; I954-M957 WeakPolarHBondContact O-CB 3.35Å; I954-M957 PolarHBondContact O-N 3.05Å; M957-F959 HydrophobicContact CB-CE2 3.57Å; M957-F959 HydrophobicContact CB-CZ 3.69Å; M957-F959 HydrophobicContact CE-CE1 3.92Å; M957-F959 HydrophobicContact CE-CZ 3.67Å; M957-F959 HydrophobicContact SD-CZ 4.19Å; M957-G1000 WeakPolarHBondContact O-CA 3.45Å; M957-G1000 PolarHBondContact O-N 3.11Å
958	Q	90.9	Very high	76	Confident	145 Å²	145	61.4 Å²	61.4	68%	0.678	35%	0.354	S	S	*	.	B	Isolated β-bridge	trans	-128.3	146.3	174	-67.9	176.5	-11.6	0	0	109.3	R917 T998	R917-Q958 VanDerWaalsContact CZ-O 3.24Å; R917-Q958 PolarHBondContact NH1-O 2.68Å; R917-Q958 PolarHBondContact NH2-O 3.09Å; Q958-T998 WeakPolarHBondContact CA-O 3.4Å
959	F	88.4	Confident	73.2	Confident	16 Å²	16	66.2 Å²	66.2	7%	0.07	38%	0.379	C	S	.	.			trans	-136.4	137.8	-173.1	-57	-95.1	0	0	0	111.2	R917 I921 N922 M957 T998 I1003	R917-F959 HydrophobicContact CG-CE1 4.41Å; I921-F959 HydrophobicContact CG2-CE1 4.06Å; I921-F959 HydrophobicContact CG2-CZ 3.76Å; N922-F959 HydrophobicContact CB-CB 4.5Å; N922-F959 HydrophobicContact CB-CD1 3.7Å; N922-F959 HydrophobicContact CB-CD2 3.85Å; N922-F959 HydrophobicContact CB-CE1 3.77Å; N922-F959 HydrophobicContact CB-CE2 3.93Å; N922-F959 HydrophobicContact CB-CG 3.76Å; N922-F959 HydrophobicContact CB-CZ 3.88Å; N922-F959 VanDerWaalsContact CG-CD1 3.45Å; M957-F959 HydrophobicContact CB-CE2 3.57Å; M957-F959 HydrophobicContact CB-CZ 3.69Å; M957-F959 HydrophobicContact CE-CE1 3.92Å; M957-F959 HydrophobicContact CE-CZ 3.67Å; M957-F959 HydrophobicContact SD-CZ 4.19Å; F959-T998 PolarHBondContact N-O 3.39Å; F959-I1003 HydrophobicContact CE2-CD1 3.86Å; F959-I1003 HydrophobicContact CZ-CD1 4.02Å
960	D	81.1	Confident	70.6	Confident	123 Å²	123	65.7 Å²	65.7	66%	0.658	38%	0.384	S	S	*	.			trans	-96.1	123	-178.6	-55	-64.2	0	0	0	111.4	S962	D960-S962 PolarHBondContact O-N 3.01Å
961	D	64.3	Low	67.8	Low	83 Å²	83	74.7 Å²	74.7	44%	0.444	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-16.4	177.4	-67.9	-36.5	0	0	0	113.9	I963 G964 S996	D961-I963 PolarHBondContact O-N 3.08Å; D961-G964 PolarHBondContact O-N 3.1Å; D961-S996 WeakPolarHBondContact OD1-CB 3.23Å; D961-S996 PolarHBondContact OD1-OG 3.14Å
962	S	54.2	Low	65	Low	64 Å²	64	77.9 Å²	77.9	45%	0.448	46%	0.459	S	S	.	.	H	α-helix	trans	-58.9	-31.3	-177.2	59.9	0	0	0	0	113.4	D960 G964 V965 L966	D960-S962 PolarHBondContact O-N 3.01Å; S962-G964 PolarHBondContact O-N 2.98Å; S962-V965 PolarHBondContact O-N 3.13Å; S962-L966 WeakPolarHBondContact O-CG 3.42Å; S962-L966 PolarHBondContact O-N 3.36Å
963	I	52.3	Low	61.9	Low	102 Å²	102	84.6 Å²	84.6	52%	0.523	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-42.7	-179	-63.8	177.3	0	0	0	111.1	D961 V965 L966 Q967	D961-I963 PolarHBondContact O-N 3.08Å; I963-V965 VanDerWaalsContact C-N 3.26Å; I963-V965 PolarHBondContact O-N 3.19Å; I963-L966 PolarHBondContact O-N 3.15Å; I963-Q967 PolarHBondContact O-N 3.06Å; I963-Q967 VanDerWaalsContact O-N 3.07Å
964	G	48.1	Very low	58.9	Low	58 Å²	58	89.8 Å²	89.8	60%	0.598	52%	0.519	S	S	*	.	H	α-helix	trans	-67.2	-24.3	178.7	0	0	0	0	0	113.9	D961 S962	D961-G964 PolarHBondContact O-N 3.1Å; S962-G964 PolarHBondContact O-N 2.98Å
965	V	40	Very low	55.9	Low	90 Å²	90	94.7 Å²	94.7	55%	0.545	55%	0.551	S	S	.	*	H	α-helix	trans	-84.8	-31.8	176.1	-177.3	0	0	0	0	111.6	S962 I963 N969	S962-V965 PolarHBondContact O-N 3.13Å; I963-V965 VanDerWaalsContact C-N 3.26Å; I963-V965 PolarHBondContact O-N 3.19Å; V965-N969 PolarHBondContact O-ND2 3.08Å
966	L	39.6	Very low	53	Low	121 Å²	121	99.1 Å²	99.1	63%	0.634	59%	0.585	S	S	*	*	H	α-helix	trans	-78.8	-41.7	-179	-70.2	169	0	0	0	112.7	S962 I963 A968 N969	S962-L966 WeakPolarHBondContact O-CG 3.42Å; S962-L966 PolarHBondContact O-N 3.36Å; I963-L966 PolarHBondContact O-N 3.15Å; L966-A968 VanDerWaalsContact C-N 3.27Å; L966-A968 PolarHBondContact O-N 3.02Å; L966-N969 PolarHBondContact O-N 3.33Å; L966-N969 VanDerWaalsContact O-N 3.14Å
967	Q	47.6	Very low	50.5	Low	97 Å²	97	99.8 Å²	99.8	45%	0.453	60%	0.602	S	S	.	*	H	α-helix	trans	-64.9	-27.3	177.4	-86.9	-174.4	-19.6	0	0	113.5	I963 N969 S970	I963-Q967 PolarHBondContact O-N 3.06Å; I963-Q967 VanDerWaalsContact O-N 3.07Å; Q967-N969 PolarHBondContact O-N 3.18Å; Q967-S970 PolarHBondContact O-N 3.2Å; Q967-S970 PolarHBondContact O-OG 3.15Å; Q967-S970 VanDerWaalsContact O-OG 3.08Å
968	A	40.1	Very low	47.7	Very low	82 Å²	82	108.6 Å²	108.6	68%	0.678	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-17.8	175.6	0	0	0	0	0	113.8	L966	L966-A968 VanDerWaalsContact C-N 3.27Å; L966-A968 PolarHBondContact O-N 3.02Å
969	N	36.5	Very low	44.7	Very low	119 Å²	119	109.2 Å²	109.2	64%	0.636	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-2.7	-177.5	-73.3	-72.6	0	0	0	114	V965 L966 Q967	V965-N969 PolarHBondContact O-ND2 3.08Å; L966-N969 PolarHBondContact O-N 3.33Å; L966-N969 VanDerWaalsContact O-N 3.14Å; Q967-N969 PolarHBondContact O-N 3.18Å
970	S	39.9	Very low	42.3	Very low	92 Å²	92	120 Å²	120	64%	0.643	69%	0.694	S	S	*	*			trans	-89.9	-12.4	-172.3	62.7	0	0	0	0	115.4	Q967 G972	Q967-S970 PolarHBondContact O-N 3.2Å; Q967-S970 PolarHBondContact O-OG 3.15Å; Q967-S970 VanDerWaalsContact O-OG 3.08Å; S970-G972 VanDerWaalsContact C-N 3.34Å; S970-G972 PolarHBondContact O-N 3.28Å; S970-G972 VanDerWaalsContact O-N 3.16Å
971	Q	38.8	Very low	40	Very low	189 Å²	189	119.6 Å²	119.6	88%	0.883	70%	0.701	S	S	*	*	S	Bend	trans	-86	75.9	167.8	-68.1	-162.2	3.1	0	0	110.7	F973	Q971-F973 PolarHBondContact O-N 3.44Å
972	G	35.8	Very low	38.3	Very low	68 Å²	68	120.4 Å²	120.4	70%	0.701	71%	0.713	S	S	*	*			trans	-77.3	107.6	-173.8	0	0	0	0	0	114.6	S970	S970-G972 VanDerWaalsContact C-N 3.34Å; S970-G972 PolarHBondContact O-N 3.28Å; S970-G972 VanDerWaalsContact O-N 3.16Å
973	F	31.7	Very low	37.4	Very low	190 Å²	190	123.2 Å²	123.2	83%	0.833	73%	0.73	S	S	*	*			trans	-150.2	106.4	145.5	-146.5	-90.3	0	0	0	112	Q971	Q971-F973 PolarHBondContact O-N 3.44Å
974	T	32.4	Very low	36.3	Very low	132 Å²	132	124.6 Å²	124.6	81%	0.81	74%	0.738	S	S	*	*			trans	-126.7	118.9	171.8	52.2	0	0	0	0	109.3
975	P	32.8	Very low	35.5	Very low	104 Å²	104	129.8 Å²	129.8	68%	0.675	75%	0.752	S	S	*	*			trans	-61.8	148.4	174.7	-21.4	33.2	0	0	0	111.9
976	P	31.2	Very low	34.9	Very low	137 Å²	137	129.9 Å²	129.9	89%	0.89	76%	0.757	S	S	*	*	S	Bend	trans	-74.6	135.2	179	30.2	-34.1	0	0	0	111.7
977	G	42	Very low	34.4	Very low	81 Å²	81	130.8 Å²	130.8	84%	0.835	77%	0.77	S	S	*	*			trans	122.4	44.2	165.5	0	0	0	0	0	117.3
978	M	34.6	Very low	33.6	Very low	187 Å²	187	131.8 Å²	131.8	92%	0.921	78%	0.783	S	S	*	*			trans	-147.8	120.8	169.7	-139.3	165.5	-171.2	0	0	112.3
979	D	27.2	Very low	33.1	Very low	158 Å²	158	137.5 Å²	137.5	85%	0.845	80%	0.795	S	S	*	*			trans	-77.8	144.8	-174.7	-69.7	-57.9	0	0	0	113.4	S981	D979-S981 PolarHBondContact O-N 2.94Å
980	R	39.2	Very low	32.6	Very low	242 Å²	242	135.7 Å²	135.7	91%	0.913	81%	0.805	S	S	*	*			trans	-90.6	98.6	178.5	-73.1	-178.5	170.5	-175.2	-3.1	111.4
981	S	31.7	Very low	32	Very low	115 Å²	115	140 Å²	140	80%	0.804	82%	0.817	S	S	*	*			trans	-149.5	33.2	174.7	65.3	0	0	0	0	116.8	D979	D979-S981 PolarHBondContact O-N 2.94Å
982	S	27.8	Very low	31.6	Very low	101 Å²	101	138.2 Å²	138.2	71%	0.706	81%	0.812	S	S	*	*			trans	-158	132.6	163.2	54.5	0	0	0	0	112.3
983	P	35.5	Very low	31.5	Very low	123 Å²	123	146.2 Å²	146.2	80%	0.799	82%	0.821	S	S	*	*			trans	-82.8	-20.2	179.2	33.1	-34.6	0	0	0	113.8	N985	P983-N985 PolarHBondContact O-N 3.1Å
984	D	30.1	Very low	32	Very low	131 Å²	131	142.5 Å²	142.5	70%	0.701	81%	0.807	S	S	*	*	S	Bend	trans	-92	85.9	-175.6	-62.8	-54.5	0	0	0	112.2
985	N	31	Very low	32.5	Very low	166 Å²	166	141.8 Å²	141.8	89%	0.888	80%	0.804	S	S	*	*			trans	160.9	96.5	144.9	-88.4	-56.9	0	0	0	110.4	P983	P983-N985 PolarHBondContact O-N 3.1Å
986	S	27.9	Very low	33.4	Very low	93 Å²	93	139.7 Å²	139.7	65%	0.65	79%	0.792	S	S	*	*			trans	-140.8	142	159.9	67.7	0	0	0	0	110.4	V988	S986-V988 PolarHBondContact O-N 3.43Å
987	P	29.6	Very low	34.9	Very low	139 Å²	139	134.7 Å²	134.7	90%	0.903	76%	0.758	S	S	*	*	S	Bend	trans	-83.3	48.7	-170.8	35.3	-37.5	0	0	0	112.6
988	V	29.6	Very low	36.3	Very low	119 Å²	119	133.7 Å²	133.7	72%	0.721	74%	0.735	S	S	*	*			trans	-128.9	68.9	-179.8	-166.8	0	0	0	0	110.3	S986	S986-V988 PolarHBondContact O-N 3.43Å
989	H	30.1	Very low	38.6	Very low	201 Å²	201	127.5 Å²	127.5	93%	0.931	71%	0.708	S	S	*	*			trans	-135.4	123.7	164.5	-110.1	46.7	0	0	0	108.5
990	G	26.2	Very low	41.2	Very low	82 Å²	82	120 Å²	120	85%	0.845	67%	0.668	S	S	*	*	S	Bend	trans	153.4	-11.7	-170.4	0	0	0	0	0	115.2
991	M	26.1	Very low	43.5	Very low	182 Å²	182	112.3 Å²	112.3	90%	0.897	65%	0.648	S	S	*	*	S	Bend	trans	-111.1	119.1	159.7	-77.9	-179.1	164.8	0	0	108.7	R993	M991-R993 PolarHBondContact O-N 2.85Å
992	L	30.8	Very low	46.2	Very low	151 Å²	151	109.6 Å²	109.6	79%	0.791	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-61.5	125	161.9	-76.5	158.3	0	0	0	107.5	Q994	L992-Q994 PolarHBondContact O-N 2.71Å
993	R	34	Very low	49.4	Very low	236 Å²	236	105.1 Å²	105.1	89%	0.891	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-66.6	124.3	167.8	-78.8	-179.3	168.1	-177.5	-5.5	107.8	M991	M991-R993 PolarHBondContact O-N 2.85Å
994	Q	41.6	Very low	52.2	Low	113 Å²	113	100.4 Å²	100.4	53%	0.528	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-56.1	136.1	155.6	-77.9	178.8	-38.5	0	0	107.7	L992 S996	L992-Q994 PolarHBondContact O-N 2.71Å; Q994-S996 PolarHBondContact O-N 2.69Å
995	P	43.9	Very low	55.3	Low	117 Å²	117	94.4 Å²	94.4	76%	0.76	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-62	129.5	172.3	27.2	-33.3	0	0	0	108.3	I997	P995-I997 PolarHBondContact O-N 3.21Å
996	S	50.9	Low	58.5	Low	60 Å²	60	86.5 Å²	86.5	42%	0.42	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-70.1	125.9	-178.6	42.7	0	0	0	0	110.4	D961 Q994 T998	D961-S996 WeakPolarHBondContact OD1-CB 3.23Å; D961-S996 PolarHBondContact OD1-OG 3.14Å; Q994-S996 PolarHBondContact O-N 2.69Å; S996-T998 PolarHBondContact O-N 2.89Å; S996-T998 VanDerWaalsContact O-N 3.1Å
997	I	64.1	Low	61.8	Low	32 Å²	32	82.2 Å²	82.2	16%	0.164	46%	0.457	C	S	.	.			trans	-77.1	100.4	-180	-63.6	176.4	0	0	0	108.5	N922 P995 T999 N1002 I1003	N922-I997 HydrophobicContact CB-CB 4.27Å; P995-I997 PolarHBondContact O-N 3.21Å; I997-T999 WeakPolarHBondContact CG2-O 3.36Å; I997-N1002 HydrophobicContact CG2-CB 4.09Å; I997-I1003 HydrophobicContact CD1-CG1 4.48Å; I997-I1003 HydrophobicContact CG2-CG1 3.95Å
998	T	71.5	Confident	64.8	Low	60 Å²	60	75.7 Å²	75.7	37%	0.368	41%	0.414	S	S	.	.			trans	-78.6	-27.2	177.1	55.4	0	0	0	0	112.8	Q958 F959 S996	Q958-T998 WeakPolarHBondContact CA-O 3.4Å; F959-T998 PolarHBondContact N-O 3.39Å; S996-T998 PolarHBondContact O-N 2.89Å; S996-T998 VanDerWaalsContact O-N 3.1Å
999	T	81.5	Confident	67.8	Low	57 Å²	57	70 Å²	70	35%	0.35	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-123.5	130.2	-177.9	53.2	0	0	0	0	111.2	I997 V1001 N1002	I997-T999 WeakPolarHBondContact CG2-O 3.36Å; T999-V1001 PolarHBondContact O-N 3.1Å; T999-V1001 VanDerWaalsContact O-N 3.1Å; T999-N1002 PolarHBondContact O-N 3.42Å
1000	G	82.2	Confident	70.4	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-63.7	-17.9	-172	0	0	0	0	0	115.2	I954 K955 M957 N1002 I1003	I954-G1000 WeakPolarHBondContact O-CA 3.48Å; K955-G1000 CarbonylContact O-C 3.53Å; M957-G1000 WeakPolarHBondContact O-CA 3.45Å; M957-G1000 PolarHBondContact O-N 3.11Å; G1000-N1002 PolarHBondContact O-N 2.87Å; G1000-I1003 WeakPolarHBondContact O-CB 3.42Å; G1000-I1003 WeakPolarHBondContact O-CG1 3.48Å; G1000-I1003 PolarHBondContact O-N 3.22Å; G1000-I1003 VanDerWaalsContact O-N 3.11Å
1001	V	87.7	Confident	73.3	Confident	80 Å²	80	58.5 Å²	58.5	49%	0.485	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-61.5	-26	177	66.9	0	0	0	0	113.2	K955 T999	K955-V1001 PolarHBondContact O-N 3.44Å; K955-V1001 VanDerWaalsContact O-N 3.11Å; T999-V1001 PolarHBondContact O-N 3.1Å; T999-V1001 VanDerWaalsContact O-N 3.1Å
1002	N	88.8	Confident	76.2	Confident	58 Å²	58	52.2 Å²	52.2	31%	0.31	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-88.2	0.2	178.2	-64.6	-4.3	0	0	0	113.3	I997 T999 G1000 T1156	I997-N1002 HydrophobicContact CG2-CB 4.09Å; T999-N1002 PolarHBondContact O-N 3.42Å; G1000-N1002 PolarHBondContact O-N 2.87Å; N1002-T1156 PolarHBondContact OD1-OG1 3.4Å
1003	I	93.4	Very high	78.9	Confident	8 Å²	8	48.9 Å²	48.9	4%	0.041	26%	0.262	C	S	.	.	S	Bend	trans	-71.6	129.1	176.9	-64.1	175.4	0	0	0	108.8	I921 N922 I954 F959 I997 G1000 I1005	I921-I1003 HydrophobicContact CG1-CD1 4.44Å; I921-I1003 HydrophobicContact CG1-CG2 4.27Å; I921-I1003 HydrophobicContact CG2-CD1 4.19Å; N922-I1003 HydrophobicContact CB-CD1 4.45Å; I954-I1003 HydrophobicContact CG2-CB 4.26Å; I954-I1003 HydrophobicContact CG2-CD1 3.8Å; I954-I1003 HydrophobicContact CG2-CG2 4.15Å; F959-I1003 HydrophobicContact CE2-CD1 3.86Å; F959-I1003 HydrophobicContact CZ-CD1 4.02Å; I997-I1003 HydrophobicContact CD1-CG1 4.48Å; I997-I1003 HydrophobicContact CG2-CG1 3.95Å; G1000-I1003 WeakPolarHBondContact O-CB 3.42Å; G1000-I1003 WeakPolarHBondContact O-CG1 3.48Å; G1000-I1003 PolarHBondContact O-N 3.22Å; G1000-I1003 VanDerWaalsContact O-N 3.11Å; I1003-I1005 HydrophobicContact CG2-CG1 4.19Å; I1003-I1005 PolarHBondContact O-N 2.8Å; I1003-I1005 VanDerWaalsContact O-N 3.17Å
1004	P	94.8	Very high	81.6	Confident	23 Å²	23	37.9 Å²	37.9	15%	0.149	22%	0.221	C	C	.	.			trans	-68.7	113.3	174.5	27.8	-33.1	0	0	0	109.7	D925 M926 C927	D925-P1004 VanDerWaalsContact O-CG 3.25Å; D925-P1004 WeakPolarHBondContact O-CG 3.48Å; M926-P1004 HydrophobicContact CE-CB 3.88Å; M926-P1004 HydrophobicContact SD-CB 4.03Å; C927-P1004 PolarHBondContact N-O 2.87Å
1005	I	96	Very high	84	Confident	5 Å²	5	32.8 Å²	32.8	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.1	177.1	-55.8	166	0	0	0	108.4	C927 I929 I954 K955 I1003 T1007 T1040	C927-I1005 HydrophobicContact CB-CG1 4.26Å; C927-I1005 CarbonylContact O-C 3.54Å; C927-I1005 WeakPolarHBondContact O-CA 3.14Å; I929-I1005 HydrophobicContact CD1-CG2 3.62Å; I929-I1005 HydrophobicContact CG1-CG2 4.13Å; I954-I1005 HydrophobicContact CB-CD1 3.87Å; I954-I1005 HydrophobicContact CD1-CD1 4.39Å; I954-I1005 HydrophobicContact CG2-CD1 3.69Å; I954-I1005 HydrophobicContact CG2-CG1 4.28Å; K955-I1005 HydrophobicContact CG-CD1 3.99Å; I1003-I1005 HydrophobicContact CG2-CG1 4.19Å; I1003-I1005 PolarHBondContact O-N 2.8Å; I1003-I1005 VanDerWaalsContact O-N 3.17Å; I1005-T1007 WeakPolarHBondContact CG2-OG1 3.46Å; I1005-T1040 WeakPolarHBondContact O-CA 3.48Å; I1005-T1040 WeakPolarHBondContact O-CB 3.43Å
1006	I	97.6	Very high	86.2	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	122	163.2	-171.3	169.6	0	0	0	109.7	I559 M926 C927 V928 I929 T1040 F1042	I559-I1006 HydrophobicContact CG1-CD1 4.16Å; I559-I1006 HydrophobicContact CG2-CG2 3.98Å; M926-I1006 HydrophobicContact CG-CG2 3.81Å; M926-I1006 HydrophobicContact SD-CB 4.07Å; M926-I1006 HydrophobicContact SD-CG2 3.78Å; C927-I1006 PolarHBondContact O-N 2.92Å; V928-I1006 WeakPolarHBondContact CA-O 3.23Å; V928-I1006 HydrophobicContact CB-CG2 4.37Å; V928-I1006 HydrophobicContact CG1-CG2 4.45Å; V928-I1006 HydrophobicContact CG2-CG2 3.9Å; I929-I1006 PolarHBondContact N-O 3.35Å; I1006-T1040 WeakPolarHBondContact CA-O 3.39Å; I1006-F1042 HydrophobicContact CD1-CB 4.5Å
1007	T	96.6	Very high	88.1	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.012	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126.4	-173.1	-61.4	0	0	0	0	110.3	I929 C947 S951 I1005 L1009 L1018 T1040 F1042	I929-T1007 HydrophobicContact CB-CG2 4.29Å; I929-T1007 HydrophobicContact CG2-CG2 4.43Å; C947-T1007 HydrophobicContact CB-CG2 3.66Å; S951-T1007 PolarHBondContact OG-OG1 3.44Å; I1005-T1007 WeakPolarHBondContact CG2-OG1 3.46Å; T1007-L1009 HydrophobicContact CG2-CD2 4.41Å; T1007-L1018 HydrophobicContact CG2-CD2 4.22Å; T1007-T1040 PolarHBondContact N-O 2.94Å; T1007-F1042 PolarHBondContact O-N 3.05Å
1008	E	94.6	Very high	89.4	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.009	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	134.3	169.6	-174.8	-178.2	156	0	0	110.5	K555 I929 L930 Q934 F1042	K555-E1008 VanDerWaalsContact CD-CD 3.49Å; K555-E1008 HydrophobicContact CD-CG 4.24Å; K555-E1008 WeakPolarHBondContact CD-OE1 3.35Å; K555-E1008 WeakPolarHBondContact CE-OE2 3.37Å; K555-E1008 IonicContact NZ-OE1 3.6Å; K555-E1008 PolarHBondContact NZ-OE1 3.07Å; K555-E1008 IonicContact NZ-OE2 2.89Å; K555-E1008 PolarHBondContact NZ-OE2 2.69Å; I929-E1008 PolarHBondContact O-N 2.9Å; L930-E1008 HydrophobicContact CD2-CB 4.06Å; L930-E1008 WeakPolarHBondContact CD2-OE2 3.45Å; Q934-E1008 PolarHBondContact NE2-OE1 2.83Å; E1008-F1042 WeakPolarHBondContact CA-O 3.25Å
1009	L	91.3	Very high	90.2	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	143.1	171.9	-62.5	175.9	0	0	0	111.4	D944 T1007 V1015 L1018 A1041 F1042 A1043 V1044	D944-L1009 HydrophobicContact CB-CD2 4.01Å; D944-L1009 WeakPolarHBondContact OD1-CA 3.49Å; T1007-L1009 HydrophobicContact CG2-CD2 4.41Å; L1009-V1015 HydrophobicContact CD1-CB 3.79Å; L1009-V1015 HydrophobicContact CD1-CG2 4.04Å; L1009-L1018 HydrophobicContact CD1-CD1 4Å; L1009-L1018 HydrophobicContact CD2-CD1 4.48Å; L1009-L1018 HydrophobicContact CG-CD1 4.48Å; L1009-A1041 HydrophobicContact CD1-CB 4.17Å; L1009-F1042 PolarHBondContact N-O 3.02Å; L1009-A1043 HydrophobicContact CB-CB 4.34Å; L1009-A1043 WeakPolarHBondContact O-CA 3.29Å; L1009-V1044 PolarHBondContact O-N 3.09Å
1010	V	85.8	Confident	90.1	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.024	17%	0.17	C	C	.	.	S	Bend	trans	-90	-42.7	172.8	-171.6	0	0	0	0	110.3	Y494 Q934 Q943 D944	Y494-V1010 HydrophobicContact CD1-CG1 3.57Å; Y494-V1010 HydrophobicContact CE1-CG1 3.56Å; Q934-V1010 HydrophobicContact CB-CG2 3.99Å; Q934-V1010 HydrophobicContact CG-CG2 3.58Å; Q943-V1010 HydrophobicContact CB-CB 4.45Å; D944-V1010 WeakPolarHBondContact OD1-CG2 3.42Å; D944-V1010 PolarHBondContact OD1-N 3.38Å; D944-V1010 PolarHBondContact OD2-N 3.36Å
1011	N	85.8	Confident	90.1	Very high	37 Å²	37	36.1 Å²	36.1	20%	0.198	19%	0.189	C	C	.	.	S	Bend	trans	-111.6	126	-177.5	-178.3	-8.6	0	0	0	111.4	T940 D944 T1013 N1014	T940-N1011 PolarHBondContact O-ND2 3.31Å; D944-N1011 PolarHBondContact OD2-N 3.02Å; D944-N1011 VanDerWaalsContact OD2-N 3.08Å; N1011-T1013 VanDerWaalsContact C-N 3.3Å; N1011-T1013 PolarHBondContact ND2-OG1 3.33Å; N1011-T1013 PolarHBondContact O-N 3.31Å; N1011-T1013 PolarHBondContact OD1-N 2.82Å; N1011-T1013 VanDerWaalsContact OD1-N 3.11Å; N1011-T1013 PolarHBondContact OD1-OG1 3.16Å; N1011-T1013 VanDerWaalsContact OD1-OG1 3.11Å; N1011-N1014 WeakPolarHBondContact O-CB 3.5Å; N1011-N1014 PolarHBondContact O-N 2.94Å
1012	D	87.6	Confident	89.7	Confident	50 Å²	50	34.1 Å²	34.1	27%	0.267	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-58.6	-37	-178	-69.4	-5.6	0	0	0	112.9	N1014 V1015 L1030 A1043 S1045	D1012-N1014 PolarHBondContact O-N 2.9Å; D1012-N1014 VanDerWaalsContact O-N 3.14Å; D1012-V1015 WeakPolarHBondContact O-CB 3.4Å; D1012-V1015 VanDerWaalsContact O-CG1 3.23Å; D1012-V1015 WeakPolarHBondContact O-CG1 3.47Å; D1012-V1015 PolarHBondContact O-N 2.84Å; D1012-L1030 HydrophobicContact CB-CB 4.38Å; D1012-A1043 VanDerWaalsContact OD1-CB 3.24Å; D1012-A1043 WeakPolarHBondContact OD1-CB 3.22Å; D1012-S1045 VanDerWaalsContact CG-OG 3.23Å; D1012-S1045 VanDerWaalsContact OD1-CB 3.23Å; D1012-S1045 WeakPolarHBondContact OD1-CB 3.43Å; D1012-S1045 PolarHBondContact OD1-OG 3.31Å; D1012-S1045 WeakPolarHBondContact OD2-CB 3.35Å; D1012-S1045 PolarHBondContact OD2-OG 3.03Å; D1012-S1045 VanDerWaalsContact OD2-OG 3.13Å
1013	T	87.7	Confident	89	Confident	81 Å²	81	38.9 Å²	38.9	50%	0.497	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-69.6	-12.5	-177.2	65.9	0	0	0	0	113.4	N1011 V1015 Q1016	N1011-T1013 VanDerWaalsContact C-N 3.3Å; N1011-T1013 PolarHBondContact ND2-OG1 3.33Å; N1011-T1013 PolarHBondContact O-N 3.31Å; N1011-T1013 PolarHBondContact OD1-N 2.82Å; N1011-T1013 VanDerWaalsContact OD1-N 3.11Å; N1011-T1013 PolarHBondContact OD1-OG1 3.16Å; N1011-T1013 VanDerWaalsContact OD1-OG1 3.11Å; T1013-V1015 VanDerWaalsContact C-N 3.31Å; T1013-Q1016 PolarHBondContact O-NE2 2.96Å; T1013-Q1016 VanDerWaalsContact O-NE2 3.09Å
1014	N	90.8	Very high	87.9	Confident	6 Å²	6	43.6 Å²	43.6	3%	0.032	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-82.6	-7.2	178.7	-77.8	-20.7	0	0	0	113.3	S941 D944 I948 N1011 D1012 Q1016 F1017	S941-N1014 PolarHBondContact O-ND2 3.13Å; D944-N1014 HydrophobicContact CB-CB 4.25Å; D944-N1014 PolarHBondContact OD2-ND2 3.47Å; I948-N1014 HydrophobicContact CD1-CB 4.16Å; N1011-N1014 WeakPolarHBondContact O-CB 3.5Å; N1011-N1014 PolarHBondContact O-N 2.94Å; D1012-N1014 PolarHBondContact O-N 2.9Å; D1012-N1014 VanDerWaalsContact O-N 3.14Å; N1014-Q1016 VanDerWaalsContact C-N 3.32Å; N1014-Q1016 PolarHBondContact O-N 2.89Å; N1014-F1017 HydrophobicContact CB-CD2 4.36Å; N1014-F1017 PolarHBondContact O-N 3.39Å
1015	V	91.9	Very high	87.1	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.03	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-61.1	-37.3	-176.5	70.5	0	0	0	0	113.5	L1009 D1012 T1013 F1017 L1018 L1030 T1033 P1035 A1041	L1009-V1015 HydrophobicContact CD1-CB 3.79Å; L1009-V1015 HydrophobicContact CD1-CG2 4.04Å; D1012-V1015 WeakPolarHBondContact O-CB 3.4Å; D1012-V1015 VanDerWaalsContact O-CG1 3.23Å; D1012-V1015 WeakPolarHBondContact O-CG1 3.47Å; D1012-V1015 PolarHBondContact O-N 2.84Å; T1013-V1015 VanDerWaalsContact C-N 3.31Å; V1015-F1017 VanDerWaalsContact C-N 3.25Å; V1015-F1017 PolarHBondContact O-N 2.94Å; V1015-L1018 WeakPolarHBondContact O-CB 3.18Å; V1015-L1018 PolarHBondContact O-N 3.48Å; V1015-L1018 VanDerWaalsContact O-N 3.17Å; V1015-L1030 HydrophobicContact CB-CD1 3.88Å; V1015-L1030 HydrophobicContact CG1-CD1 3.91Å; V1015-L1030 HydrophobicContact CG2-CD1 3.91Å; V1015-T1033 HydrophobicContact CG1-CG2 3.73Å; V1015-P1035 HydrophobicContact CG2-CB 3.87Å; V1015-P1035 HydrophobicContact CG2-CG 4.16Å; V1015-A1041 HydrophobicContact CG2-CB 3.74Å
1016	Q	89	Confident	86.1	Confident	42 Å²	42	51 Å²	51	20%	0.196	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-53.4	-40.2	179.7	62.7	-166.3	-15.4	0	0	112.3	T1013 N1014 L1018 D1019	T1013-Q1016 PolarHBondContact O-NE2 2.96Å; T1013-Q1016 VanDerWaalsContact O-NE2 3.09Å; N1014-Q1016 VanDerWaalsContact C-N 3.32Å; N1014-Q1016 PolarHBondContact O-N 2.89Å; Q1016-L1018 PolarHBondContact O-N 3.24Å; Q1016-D1019 PolarHBondContact O-N 3.35Å
1017	F	91.6	Very high	85.3	Confident	100 Å²	100	58.1 Å²	58.1	44%	0.439	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-68.3	-1.7	-176.6	-53.3	-54.2	0	0	0	115.3	I948 N1014 V1015	I948-F1017 HydrophobicContact CD1-CB 4.29Å; I948-F1017 HydrophobicContact CD1-CD2 4.17Å; I948-F1017 HydrophobicContact CG2-CB 3.88Å; N1014-F1017 HydrophobicContact CB-CD2 4.36Å; N1014-F1017 PolarHBondContact O-N 3.39Å; V1015-F1017 VanDerWaalsContact C-N 3.25Å; V1015-F1017 PolarHBondContact O-N 2.94Å
1018	L	92	Very high	84.8	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-84	-29.9	179.2	-66.1	177.3	0	0	0	113.6	I948 K955 T1007 L1009 V1015 Q1016 P1035 A1041	I948-L1018 HydrophobicContact CG1-CD2 4.29Å; K955-L1018 PolarHBondContact NZ-O 2.92Å; T1007-L1018 HydrophobicContact CG2-CD2 4.22Å; L1009-L1018 HydrophobicContact CD1-CD1 4Å; L1009-L1018 HydrophobicContact CD2-CD1 4.48Å; L1009-L1018 HydrophobicContact CG-CD1 4.48Å; V1015-L1018 WeakPolarHBondContact O-CB 3.18Å; V1015-L1018 PolarHBondContact O-N 3.48Å; V1015-L1018 VanDerWaalsContact O-N 3.17Å; Q1016-L1018 PolarHBondContact O-N 3.24Å; L1018-P1035 HydrophobicContact CB-CB 4.22Å; L1018-P1035 HydrophobicContact CB-CG 4.26Å; L1018-P1035 HydrophobicContact CD1-CB 4.3Å; L1018-A1041 HydrophobicContact CD1-CB 3.69Å
1019	D	87.4	Confident	84.4	Confident	11 Å²	11	64.5 Å²	64.5	6%	0.059	34%	0.341	C	S	.	.			trans	-119.5	164.9	177	-84.4	-20.6	0	0	0	110.4	K955 Q1016 Q1034 P1035 K1157	K955-D1019 IonicContact NZ-OD1 2.7Å; K955-D1019 PolarHBondContact NZ-OD1 2.92Å; Q1016-D1019 PolarHBondContact O-N 3.35Å; D1019-Q1034 PolarHBondContact OD2-NE2 3.29Å; D1019-P1035 HydrophobicContact CB-CG 4.17Å; D1019-K1157 IonicContact OD1-NZ 3.8Å; D1019-K1157 PolarHBondContact OD1-NZ 3.33Å; D1019-K1157 WeakPolarHBondContact OD2-CE 3.41Å; D1019-K1157 IonicContact OD2-NZ 3.46Å; D1019-K1157 PolarHBondContact OD2-NZ 2.86Å
1020	Q	80.6	Confident	84.3	Confident	168 Å²	168	65.3 Å²	65.3	79%	0.785	35%	0.345	S	S	*	.	S	Bend	trans	-129.2	16.1	-175.4	-62.5	-178.3	-15.1	0	0	111.8
1021	D	82.2	Confident	84.5	Confident	74 Å²	74	66 Å²	66	40%	0.396	35%	0.348	S	S	.	.	S	Bend	trans	-148.7	35	-169.5	64.4	-62.5	0	0	0	109.5	Q1034 R1145 K1157	D1021-Q1034 PolarHBondContact O-NE2 3.05Å; D1021-R1145 PolarHBondContact O-NH1 2.72Å; D1021-R1145 IonicContact OD2-CZ 2.69Å; D1021-R1145 IonicContact OD2-NH1 2.75Å; D1021-R1145 PolarHBondContact OD2-NH1 2.96Å; D1021-R1145 IonicContact OD2-NH2 3.17Å; D1021-K1157 IonicContact OD1-NZ 2.72Å; D1021-K1157 PolarHBondContact OD1-NZ 3.39Å; D1021-K1157 IonicContact OD2-NZ 2.75Å; D1021-K1157 PolarHBondContact OD2-NZ 3.3Å
1022	D	78.3	Confident	84.7	Confident	38 Å²	38	66.1 Å²	66.1	20%	0.203	35%	0.348	C	S	.	.	S	Bend	trans	-114.4	160	164	-155.1	11.4	0	0	0	107.3	D1024 Q1034	D1022-D1024 PolarHBondContact O-N 3.34Å; D1022-Q1034 HydrophobicContact CB-CB 4.14Å; D1022-Q1034 WeakPolarHBondContact OD2-CB 3.37Å; D1022-Q1034 PolarHBondContact OD2-N 2.92Å
1023	D	75	Confident	85	Confident	158 Å²	158	64.4 Å²	64.4	85%	0.845	34%	0.339	S	S	*	.			trans	-89.4	97.4	175.6	-76.3	-54.6	0	0	0	109.4	D1025	D1023-D1025 PolarHBondContact O-N 2.99Å
1024	D	69.6	Low	85.2	Confident	106 Å²	106	60.7 Å²	60.7	57%	0.567	32%	0.316	S	S	*	.			trans	-65.2	89.4	-173	-68.2	-33.4	0	0	0	113.8	D1022	D1022-D1024 PolarHBondContact O-N 3.34Å
1025	D	78.2	Confident	85.4	Confident	89 Å²	89	60.4 Å²	60.4	48%	0.476	32%	0.315	S	S	.	.			trans	-106.9	113	164.4	-177	-10.8	0	0	0	110.8	D1023 D1027 T1028	D1023-D1025 PolarHBondContact O-N 2.99Å; D1025-D1027 VanDerWaalsContact C-N 3.27Å; D1025-D1027 PolarHBondContact O-N 3.37Å; D1025-D1027 PolarHBondContact OD1-N 2.9Å; D1025-T1028 WeakPolarHBondContact O-CB 3.49Å; D1025-T1028 PolarHBondContact O-N 3.28Å; D1025-T1028 VanDerWaalsContact O-N 3.13Å; D1025-T1028 PolarHBondContact O-OG1 2.95Å
1026	P	75.3	Confident	85.5	Confident	94 Å²	94	60.2 Å²	60.2	61%	0.61	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-12.9	-176.3	31.1	-37.4	0	0	0	114.9	T1028	P1026-T1028 PolarHBondContact O-N 3.42Å
1027	D	80.9	Confident	85.8	Confident	152 Å²	152	58.2 Å²	58.2	81%	0.813	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-3	172.5	-78.1	-20	0	0	0	112.1	D1025 E1029	D1025-D1027 VanDerWaalsContact C-N 3.27Å; D1025-D1027 PolarHBondContact O-N 3.37Å; D1025-D1027 PolarHBondContact OD1-N 2.9Å; D1027-E1029 PolarHBondContact O-N 3.2Å
1028	T	84.7	Confident	85.9	Confident	50 Å²	50	53.6 Å²	53.6	31%	0.307	28%	0.284	S	S	.	.	S	Bend	trans	-69.1	119.3	178.8	-58.3	0	0	0	0	112.2	D1025 P1026 L1030 L1032 T1033	D1025-T1028 WeakPolarHBondContact O-CB 3.49Å; D1025-T1028 PolarHBondContact O-N 3.28Å; D1025-T1028 VanDerWaalsContact O-N 3.13Å; D1025-T1028 PolarHBondContact O-OG1 2.95Å; P1026-T1028 PolarHBondContact O-N 3.42Å; T1028-L1030 PolarHBondContact O-N 2.94Å; T1028-L1032 HydrophobicContact CG2-CB 3.53Å; T1028-L1032 HydrophobicContact CG2-CD1 4.38Å; T1028-T1033 HydrophobicContact CG2-CG2 3.8Å
1029	E	86.2	Confident	86.1	Confident	88 Å²	88	53.5 Å²	53.5	41%	0.411	28%	0.284	S	S	.	.			trans	-62.3	134.1	172.8	-63.5	-165.7	127.6	0	0	111.1	K426 D1027 Y1031 L1032	K426-E1029 IonicContact NZ-OE1 3.38Å; K426-E1029 PolarHBondContact NZ-OE1 3.08Å; D1027-E1029 PolarHBondContact O-N 3.2Å; E1029-Y1031 HydrophobicContact CB-CD1 4.01Å; E1029-Y1031 HydrophobicContact CB-CE1 3.65Å; E1029-Y1031 PolarHBondContact O-N 2.82Å; E1029-Y1031 WeakPolarHBondContact OE2-CE1 3.26Å; E1029-L1032 PolarHBondContact O-N 2.74Å
1030	L	89.3	Confident	86.4	Confident	17 Å²	17	54.1 Å²	54.1	9%	0.089	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-34.6	-43.4	-171.5	174.2	65.2	0	0	0	115.7	D1012 V1015 T1028 L1032 T1033 F1036 A1043 V1046	D1012-L1030 HydrophobicContact CB-CB 4.38Å; V1015-L1030 HydrophobicContact CB-CD1 3.88Å; V1015-L1030 HydrophobicContact CG1-CD1 3.91Å; V1015-L1030 HydrophobicContact CG2-CD1 3.91Å; T1028-L1030 PolarHBondContact O-N 2.94Å; L1030-L1032 VanDerWaalsContact C-N 3.32Å; L1030-L1032 PolarHBondContact O-N 2.79Å; L1030-T1033 WeakPolarHBondContact O-CB 3.44Å; L1030-T1033 PolarHBondContact O-N 3.27Å; L1030-T1033 PolarHBondContact O-OG1 3.36Å; L1030-F1036 HydrophobicContact CD1-CB 4.3Å; L1030-F1036 HydrophobicContact CD1-CD2 4.24Å; L1030-F1036 HydrophobicContact CD1-CG 4.5Å; L1030-F1036 HydrophobicContact CD2-CD2 4.14Å; L1030-F1036 HydrophobicContact CD2-CE2 4.25Å; L1030-F1036 HydrophobicContact CG-CB 4.5Å; L1030-F1036 HydrophobicContact CG-CD2 3.97Å; L1030-F1036 HydrophobicContact CG-CE2 4.46Å; L1030-F1036 HydrophobicContact CG-CG 4.25Å; L1030-F1036 WeakPolarHBondContact O-CB 3.17Å; L1030-A1043 HydrophobicContact CD2-CB 3.65Å; L1030-V1046 HydrophobicContact CD2-CG1 3.81Å
1031	Y	90.4	Very high	87.1	Confident	19 Å²	19	46.1 Å²	46.1	8%	0.075	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-71.9	-20.3	-174.3	71.4	-84.7	0	0	0	115.3	R579 Y593 L594 V597 E1029 T1033 F1036	R579-Y1031 VanDerWaalsContact NH1-CG 3.25Å; Y593-Y1031 HydrophobicContact CE1-CD2 4.46Å; Y593-Y1031 WeakPolarHBondContact CE1-O 3.48Å; Y593-Y1031 PolarHBondContact OH-O 2.77Å; L594-Y1031 HydrophobicContact CD2-CE2 4.36Å; V597-Y1031 HydrophobicContact CG1-CD2 4.14Å; V597-Y1031 HydrophobicContact CG1-CE2 4.11Å; V597-Y1031 HydrophobicContact CG2-CD2 4.38Å; E1029-Y1031 HydrophobicContact CB-CD1 4.01Å; E1029-Y1031 HydrophobicContact CB-CE1 3.65Å; E1029-Y1031 PolarHBondContact O-N 2.82Å; E1029-Y1031 WeakPolarHBondContact OE2-CE1 3.26Å; Y1031-T1033 VanDerWaalsContact C-N 3.33Å; Y1031-F1036 VanDerWaalsContact CA-CD1 3.48Å
1032	L	90.9	Very high	87.7	Confident	38 Å²	38	42.6 Å²	42.6	20%	0.199	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-79.9	-18.2	176.1	-67.6	171.3	0	0	0	112.1	W589 L594 T1028 E1029 L1030	W589-L1032 WeakPolarHBondContact CH2-O 3.4Å; L594-L1032 HydrophobicContact CD1-CD2 4.41Å; L594-L1032 HydrophobicContact CD2-CD2 3.88Å; L594-L1032 HydrophobicContact CG-CD2 4.45Å; T1028-L1032 HydrophobicContact CG2-CB 3.53Å; T1028-L1032 HydrophobicContact CG2-CD1 4.38Å; E1029-L1032 PolarHBondContact O-N 2.74Å; L1030-L1032 VanDerWaalsContact C-N 3.32Å; L1030-L1032 PolarHBondContact O-N 2.79Å
1033	T	92.2	Very high	88.3	Confident	14 Å²	14	40.8 Å²	40.8	9%	0.086	22%	0.222	C	C	.	.	S	Bend	trans	-70.7	143.4	-178.3	72	0	0	0	0	112.1	V1015 T1028 L1030 Y1031 F1036 A1037	V1015-T1033 HydrophobicContact CG1-CG2 3.73Å; T1028-T1033 HydrophobicContact CG2-CG2 3.8Å; L1030-T1033 WeakPolarHBondContact O-CB 3.44Å; L1030-T1033 PolarHBondContact O-N 3.27Å; L1030-T1033 PolarHBondContact O-OG1 3.36Å; Y1031-T1033 VanDerWaalsContact C-N 3.33Å; T1033-F1036 PolarHBondContact O-N 2.98Å; T1033-A1037 WeakPolarHBondContact O-CB 3.29Å; T1033-A1037 PolarHBondContact O-N 3.03Å
1034	Q	92.5	Very high	88.9	Confident	3 Å²	3	34 Å²	34	1%	0.014	19%	0.186	C	C	.	.	H	α-helix	trans	-59.2	-43.7	-178.5	178.2	176.5	-111.1	0	0	113.8	W589 D1019 D1021 D1022 F1036 A1037 C1038	W589-Q1034 HydrophobicContact CH2-CB 4.42Å; W589-Q1034 HydrophobicContact CZ2-CB 4.06Å; D1019-Q1034 PolarHBondContact OD2-NE2 3.29Å; D1021-Q1034 PolarHBondContact O-NE2 3.05Å; D1022-Q1034 HydrophobicContact CB-CB 4.14Å; D1022-Q1034 WeakPolarHBondContact OD2-CB 3.37Å; D1022-Q1034 PolarHBondContact OD2-N 2.92Å; Q1034-F1036 VanDerWaalsContact C-N 3.28Å; Q1034-F1036 PolarHBondContact O-N 2.94Å; Q1034-A1037 PolarHBondContact O-N 3.43Å; Q1034-C1038 VanDerWaalsContact O-CB 3.31Å; Q1034-C1038 WeakPolarHBondContact O-CB 3.34Å; Q1034-C1038 PolarHBondContact O-N 3.15Å; Q1034-C1038 PolarHBondContact O-SG 3.1Å; Q1034-C1038 VanDerWaalsContact O-SG 3.34Å
1035	P	94.4	Very high	89.7	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.006	16%	0.162	C	C	.	.	H	α-helix	trans	-64.1	-34.1	-177.3	-22.6	35.5	0	0	0	112.5	V1015 L1018 D1019 G1039 T1040 A1041	V1015-P1035 HydrophobicContact CG2-CB 3.87Å; V1015-P1035 HydrophobicContact CG2-CG 4.16Å; L1018-P1035 HydrophobicContact CB-CB 4.22Å; L1018-P1035 HydrophobicContact CB-CG 4.26Å; L1018-P1035 HydrophobicContact CD1-CB 4.3Å; D1019-P1035 HydrophobicContact CB-CG 4.17Å; P1035-G1039 PolarHBondContact O-N 3.03Å; P1035-T1040 WeakPolarHBondContact CA-OG1 3.34Å; P1035-T1040 PolarHBondContact O-N 3.2Å; P1035-T1040 PolarHBondContact O-OG1 3.14Å; P1035-A1041 HydrophobicContact CB-CB 4.03Å; P1035-A1041 PolarHBondContact O-N 3.47Å; P1035-A1041 VanDerWaalsContact O-N 3.1Å
1036	F	95	Very high	90.1	Very high	1 Å²	1	25.6 Å²	25.6	0%	0.004	14%	0.143	C	C	.	.	H	α-helix	trans	-73.9	-46.1	172.8	-173.8	-89.8	0	0	0	111.7	T570 A573 L1030 Y1031 T1033 Q1034 C1038 G1039 V1046	T570-F1036 WeakPolarHBondContact CB-O 3.47Å; T570-F1036 HydrophobicContact CG2-CD1 3.87Å; T570-F1036 HydrophobicContact CG2-CE1 3.72Å; T570-F1036 HydrophobicContact CG2-CZ 4.43Å; T570-F1036 WeakPolarHBondContact CG2-O 3.35Å; T570-F1036 PolarHBondContact OG1-O 3.45Å; A573-F1036 HydrophobicContact CB-CZ 4.02Å; L1030-F1036 HydrophobicContact CD1-CB 4.3Å; L1030-F1036 HydrophobicContact CD1-CD2 4.24Å; L1030-F1036 HydrophobicContact CD1-CG 4.5Å; L1030-F1036 HydrophobicContact CD2-CD2 4.14Å; L1030-F1036 HydrophobicContact CD2-CE2 4.25Å; L1030-F1036 HydrophobicContact CG-CB 4.5Å; L1030-F1036 HydrophobicContact CG-CD2 3.97Å; L1030-F1036 HydrophobicContact CG-CE2 4.46Å; L1030-F1036 HydrophobicContact CG-CG 4.25Å; L1030-F1036 WeakPolarHBondContact O-CB 3.17Å; Y1031-F1036 VanDerWaalsContact CA-CD1 3.48Å; T1033-F1036 PolarHBondContact O-N 2.98Å; Q1034-F1036 VanDerWaalsContact C-N 3.28Å; Q1034-F1036 PolarHBondContact O-N 2.94Å; F1036-C1038 PolarHBondContact O-N 2.63Å; F1036-G1039 PolarHBondContact O-N 2.92Å; F1036-V1046 HydrophobicContact CE2-CG1 3.94Å; F1036-V1046 HydrophobicContact CZ-CG1 4.14Å
1037	A	94.4	Very high	90.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.6	-29.6	178.3	0	0	0	0	0	113.4	W589 Y593 T1033 Q1034 Y1159 V1160	W589-A1037 HydrophobicContact CE3-CB 4.45Å; W589-A1037 HydrophobicContact CH2-CB 3.75Å; W589-A1037 HydrophobicContact CZ3-CB 3.42Å; W589-A1037 VanDerWaalsContact CZ3-CB 3.42Å; Y593-A1037 HydrophobicContact CD2-CB 3.84Å; Y593-A1037 HydrophobicContact CE1-CB 4.27Å; Y593-A1037 HydrophobicContact CE2-CB 3.56Å; Y593-A1037 HydrophobicContact CG-CB 4.33Å; T1033-A1037 WeakPolarHBondContact O-CB 3.29Å; T1033-A1037 PolarHBondContact O-N 3.03Å; Q1034-A1037 PolarHBondContact O-N 3.43Å; A1037-Y1159 WeakPolarHBondContact O-CA 3.2Å; A1037-V1160 PolarHBondContact O-N 2.95Å
1038	C	94.9	Very high	91.1	Very high	2 Å²	2	14.3 Å²	14.3	1%	0.014	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-7.1	172.7	-66.6	0	0	0	0	114.8	Q1034 F1036 T1040 Y1142 R1158	Q1034-C1038 VanDerWaalsContact O-CB 3.31Å; Q1034-C1038 WeakPolarHBondContact O-CB 3.34Å; Q1034-C1038 PolarHBondContact O-N 3.15Å; Q1034-C1038 PolarHBondContact O-SG 3.1Å; Q1034-C1038 VanDerWaalsContact O-SG 3.34Å; F1036-C1038 PolarHBondContact O-N 2.63Å; C1038-T1040 VanDerWaalsContact C-N 3.3Å; C1038-T1040 HydrophobicContact CB-CG2 4.28Å; C1038-T1040 PolarHBondContact O-N 3.36Å; C1038-Y1142 PolarHBondContact O-OH 3.13Å; C1038-R1158 WeakPolarHBondContact CA-O 3.4Å; C1038-R1158 VanDerWaalsContact CB-O 3.25Å; C1038-R1158 WeakPolarHBondContact CB-O 3.14Å; C1038-R1158 PolarHBondContact SG-O 3.42Å
1039	G	95.1	Very high	91.3	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	29.3	-178.2	0	0	0	0	0	114.7	T570 P1035 F1036	T570-G1039 WeakPolarHBondContact OG1-CA 3.45Å; P1035-G1039 PolarHBondContact O-N 3.03Å; F1036-G1039 PolarHBondContact O-N 2.92Å
1040	T	94.9	Very high	91.5	Very high	24 Å²	24	8.1 Å²	8.1	15%	0.147	5%	0.045	C	C	.	.	S	Bend	trans	-93.9	-15.7	170.9	63.2	0	0	0	0	112.3	I1005 I1006 T1007 P1035 C1038	I1005-T1040 WeakPolarHBondContact O-CA 3.48Å; I1005-T1040 WeakPolarHBondContact O-CB 3.43Å; I1006-T1040 WeakPolarHBondContact CA-O 3.39Å; T1007-T1040 PolarHBondContact N-O 2.94Å; P1035-T1040 WeakPolarHBondContact CA-OG1 3.34Å; P1035-T1040 PolarHBondContact O-N 3.2Å; P1035-T1040 PolarHBondContact O-OG1 3.14Å; C1038-T1040 VanDerWaalsContact C-N 3.3Å; C1038-T1040 HydrophobicContact CB-CG2 4.28Å; C1038-T1040 PolarHBondContact O-N 3.36Å
1041	A	95.1	Very high	91.6	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	145.3	171	0	0	0	0	0	111.7	L1009 V1015 L1018 P1035	L1009-A1041 HydrophobicContact CD1-CB 4.17Å; V1015-A1041 HydrophobicContact CG2-CB 3.74Å; L1018-A1041 HydrophobicContact CD1-CB 3.69Å; P1035-A1041 HydrophobicContact CB-CB 4.03Å; P1035-A1041 PolarHBondContact O-N 3.47Å; P1035-A1041 VanDerWaalsContact O-N 3.1Å
1042	F	95.1	Very high	91.6	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	4%	0.038	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	110.6	167.4	-171.7	-94.3	0	0	0	110.8	K555 F558 I559 I1006 T1007 E1008 L1009 V1046 L1047	K555-F1042 HydrophobicContact CB-CE1 4.26Å; K555-F1042 HydrophobicContact CG-CD1 4.19Å; K555-F1042 HydrophobicContact CG-CE1 3.96Å; F558-F1042 HydrophobicContact CB-CE2 4.01Å; F558-F1042 HydrophobicContact CB-CZ 4.05Å; F558-F1042 HydrophobicContact CD2-CE2 4.25Å; F558-F1042 AromaticContact CD2-CZ 3.79Å; F558-F1042 HydrophobicContact CD2-CZ 3.79Å; F558-F1042 HydrophobicContact CG-CE2 4.28Å; F558-F1042 HydrophobicContact CG-CZ 4.21Å; I559-F1042 HydrophobicContact CD1-CD1 4.4Å; I559-F1042 HydrophobicContact CG1-CD1 4.43Å; I1006-F1042 HydrophobicContact CD1-CB 4.5Å; T1007-F1042 PolarHBondContact O-N 3.05Å; E1008-F1042 WeakPolarHBondContact CA-O 3.25Å; L1009-F1042 PolarHBondContact N-O 3.02Å; F1042-V1046 HydrophobicContact CE2-CG2 3.99Å; F1042-V1046 HydrophobicContact CZ-CG2 3.91Å; F1042-L1047 HydrophobicContact CZ-CD2 4.28Å
1043	A	90.8	Very high	91.6	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.033	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	152.7	174.7	0	0	0	0	0	111.7	L1009 D1012 L1030 S1045	L1009-A1043 HydrophobicContact CB-CB 4.34Å; L1009-A1043 WeakPolarHBondContact O-CA 3.29Å; D1012-A1043 VanDerWaalsContact OD1-CB 3.24Å; D1012-A1043 WeakPolarHBondContact OD1-CB 3.22Å; L1030-A1043 HydrophobicContact CD2-CB 3.65Å; A1043-S1045 VanDerWaalsContact C-N 3.34Å; A1043-S1045 WeakPolarHBondContact CB-OG 3.38Å
1044	V	87.4	Confident	91.5	Very high	16 Å²	16	4.5 Å²	4.5	10%	0.097	3%	0.029	C	C	.	.	S	Bend	trans	-74.4	-24.7	178	70.1	0	0	0	0	113.2	K493 Y494 L551 L1009 V1046 L1047	K493-V1044 HydrophobicContact CD-CG1 4.09Å; K493-V1044 HydrophobicContact CD-CG2 4.05Å; Y494-V1044 HydrophobicContact CE1-CG1 3.95Å; L551-V1044 HydrophobicContact CD1-CG2 4.45Å; L1009-V1044 PolarHBondContact O-N 3.09Å; V1044-V1046 VanDerWaalsContact C-N 3.29Å; V1044-V1046 PolarHBondContact O-N 3.26Å; V1044-L1047 HydrophobicContact CG2-CD1 4.4Å; V1044-L1047 WeakPolarHBondContact O-CB 3.02Å; V1044-L1047 PolarHBondContact O-N 2.77Å; V1044-L1047 VanDerWaalsContact O-N 3.11Å
1045	S	85.5	Confident	91.5	Very high	9 Å²	9	5.2 Å²	5.2	6%	0.063	3%	0.031	C	C	.	.	G	3₁₀ helix	trans	-49.1	-42.5	178.7	53.6	0	0	0	0	114	D1012 A1043 L1047 D1048	D1012-S1045 VanDerWaalsContact CG-OG 3.23Å; D1012-S1045 VanDerWaalsContact OD1-CB 3.23Å; D1012-S1045 WeakPolarHBondContact OD1-CB 3.43Å; D1012-S1045 PolarHBondContact OD1-OG 3.31Å; D1012-S1045 WeakPolarHBondContact OD2-CB 3.35Å; D1012-S1045 PolarHBondContact OD2-OG 3.03Å; D1012-S1045 VanDerWaalsContact OD2-OG 3.13Å; A1043-S1045 VanDerWaalsContact C-N 3.34Å; A1043-S1045 WeakPolarHBondContact CB-OG 3.38Å; S1045-L1047 PolarHBondContact O-N 2.01Å; S1045-D1048 WeakPolarHBondContact O-CB 3.37Å; S1045-D1048 PolarHBondContact O-N 2.67Å
1046	V	87.8	Confident	91.2	Very high	10 Å²	10	7.5 Å²	7.5	6%	0.061	4%	0.042	C	C	.	.	G	3₁₀ helix	trans	-58.4	-23.4	-177.8	-51.2	0	0	0	0	112.9	A573 F576 L1030 F1036 F1042 V1044 D1048	A573-V1046 HydrophobicContact CB-CB 4.41Å; A573-V1046 HydrophobicContact CB-CG2 4.14Å; F576-V1046 WeakPolarHBondContact CE2-O 3.44Å; L1030-V1046 HydrophobicContact CD2-CG1 3.81Å; F1036-V1046 HydrophobicContact CE2-CG1 3.94Å; F1036-V1046 HydrophobicContact CZ-CG1 4.14Å; F1042-V1046 HydrophobicContact CE2-CG2 3.99Å; F1042-V1046 HydrophobicContact CZ-CG2 3.91Å; V1044-V1046 VanDerWaalsContact C-N 3.29Å; V1044-V1046 PolarHBondContact O-N 3.26Å; V1046-D1048 VanDerWaalsContact C-N 3.29Å; V1046-D1048 PolarHBondContact O-N 3.11Å
1047	L	89.7	Confident	90.8	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.053	C	C	.	.	G	3₁₀ helix	trans	-75.4	-13.9	178.6	-57.6	-178.2	0	0	0	113.4	L551 L554 K555 F558 F576 F1042 V1044 S1045 S1049 L1050	L551-L1047 HydrophobicContact CD2-CB 3.88Å; L551-L1047 HydrophobicContact CD2-CD1 3.99Å; L554-L1047 HydrophobicContact CB-CD1 4.28Å; L554-L1047 HydrophobicContact CB-CD2 4.4Å; K555-L1047 HydrophobicContact CB-CD1 4.25Å; F558-L1047 HydrophobicContact CD2-CD2 4.09Å; F558-L1047 HydrophobicContact CE2-CD2 3.64Å; F576-L1047 HydrophobicContact CZ-CD2 4.21Å; F1042-L1047 HydrophobicContact CZ-CD2 4.28Å; V1044-L1047 HydrophobicContact CG2-CD1 4.4Å; V1044-L1047 WeakPolarHBondContact O-CB 3.02Å; V1044-L1047 PolarHBondContact O-N 2.77Å; V1044-L1047 VanDerWaalsContact O-N 3.11Å; S1045-L1047 PolarHBondContact O-N 2.01Å; L1047-S1049 VanDerWaalsContact C-N 3.33Å; L1047-L1050 VanDerWaalsContact O-CB 3.31Å; L1047-L1050 WeakPolarHBondContact O-CB 2.96Å; L1047-L1050 PolarHBondContact O-N 2.69Å
1048	D	87.1	Confident	90.3	Very high	9 Å²	9	12.9 Å²	12.9	5%	0.048	7%	0.07	C	C	.	.	S	Bend	trans	-65.1	-37.6	173.7	-71.3	-24.5	0	0	0	111.2	N423 K493 Q524 S1045 V1046 L1050 M1051	N423-D1048 HydrophobicContact CB-CB 4.33Å; K493-D1048 IonicContact NZ-OD1 2.62Å; K493-D1048 PolarHBondContact NZ-OD1 3.18Å; K493-D1048 IonicContact NZ-OD2 3.36Å; K493-D1048 PolarHBondContact NZ-OD2 3.22Å; Q524-D1048 PolarHBondContact NE2-OD1 3.36Å; Q524-D1048 VanDerWaalsContact NE2-OD1 3.13Å; S1045-D1048 WeakPolarHBondContact O-CB 3.37Å; S1045-D1048 PolarHBondContact O-N 2.67Å; V1046-D1048 VanDerWaalsContact C-N 3.29Å; V1046-D1048 PolarHBondContact O-N 3.11Å; D1048-L1050 PolarHBondContact O-N 3.18Å; D1048-L1050 VanDerWaalsContact O-N 3.09Å; D1048-M1051 WeakPolarHBondContact O-CB 3.47Å; D1048-M1051 PolarHBondContact O-N 2.79Å
1049	S	88.3	Confident	90	Very high	7 Å²	7	14.7 Å²	14.7	5%	0.049	8%	0.08	C	C	.	.	H	α-helix	trans	-52	-34.9	174.9	-56.7	0	0	0	0	112.2	D427 S577 L1047 M1051 S1052 A1053	D427-S1049 VanDerWaalsContact OD2-CA 3.3Å; D427-S1049 WeakPolarHBondContact OD2-CA 3.41Å; D427-S1049 WeakPolarHBondContact OD2-CB 3.15Å; D427-S1049 PolarHBondContact OD2-OG 2.75Å; S577-S1049 PolarHBondContact OG-OG 2.68Å; L1047-S1049 VanDerWaalsContact C-N 3.33Å; S1049-M1051 PolarHBondContact O-N 2.82Å; S1049-S1052 PolarHBondContact O-N 2.93Å; S1049-S1052 PolarHBondContact O-OG 3.41Å; S1049-A1053 PolarHBondContact O-N 3.29Å; S1049-A1053 VanDerWaalsContact O-N 3.14Å
1050	L	90.8	Very high	89.6	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-65.7	-23.3	-176.7	-166.8	62.4	0	0	0	113.2	I549 L554 F576 L1047 D1048 S1052 A1053 T1054 I1060 L1061 I1064	I549-L1050 HydrophobicContact CD1-CG 4.2Å; I549-L1050 HydrophobicContact CG2-CD2 4.14Å; L554-L1050 HydrophobicContact CD1-CD2 3.43Å; L554-L1050 VanDerWaalsContact CD1-CD2 3.43Å; F576-L1050 HydrophobicContact CB-CD1 4.41Å; F576-L1050 HydrophobicContact CD1-CD1 4.47Å; F576-L1050 HydrophobicContact CD2-CB 4.08Å; F576-L1050 HydrophobicContact CD2-CD1 4.07Å; F576-L1050 HydrophobicContact CE2-CB 4.04Å; F576-L1050 HydrophobicContact CE2-CD1 4.46Å; F576-L1050 HydrophobicContact CG-CD1 4.08Å; L1047-L1050 VanDerWaalsContact O-CB 3.31Å; L1047-L1050 WeakPolarHBondContact O-CB 2.96Å; L1047-L1050 PolarHBondContact O-N 2.69Å; D1048-L1050 PolarHBondContact O-N 3.18Å; D1048-L1050 VanDerWaalsContact O-N 3.09Å; L1050-S1052 VanDerWaalsContact C-N 3.35Å; L1050-A1053 HydrophobicContact CD1-CB 4.39Å; L1050-T1054 VanDerWaalsContact O-CB 3.23Å; L1050-T1054 WeakPolarHBondContact O-CB 3.39Å; L1050-T1054 PolarHBondContact O-N 3.5Å; L1050-T1054 PolarHBondContact O-OG1 3.3Å; L1050-I1060 HydrophobicContact CD1-CG2 4.4Å; L1050-L1061 HydrophobicContact CD2-CD1 3.96Å; L1050-I1064 HydrophobicContact CD1-CD1 3.78Å
1051	M	91.4	Very high	89.4	Confident	1 Å²	1	14 Å²	14	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-60.4	-45.7	170.5	-71.8	-67.5	-71.3	0	0	111	L488 L490 I522 Q524 I549 D1048 S1049 Y1055	L488-M1051 HydrophobicContact CB-CE 3.9Å; L488-M1051 HydrophobicContact CD2-CE 4.26Å; L488-M1051 HydrophobicContact CG-CE 4.1Å; L490-M1051 HydrophobicContact CD2-CE 4.17Å; L490-M1051 HydrophobicContact CD2-CG 4.31Å; I522-M1051 HydrophobicContact CB-CE 4.39Å; I522-M1051 HydrophobicContact CG2-CE 3.96Å; I522-M1051 HydrophobicContact CG2-SD 3.86Å; Q524-M1051 HydrophobicContact CG-CE 4.41Å; Q524-M1051 HydrophobicContact CG-CG 4.08Å; Q524-M1051 HydrophobicContact CG-SD 3.55Å; Q524-M1051 VanDerWaalsContact CG-SD 3.55Å; I549-M1051 HydrophobicContact CD1-CG 4.48Å; I549-M1051 HydrophobicContact CD1-SD 3.78Å; D1048-M1051 WeakPolarHBondContact O-CB 3.47Å; D1048-M1051 PolarHBondContact O-N 2.79Å; S1049-M1051 PolarHBondContact O-N 2.82Å; M1051-Y1055 PolarHBondContact O-N 3.45Å
1052	S	90.4	Very high	89.1	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.007	9%	0.094	C	C	.	.	H	α-helix	trans	-69.7	-44.8	178.3	77.4	0	0	0	0	111.6	R433 S1049 L1050 T1054 Y1055 F1056	R433-S1052 PolarHBondContact NH2-OG 2.75Å; S1049-S1052 PolarHBondContact O-N 2.93Å; S1049-S1052 PolarHBondContact O-OG 3.41Å; L1050-S1052 VanDerWaalsContact C-N 3.35Å; S1052-T1054 VanDerWaalsContact C-N 3.31Å; S1052-T1054 PolarHBondContact O-N 2.91Å; S1052-Y1055 PolarHBondContact O-N 3.03Å; S1052-F1056 VanDerWaalsContact O-CD2 3.25Å; S1052-F1056 WeakPolarHBondContact O-CD2 3.36Å; S1052-F1056 PolarHBondContact O-N 3.3Å; S1052-F1056 VanDerWaalsContact O-N 3.13Å
1053	A	90	Very high	88.8	Confident	11 Å²	11	17.4 Å²	17.4	9%	0.091	10%	0.096	C	C	.	.	H	α-helix	trans	-61.9	-38.7	179.4	0	0	0	0	0	112.2	F576 S1049 L1050 N1057	F576-A1053 HydrophobicContact CB-CB 4.22Å; S1049-A1053 PolarHBondContact O-N 3.29Å; S1049-A1053 VanDerWaalsContact O-N 3.14Å; L1050-A1053 HydrophobicContact CD1-CB 4.39Å; A1053-N1057 PolarHBondContact O-N 3.32Å
1054	T	91.9	Very high	88.8	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-69.1	-37.8	177	-55.5	0	0	0	0	112	R520 I522 D547 I549 L1050 S1052 N1057 D1058 L1061	R520-T1054 PolarHBondContact NH1-O 3.34Å; R520-T1054 PolarHBondContact NH2-O 3.42Å; I522-T1054 HydrophobicContact CD1-CG2 4.22Å; I522-T1054 HydrophobicContact CG2-CG2 4.28Å; D547-T1054 HydrophobicContact CB-CG2 3.75Å; D547-T1054 VanDerWaalsContact OD2-CG2 3.32Å; D547-T1054 WeakPolarHBondContact OD2-CG2 3.19Å; I549-T1054 HydrophobicContact CD1-CG2 4.45Å; L1050-T1054 VanDerWaalsContact O-CB 3.23Å; L1050-T1054 WeakPolarHBondContact O-CB 3.39Å; L1050-T1054 PolarHBondContact O-N 3.5Å; L1050-T1054 PolarHBondContact O-OG1 3.3Å; S1052-T1054 VanDerWaalsContact C-N 3.31Å; S1052-T1054 PolarHBondContact O-N 2.91Å; T1054-N1057 CarbonylContact O-C 3.55Å; T1054-D1058 PolarHBondContact O-N 3.13Å; T1054-L1061 HydrophobicContact CG2-CB 4.07Å; T1054-L1061 HydrophobicContact CG2-CD2 4.17Å
1055	Y	92.1	Very high	88.9	Confident	17 Å²	17	18.2 Å²	18.2	7%	0.067	10%	0.097	C	C	.	.	H	α-helix	trans	-61.7	-46.3	174.1	170.4	-104.1	0	0	0	112.4	I410 F428 D485 A486 L488 R520 M1051 S1052	I410-Y1055 HydrophobicContact CG2-CD2 4.21Å; I410-Y1055 HydrophobicContact CG2-CE1 4.42Å; I410-Y1055 HydrophobicContact CG2-CE2 3.52Å; F428-Y1055 AromaticContact CE2-CD1 3.43Å; F428-Y1055 HydrophobicContact CE2-CD1 3.43Å; F428-Y1055 VanDerWaalsContact CE2-CD1 3.43Å; F428-Y1055 AromaticContact CE2-CE1 3.79Å; F428-Y1055 HydrophobicContact CE2-CE1 3.79Å; F428-Y1055 HydrophobicContact CE2-CG 4.14Å; F428-Y1055 AromaticContact CZ-CD1 3.8Å; F428-Y1055 HydrophobicContact CZ-CD1 3.8Å; F428-Y1055 AromaticContact CZ-CE1 3.63Å; F428-Y1055 HydrophobicContact CZ-CE1 3.63Å; D485-Y1055 PolarHBondContact OD2-OH 2.92Å; A486-Y1055 HydrophobicContact CB-CD2 3.8Å; A486-Y1055 HydrophobicContact CB-CE2 3.77Å; L488-Y1055 HydrophobicContact CD1-CD2 4.39Å; R520-Y1055 PolarHBondContact NH1-O 2.93Å; M1051-Y1055 PolarHBondContact O-N 3.45Å; S1052-Y1055 PolarHBondContact O-N 3.03Å
1056	F	88.4	Confident	89.1	Confident	50 Å²	50	19.7 Å²	19.7	22%	0.219	11%	0.106	C	C	.	.	H	α-helix	trans	-76.7	-26.9	-180	-70.8	-70.3	0	0	0	113.7	F428 V436 S1052	F428-F1056 HydrophobicContact CD1-CZ 4.49Å; F428-F1056 AromaticContact CD2-CE2 3.97Å; F428-F1056 HydrophobicContact CD2-CE2 3.97Å; F428-F1056 HydrophobicContact CD2-CZ 4.46Å; F428-F1056 HydrophobicContact CE1-CZ 4.13Å; F428-F1056 AromaticContact CE2-CE2 3.91Å; F428-F1056 HydrophobicContact CE2-CE2 3.91Å; F428-F1056 HydrophobicContact CE2-CZ 4.09Å; F428-F1056 HydrophobicContact CG-CE2 4.32Å; F428-F1056 HydrophobicContact CZ-CE2 4.21Å; F428-F1056 AromaticContact CZ-CZ 3.92Å; F428-F1056 HydrophobicContact CZ-CZ 3.92Å; V436-F1056 HydrophobicContact CB-CE1 4.14Å; V436-F1056 HydrophobicContact CG1-CE1 4.46Å; V436-F1056 HydrophobicContact CG2-CD1 4.39Å; V436-F1056 HydrophobicContact CG2-CE1 3.76Å; S1052-F1056 VanDerWaalsContact O-CD2 3.25Å; S1052-F1056 WeakPolarHBondContact O-CD2 3.36Å; S1052-F1056 PolarHBondContact O-N 3.3Å; S1052-F1056 VanDerWaalsContact O-N 3.13Å
1057	N	86.6	Confident	89.2	Confident	46 Å²	46	20.5 Å²	20.5	25%	0.246	11%	0.11	C	C	.	.			trans	-146.7	95.9	177.2	-72.4	-88.2	0	0	0	112.5	T603 A1053 T1054 N1059 I1060	T603-N1057 PolarHBondContact OG1-OD1 3.2Å; T603-N1057 VanDerWaalsContact OG1-OD1 3.14Å; A1053-N1057 PolarHBondContact O-N 3.32Å; T1054-N1057 CarbonylContact O-C 3.55Å; N1057-N1059 PolarHBondContact O-N 3.43Å; N1057-I1060 HydrophobicContact CB-CB 4.45Å; N1057-I1060 HydrophobicContact CB-CD1 4.42Å; N1057-I1060 HydrophobicContact CB-CG1 3.45Å; N1057-I1060 VanDerWaalsContact CB-CG1 3.45Å; N1057-I1060 WeakPolarHBondContact O-CB 3.36Å; N1057-I1060 WeakPolarHBondContact O-CG1 3.3Å; N1057-I1060 PolarHBondContact O-N 3.08Å
1058	D	83.4	Confident	89.3	Confident	67 Å²	67	20.5 Å²	20.5	36%	0.358	11%	0.11	S	C	.	.	H	α-helix	trans	-51.4	-32.8	-179.2	-27.7	-16.3	0	0	0	113.2	R520 T1054 I1060	R520-D1058 IonicContact CZ-OD1 3.25Å; R520-D1058 IonicContact NH1-OD1 2.88Å; R520-D1058 PolarHBondContact NH1-OD1 2.95Å; R520-D1058 IonicContact NH2-OD1 2.71Å; R520-D1058 PolarHBondContact NH2-OD1 3.23Å; T1054-D1058 PolarHBondContact O-N 3.13Å; D1058-I1060 VanDerWaalsContact C-N 3.3Å; D1058-I1060 PolarHBondContact O-N 3.21Å
1059	N	87.3	Confident	89.4	Confident	41 Å²	41	20.5 Å²	20.5	22%	0.219	11%	0.11	C	C	.	.	H	α-helix	trans	-75.4	-15.1	-176.7	-55.5	-87.1	0	0	0	113.5	T603 F665 N1057 T1062 L1063	T603-N1059 HydrophobicContact CG2-CB 4.46Å; F665-N1059 HydrophobicContact CE1-CB 3.6Å; F665-N1059 HydrophobicContact CZ-CB 3.76Å; N1057-N1059 PolarHBondContact O-N 3.43Å; N1059-T1062 PolarHBondContact O-N 3.09Å; N1059-L1063 PolarHBondContact O-N 3.35Å
1060	I	88.5	Confident	88.9	Confident	4 Å²	4	20.5 Å²	20.5	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-67.5	-49.4	-177.6	-65.5	-66.9	0	0	0	110.7	M601 T603 L1050 N1057 D1058 T1062 L1063 I1064	M601-I1060 HydrophobicContact CB-CD1 3.89Å; M601-I1060 HydrophobicContact CG-CD1 3.56Å; M601-I1060 WeakPolarHBondContact O-CD1 3.39Å; M601-I1060 HydrophobicContact SD-CD1 3.66Å; M601-I1060 HydrophobicContact SD-CG2 4.31Å; T603-I1060 HydrophobicContact CG2-CD1 4.11Å; L1050-I1060 HydrophobicContact CD1-CG2 4.4Å; N1057-I1060 HydrophobicContact CB-CB 4.45Å; N1057-I1060 HydrophobicContact CB-CD1 4.42Å; N1057-I1060 HydrophobicContact CB-CG1 3.45Å; N1057-I1060 VanDerWaalsContact CB-CG1 3.45Å; N1057-I1060 WeakPolarHBondContact O-CB 3.36Å; N1057-I1060 WeakPolarHBondContact O-CG1 3.3Å; N1057-I1060 PolarHBondContact O-N 3.08Å; D1058-I1060 VanDerWaalsContact C-N 3.3Å; D1058-I1060 PolarHBondContact O-N 3.21Å; I1060-T1062 VanDerWaalsContact C-N 3.26Å; I1060-T1062 PolarHBondContact O-N 3.25Å; I1060-L1063 PolarHBondContact O-N 2.94Å; I1060-I1064 HydrophobicContact CG2-CD1 3.62Å; I1060-I1064 HydrophobicContact CG2-CG1 4.32Å; I1060-I1064 WeakPolarHBondContact O-CB 3.28Å; I1060-I1064 WeakPolarHBondContact O-CG1 3.37Å; I1060-I1064 PolarHBondContact O-N 3.24Å
1061	L	90.3	Very high	88	Confident	5 Å²	5	20.6 Å²	20.6	3%	0.026	11%	0.112	C	C	.	.	H	α-helix	trans	-57	-43.1	174.7	-178.3	63.7	0	0	0	110.9	D547 I549 L554 L1050 T1054 L1063 I1064 R1065	D547-L1061 HydrophobicContact CB-CD2 3.87Å; I549-L1061 HydrophobicContact CG1-CD1 4.04Å; I549-L1061 HydrophobicContact CG1-CD2 3.72Å; L554-L1061 HydrophobicContact CD1-CD1 4.26Å; L1050-L1061 HydrophobicContact CD2-CD1 3.96Å; T1054-L1061 HydrophobicContact CG2-CB 4.07Å; T1054-L1061 HydrophobicContact CG2-CD2 4.17Å; L1061-L1063 PolarHBondContact O-N 2.92Å; L1061-I1064 PolarHBondContact O-N 3.3Å; L1061-R1065 HydrophobicContact CD1-CG 4.04Å; L1061-R1065 HydrophobicContact CG-CG 4.3Å; L1061-R1065 VanDerWaalsContact O-CB 3.27Å; L1061-R1065 WeakPolarHBondContact O-CB 3.4Å; L1061-R1065 WeakPolarHBondContact O-CG 3.41Å; L1061-R1065 PolarHBondContact O-N 3.22Å
1062	T	87.8	Confident	87.3	Confident	65 Å²	65	21 Å²	21	40%	0.399	12%	0.115	S	C	.	.	H	α-helix	trans	-65.3	-39.9	179.3	-56.3	0	0	0	0	112.3	I648 N1059 I1060 T1066	I648-T1062 HydrophobicContact CD1-CG2 3.65Å; I648-T1062 HydrophobicContact CG1-CG2 4.42Å; N1059-T1062 PolarHBondContact O-N 3.09Å; I1060-T1062 VanDerWaalsContact C-N 3.26Å; I1060-T1062 PolarHBondContact O-N 3.25Å; T1062-T1066 WeakPolarHBondContact O-CB 3.43Å; T1062-T1066 PolarHBondContact O-N 3.37Å; T1062-T1066 PolarHBondContact O-OG1 3.13Å
1063	L	90.1	Very high	86.8	Confident	6 Å²	6	22.6 Å²	22.6	3%	0.031	13%	0.125	C	C	.	.	H	α-helix	trans	-66.9	-50.4	175	170.8	56.3	0	0	0	111.5	M601 A632 I648 I650 F665 N1059 I1060 L1061 R1065 T1066 L1067	M601-L1063 HydrophobicContact CG-CD2 4.47Å; M601-L1063 HydrophobicContact SD-CD2 3.54Å; M601-L1063 VanDerWaalsContact SD-CD2 3.54Å; M601-L1063 HydrophobicContact SD-CG 4.16Å; A632-L1063 HydrophobicContact CB-CD1 3.92Å; A632-L1063 HydrophobicContact CB-CD2 4.46Å; I648-L1063 HydrophobicContact CD1-CB 4.12Å; I648-L1063 HydrophobicContact CG2-CD1 3.94Å; I650-L1063 HydrophobicContact CD1-CD1 3.82Å; I650-L1063 HydrophobicContact CG1-CD1 3.68Å; F665-L1063 HydrophobicContact CB-CD2 3.77Å; F665-L1063 HydrophobicContact CD1-CB 4.24Å; F665-L1063 HydrophobicContact CD1-CD2 3.35Å; F665-L1063 HydrophobicContact CD1-CG 4.39Å; F665-L1063 HydrophobicContact CE1-CB 4.08Å; F665-L1063 HydrophobicContact CE1-CD2 4.06Å; F665-L1063 HydrophobicContact CG-CD2 3.7Å; N1059-L1063 PolarHBondContact O-N 3.35Å; I1060-L1063 PolarHBondContact O-N 2.94Å; L1061-L1063 PolarHBondContact O-N 2.92Å; L1063-R1065 PolarHBondContact O-N 3.47Å; L1063-T1066 WeakPolarHBondContact O-CB 3.42Å; L1063-T1066 PolarHBondContact O-N 2.73Å; L1063-T1066 VanDerWaalsContact O-N 3.11Å; L1063-L1067 PolarHBondContact O-N 2.97Å
1064	I	90.8	Very high	86.3	Confident	2 Å²	2	25.1 Å²	25.1	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-57	-50.6	178.6	-70.5	172.6	0	0	0	109.8	L554 F558 F576 M601 L1050 I1060 L1061 T1066 L1067 V1068	L554-I1064 HydrophobicContact CD2-CG2 4.09Å; F558-I1064 HydrophobicContact CE1-CG2 4.22Å; F558-I1064 HydrophobicContact CZ-CG2 3.71Å; F576-I1064 HydrophobicContact CB-CD1 4.5Å; F576-I1064 HydrophobicContact CD1-CD1 3.63Å; F576-I1064 HydrophobicContact CE1-CD1 4.16Å; F576-I1064 HydrophobicContact CG-CD1 4.28Å; M601-I1064 HydrophobicContact CE-CD1 4.29Å; M601-I1064 HydrophobicContact CE-CG1 3.97Å; M601-I1064 HydrophobicContact SD-CG1 4.39Å; L1050-I1064 HydrophobicContact CD1-CD1 3.78Å; I1060-I1064 HydrophobicContact CG2-CD1 3.62Å; I1060-I1064 HydrophobicContact CG2-CG1 4.32Å; I1060-I1064 WeakPolarHBondContact O-CB 3.28Å; I1060-I1064 WeakPolarHBondContact O-CG1 3.37Å; I1060-I1064 PolarHBondContact O-N 3.24Å; L1061-I1064 PolarHBondContact O-N 3.3Å; I1064-T1066 VanDerWaalsContact C-N 3.32Å; I1064-T1066 PolarHBondContact O-N 3.12Å; I1064-L1067 PolarHBondContact O-N 3.29Å; I1064-V1068 HydrophobicContact CG2-CG2 3.94Å; I1064-V1068 WeakPolarHBondContact O-CB 3.49Å; I1064-V1068 VanDerWaalsContact O-CG2 3.22Å; I1064-V1068 WeakPolarHBondContact O-CG2 3.03Å; I1064-V1068 PolarHBondContact O-N 3.33Å
1065	R	89.7	Confident	85.7	Confident	31 Å²	31	28.2 Å²	28.2	12%	0.117	16%	0.155	C	C	.	.	H	α-helix	trans	-56.8	-43.9	175.6	-71.5	-177	70.1	-139.2	-12.8	112	E553 L554 L1061 L1063 L1067 V1068 T1069 E1077	E553-R1065 IonicContact OE1-CZ 2.81Å; E553-R1065 IonicContact OE1-NE 2.77Å; E553-R1065 PolarHBondContact OE1-NE 3.15Å; E553-R1065 IonicContact OE1-NH2 3.84Å; E553-R1065 PolarHBondContact OE1-NH2 3.22Å; E553-R1065 IonicContact OE2-CZ 3.67Å; E553-R1065 IonicContact OE2-NE 2.68Å; E553-R1065 IonicContact OE2-NH2 2.59Å; L554-R1065 HydrophobicContact CD2-CG 4.15Å; L1061-R1065 HydrophobicContact CD1-CG 4.04Å; L1061-R1065 HydrophobicContact CG-CG 4.3Å; L1061-R1065 VanDerWaalsContact O-CB 3.27Å; L1061-R1065 WeakPolarHBondContact O-CB 3.4Å; L1061-R1065 WeakPolarHBondContact O-CG 3.41Å; L1061-R1065 PolarHBondContact O-N 3.22Å; L1063-R1065 PolarHBondContact O-N 3.47Å; R1065-L1067 PolarHBondContact O-N 3.28Å; R1065-V1068 PolarHBondContact O-N 3.32Å; R1065-T1069 WeakPolarHBondContact O-CB 3.42Å; R1065-T1069 WeakPolarHBondContact O-CG2 3.44Å; R1065-T1069 PolarHBondContact O-N 3.31Å; R1065-T1069 PolarHBondContact O-OG1 3.17Å; R1065-E1077 IonicContact CZ-OE1 2.86Å; R1065-E1077 IonicContact CZ-OE2 3.46Å; R1065-E1077 IonicContact NH1-OE1 2.63Å; R1065-E1077 PolarHBondContact NH1-OE1 3.12Å; R1065-E1077 IonicContact NH1-OE2 2.74Å; R1065-E1077 PolarHBondContact NH1-OE2 3.18Å; R1065-E1077 IonicContact NH2-OE1 3.42Å; R1065-E1077 PolarHBondContact NH2-OE1 2.83Å; R1065-E1077 IonicContact NH2-OE2 2.67Å; R1065-E1077 PolarHBondContact NH2-OE2 3.28Å
1066	T	89.1	Confident	85.4	Confident	41 Å²	41	27.6 Å²	27.6	25%	0.252	15%	0.153	S	C	.	.	H	α-helix	trans	-62	-41.8	179	-58.1	0	0	0	0	112.2	I650 T1062 L1063 I1064 G1071	I650-T1066 HydrophobicContact CD1-CG2 3.87Å; T1062-T1066 WeakPolarHBondContact O-CB 3.43Å; T1062-T1066 PolarHBondContact O-N 3.37Å; T1062-T1066 PolarHBondContact O-OG1 3.13Å; L1063-T1066 WeakPolarHBondContact O-CB 3.42Å; L1063-T1066 PolarHBondContact O-N 2.73Å; L1063-T1066 VanDerWaalsContact O-N 3.11Å; I1064-T1066 VanDerWaalsContact C-N 3.32Å; I1064-T1066 PolarHBondContact O-N 3.12Å; T1066-G1071 PolarHBondContact O-N 2.8Å
1067	L	89.9	Confident	85.1	Confident	27 Å²	27	26 Å²	26	14%	0.141	15%	0.146	C	C	.	.	H	α-helix	trans	-69.5	-50	177.6	-179.7	62.5	0	0	0	111.7	L572 I650 L1063 I1064 R1065 V1104 L1179	L572-L1067 HydrophobicContact CD1-CD2 3.96Å; L572-L1067 HydrophobicContact CD2-CD2 3.81Å; I650-L1067 HydrophobicContact CD1-CB 3.8Å; I650-L1067 HydrophobicContact CD1-CD1 4.18Å; L1063-L1067 PolarHBondContact O-N 2.97Å; I1064-L1067 PolarHBondContact O-N 3.29Å; R1065-L1067 PolarHBondContact O-N 3.28Å; L1067-V1104 HydrophobicContact CD1-CG2 3.83Å; L1067-L1179 HydrophobicContact CD1-CD2 4.18Å
1068	V	92.1	Very high	84.8	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-79.5	-42.7	-166.4	172.7	0	0	0	0	112.6	G557 F558 Q561 L572 I1064 R1065 G1070	G557-V1068 VanDerWaalsContact CA-CG1 3.49Å; F558-V1068 HydrophobicContact CD1-CG1 4.29Å; F558-V1068 HydrophobicContact CD1-CG2 3.87Å; F558-V1068 HydrophobicContact CE1-CG2 3.55Å; F558-V1068 HydrophobicContact CG-CG1 4.43Å; F558-V1068 HydrophobicContact CZ-CG2 4.2Å; Q561-V1068 PolarHBondContact NE2-O 3.48Å; L572-V1068 HydrophobicContact CD1-CG2 3.89Å; I1064-V1068 HydrophobicContact CG2-CG2 3.94Å; I1064-V1068 WeakPolarHBondContact O-CB 3.49Å; I1064-V1068 VanDerWaalsContact O-CG2 3.22Å; I1064-V1068 WeakPolarHBondContact O-CG2 3.03Å; I1064-V1068 PolarHBondContact O-N 3.33Å; R1065-V1068 PolarHBondContact O-N 3.32Å; V1068-G1070 PolarHBondContact O-N 3.45Å
1069	T	87.8	Confident	84.8	Confident	9 Å²	9	25.2 Å²	25.2	6%	0.055	15%	0.149	C	C	.	.	S	Bend	trans	-75.9	-5.4	-179	63.5	0	0	0	0	113.7	E553 R1065 G1071 A1072	E553-T1069 HydrophobicContact CG-CG2 4.06Å; E553-T1069 WeakPolarHBondContact OE1-CG2 3.33Å; R1065-T1069 WeakPolarHBondContact O-CB 3.42Å; R1065-T1069 WeakPolarHBondContact O-CG2 3.44Å; R1065-T1069 PolarHBondContact O-N 3.31Å; R1065-T1069 PolarHBondContact O-OG1 3.17Å; T1069-G1071 VanDerWaalsContact C-N 3.27Å; T1069-G1071 PolarHBondContact OG1-N 2.96Å; T1069-A1072 HydrophobicContact CG2-CB 4.15Å; T1069-A1072 VanDerWaalsContact OG1-CB 3.3Å; T1069-A1072 WeakPolarHBondContact OG1-CB 3.05Å; T1069-A1072 PolarHBondContact OG1-N 3.44Å
1070	G	78.3	Confident	84.6	Confident	6 Å²	6	23.7 Å²	23.7	6%	0.062	14%	0.141	C	C	.	.	S	Bend	trans	71.1	23.1	-167.5	0	0	0	0	0	113.2	V1068 R1101	V1068-G1070 PolarHBondContact O-N 3.45Å; G1070-R1101 PolarHBondContact O-NH1 2.85Å; G1070-R1101 PolarHBondContact O-NH2 3.19Å
1071	G	72.4	Confident	84	Confident	2 Å²	2	25.2 Å²	25.2	2%	0.021	15%	0.154	C	C	.	.			trans	99.5	40.6	171.4	0	0	0	0	0	116	M818 T1066 T1069 T1073	M818-G1071 WeakPolarHBondContact CE-O 3.3Å; T1066-G1071 PolarHBondContact O-N 2.8Å; T1069-G1071 VanDerWaalsContact C-N 3.27Å; T1069-G1071 PolarHBondContact OG1-N 2.96Å; G1071-T1073 PolarHBondContact O-N 3.31Å; G1071-T1073 VanDerWaalsContact O-N 3.07Å
1072	A	75.9	Confident	83.4	Confident	10 Å²	10	31.3 Å²	31.3	8%	0.083	18%	0.182	C	C	.	.			trans	-59.2	111.3	167.7	0	0	0	0	0	110.2	T1069	T1069-A1072 HydrophobicContact CG2-CB 4.15Å; T1069-A1072 VanDerWaalsContact OG1-CB 3.3Å; T1069-A1072 WeakPolarHBondContact OG1-CB 3.05Å; T1069-A1072 PolarHBondContact OG1-N 3.44Å
1073	T	81.1	Confident	82.6	Confident	34 Å²	34	33 Å²	33	21%	0.209	19%	0.185	C	C	.	.			trans	-95.1	156.1	177.3	62.8	0	0	0	0	110.6	M818 G1071 E1075 L1076 E1077	M818-T1073 HydrophobicContact CE-CG2 4.2Å; G1071-T1073 PolarHBondContact O-N 3.31Å; G1071-T1073 VanDerWaalsContact O-N 3.07Å; T1073-E1075 PolarHBondContact O-N 3.23Å; T1073-E1075 VanDerWaalsContact O-N 3.07Å; T1073-L1076 WeakPolarHBondContact O-CA 3.31Å; T1073-L1076 WeakPolarHBondContact O-CB 3.46Å; T1073-L1076 PolarHBondContact O-N 2.97Å; T1073-L1076 PolarHBondContact OG1-N 3.38Å; T1073-E1077 PolarHBondContact O-N 3.15Å
1074	P	79.6	Confident	82.1	Confident	65 Å²	65	35.8 Å²	35.8	42%	0.422	20%	0.2	S	C	.	.	H	α-helix	trans	-58.4	-21.9	170.4	-25.9	35.4	0	0	0	113.5	L1076 A1078	P1074-L1076 VanDerWaalsContact C-N 3.35Å; P1074-A1078 WeakPolarHBondContact O-CB 3.28Å; P1074-A1078 PolarHBondContact O-N 3.15Å; P1074-A1078 VanDerWaalsContact O-N 3.11Å
1075	E	79.3	Confident	81.7	Confident	65 Å²	65	37.6 Å²	37.6	30%	0.304	22%	0.215	S	C	.	.	H	α-helix	trans	-69.3	-34	173.7	-51.4	177.6	-150.4	0	0	111	R645 R647 T1073 L1079	R645-E1075 IonicContact CZ-OE1 3.38Å; R645-E1075 IonicContact CZ-OE2 3.5Å; R645-E1075 IonicContact NE-OE1 2.69Å; R645-E1075 IonicContact NH1-OE1 3.83Å; R645-E1075 PolarHBondContact NH1-OE1 2.89Å; R645-E1075 IonicContact NH1-OE2 2.73Å; R645-E1075 PolarHBondContact NH1-OE2 3.28Å; R647-E1075 IonicContact CZ-OE1 3.64Å; R647-E1075 IonicContact NH2-OE1 3.78Å; R647-E1075 PolarHBondContact NH2-OE1 2.9Å; R647-E1075 IonicContact NH2-OE2 3.38Å; T1073-E1075 PolarHBondContact O-N 3.23Å; T1073-E1075 VanDerWaalsContact O-N 3.07Å; E1075-L1079 WeakPolarHBondContact O-CG 3.47Å
1076	L	84.3	Confident	81.5	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-79.8	-39.7	171.5	-178.9	62.5	0	0	0	112.1	T816 F819 M866 T1073 P1074 A1078 L1079 I1080 L1086	T816-L1076 HydrophobicContact CG2-CB 4.24Å; T816-L1076 HydrophobicContact CG2-CD1 4.16Å; F819-L1076 HydrophobicContact CD2-CD2 3.9Å; F819-L1076 HydrophobicContact CE2-CD2 3.51Å; M866-L1076 HydrophobicContact SD-CD2 4.45Å; T1073-L1076 WeakPolarHBondContact O-CA 3.31Å; T1073-L1076 WeakPolarHBondContact O-CB 3.46Å; T1073-L1076 PolarHBondContact O-N 2.97Å; T1073-L1076 PolarHBondContact OG1-N 3.38Å; P1074-L1076 VanDerWaalsContact C-N 3.35Å; L1076-A1078 VanDerWaalsContact C-N 3.28Å; L1076-A1078 PolarHBondContact O-N 2.86Å; L1076-L1079 PolarHBondContact O-N 3.49Å; L1076-L1079 VanDerWaalsContact O-N 3.15Å; L1076-I1080 HydrophobicContact CD1-CD1 4.15Å; L1076-I1080 HydrophobicContact CD1-CG1 4.3Å; L1076-I1080 HydrophobicContact CD2-CD1 4.45Å; L1076-I1080 HydrophobicContact CG-CD1 3.83Å; L1076-I1080 HydrophobicContact CG-CG1 4.41Å; L1076-I1080 VanDerWaalsContact O-CG1 3.31Å; L1076-I1080 WeakPolarHBondContact O-CG1 3.45Å; L1076-I1080 PolarHBondContact O-N 3.11Å; L1076-L1086 HydrophobicContact CD1-CD2 4.23Å
1077	E	82.8	Confident	81.4	Confident	18 Å²	18	39.5 Å²	39.5	8%	0.084	22%	0.219	C	C	.	.	H	α-helix	trans	-58.6	-40	176.8	-64	-170.2	105.6	0	0	111.6	K531 L535 R1065 T1073 I1080 A1081	K531-E1077 IonicContact NZ-OE1 2.95Å; K531-E1077 PolarHBondContact NZ-OE1 2.87Å; L535-E1077 HydrophobicContact CD1-CB 4.23Å; R1065-E1077 IonicContact CZ-OE1 2.86Å; R1065-E1077 IonicContact CZ-OE2 3.46Å; R1065-E1077 IonicContact NH1-OE1 2.63Å; R1065-E1077 PolarHBondContact NH1-OE1 3.12Å; R1065-E1077 IonicContact NH1-OE2 2.74Å; R1065-E1077 PolarHBondContact NH1-OE2 3.18Å; R1065-E1077 IonicContact NH2-OE1 3.42Å; R1065-E1077 PolarHBondContact NH2-OE1 2.83Å; R1065-E1077 IonicContact NH2-OE2 2.67Å; R1065-E1077 PolarHBondContact NH2-OE2 3.28Å; T1073-E1077 PolarHBondContact O-N 3.15Å; E1077-I1080 PolarHBondContact O-N 3.45Å; E1077-A1081 PolarHBondContact O-N 3.29Å
1078	A	79.8	Confident	81.1	Confident	51 Å²	51	38.7 Å²	38.7	42%	0.421	22%	0.217	S	C	.	.	H	α-helix	trans	-63.3	-42.3	174.2	0	0	0	0	0	113.2	P1074 L1076 I1080 A1081 E1082	P1074-A1078 WeakPolarHBondContact O-CB 3.28Å; P1074-A1078 PolarHBondContact O-N 3.15Å; P1074-A1078 VanDerWaalsContact O-N 3.11Å; L1076-A1078 VanDerWaalsContact C-N 3.28Å; L1076-A1078 PolarHBondContact O-N 2.86Å; A1078-I1080 VanDerWaalsContact C-N 3.27Å; A1078-I1080 PolarHBondContact O-N 3.25Å; A1078-A1081 WeakPolarHBondContact O-CB 3.47Å; A1078-A1081 PolarHBondContact O-N 3.26Å; A1078-E1082 PolarHBondContact O-N 3.18Å
1079	L	83.4	Confident	80.8	Confident	45 Å²	45	39.2 Å²	39.2	24%	0.236	22%	0.222	C	C	.	.	H	α-helix	trans	-64.1	-33.3	175.8	-74.5	165.8	0	0	0	112.3	S815 T816 E1075 L1076	S815-L1079 WeakPolarHBondContact OG-CD1 3.01Å; T816-L1079 HydrophobicContact CG2-CD1 3.71Å; E1075-L1079 WeakPolarHBondContact O-CG 3.47Å; L1076-L1079 PolarHBondContact O-N 3.49Å; L1076-L1079 VanDerWaalsContact O-N 3.15Å
1080	I	82.8	Confident	80.7	Confident	9 Å²	9	45.2 Å²	45.2	5%	0.046	25%	0.245	C	C	.	.	H	α-helix	trans	-75.2	-33.5	175.7	-61.9	168.3	0	0	0	110.5	Y528 L1076 E1077 A1078 E1082 N1084	Y528-I1080 HydrophobicContact CE1-CD1 4.14Å; Y528-I1080 HydrophobicContact CE1-CG2 4.16Å; L1076-I1080 HydrophobicContact CD1-CD1 4.15Å; L1076-I1080 HydrophobicContact CD1-CG1 4.3Å; L1076-I1080 HydrophobicContact CD2-CD1 4.45Å; L1076-I1080 HydrophobicContact CG-CD1 3.83Å; L1076-I1080 HydrophobicContact CG-CG1 4.41Å; L1076-I1080 VanDerWaalsContact O-CG1 3.31Å; L1076-I1080 WeakPolarHBondContact O-CG1 3.45Å; L1076-I1080 PolarHBondContact O-N 3.11Å; E1077-I1080 PolarHBondContact O-N 3.45Å; A1078-I1080 VanDerWaalsContact C-N 3.27Å; A1078-I1080 PolarHBondContact O-N 3.25Å; I1080-E1082 VanDerWaalsContact C-N 3.26Å; I1080-E1082 PolarHBondContact O-N 2.92Å; I1080-N1084 WeakPolarHBondContact O-CA 3.49Å; I1080-N1084 PolarHBondContact O-N 3.02Å
1081	A	77.6	Confident	81.1	Confident	35 Å²	35	47 Å²	47	29%	0.289	26%	0.256	S	S	.	.	H	α-helix	trans	-65	-26.2	174.3	0	0	0	0	0	113.6	A532 E1077 A1078	A532-A1081 HydrophobicContact CB-CB 3.82Å; E1077-A1081 PolarHBondContact O-N 3.29Å; A1078-A1081 WeakPolarHBondContact O-CB 3.47Å; A1078-A1081 PolarHBondContact O-N 3.26Å
1082	E	77.6	Confident	81.8	Confident	133 Å²	133	49.8 Å²	49.8	62%	0.621	27%	0.273	S	S	*	.	H	α-helix	trans	-75.5	-40.6	176.4	-72.8	-177.1	-179.9	0	0	114.2	A1078 I1080 R1087	A1078-E1082 PolarHBondContact O-N 3.18Å; I1080-E1082 VanDerWaalsContact C-N 3.26Å; I1080-E1082 PolarHBondContact O-N 2.92Å; E1082-R1087 IonicContact OE2-CZ 3.66Å; E1082-R1087 IonicContact OE2-NH1 3.79Å; E1082-R1087 PolarHBondContact OE2-NH1 3.03Å; E1082-R1087 IonicContact OE2-NH2 3.54Å
1083	E	70	Confident	82.3	Confident	100 Å²	100	54.8 Å²	54.8	47%	0.467	31%	0.305	S	S	.	.	H	α-helix	trans	-133.6	-3.5	-168.3	-73.1	-165.3	161.2	0	0	115.4	A1085 R1087	E1083-A1085 PolarHBondContact O-N 3.14Å; E1083-R1087 IonicContact OE1-CZ 2.74Å; E1083-R1087 IonicContact OE1-NE 2.78Å; E1083-R1087 PolarHBondContact OE1-NE 3.28Å; E1083-R1087 IonicContact OE1-NH2 2.64Å; E1083-R1087 PolarHBondContact OE1-NH2 2.73Å; E1083-R1087 WeakPolarHBondContact OE2-CG 3.27Å; E1083-R1087 IonicContact OE2-CZ 2.68Å; E1083-R1087 IonicContact OE2-NE 3.18Å; E1083-R1087 PolarHBondContact OE2-NE 3.08Å; E1083-R1087 IonicContact OE2-NH2 3.33Å
1084	N	80.4	Confident	82.3	Confident	66 Å²	66	60.7 Å²	60.7	35%	0.353	33%	0.33	S	S	.	.	S	Bend	trans	55.8	-5.3	-165.8	-156.9	9.7	0	0	0	115.6	R862 I1080	R862-N1084 VanDerWaalsContact CZ-O 3.24Å; R862-N1084 PolarHBondContact NH1-O 3.37Å; R862-N1084 PolarHBondContact NH1-OD1 3.13Å; R862-N1084 VanDerWaalsContact NH1-OD1 3.1Å; R862-N1084 PolarHBondContact NH2-O 3.08Å; R862-N1084 VanDerWaalsContact NH2-O 3.08Å; I1080-N1084 WeakPolarHBondContact O-CA 3.49Å; I1080-N1084 PolarHBondContact O-N 3.02Å
1085	A	82.4	Confident	82.5	Confident	39 Å²	39	58.3 Å²	58.3	32%	0.322	31%	0.314	S	S	.	.	S	Bend	trans	-108.8	162.5	-174.3	0	0	0	0	0	114.2	E1083	E1083-A1085 PolarHBondContact O-N 3.14Å
1086	L	84.9	Confident	82.9	Confident	15 Å²	15	58.2 Å²	58.2	8%	0.079	32%	0.316	C	S	.	.			trans	-91.5	107.3	168.5	-84.4	115.5	0	0	0	110.9	D814 F819 W821 M866 F900 L1076	D814-L1086 HydrophobicContact CB-CD2 4Å; F819-L1086 HydrophobicContact CD2-CD2 4.41Å; W821-L1086 PolarHBondContact NE1-O 3.4Å; M866-L1086 HydrophobicContact CE-CD1 4.16Å; F900-L1086 HydrophobicContact CZ-CD1 4.04Å; L1076-L1086 HydrophobicContact CD1-CD2 4.23Å
1087	R	86.1	Confident	82.9	Confident	98 Å²	98	61 Å²	61	37%	0.37	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-69.9	131.1	173	-70.9	173.8	168.6	156.7	-7.4	111.3	D814 S815 E1082 E1083	D814-R1087 CarbonylContact C-O 3.54Å; D814-R1087 WeakPolarHBondContact CA-O 3.2Å; S815-R1087 PolarHBondContact N-O 3.45Å; E1082-R1087 IonicContact OE2-CZ 3.66Å; E1082-R1087 IonicContact OE2-NH1 3.79Å; E1082-R1087 PolarHBondContact OE2-NH1 3.03Å; E1082-R1087 IonicContact OE2-NH2 3.54Å; E1083-R1087 IonicContact OE1-CZ 2.74Å; E1083-R1087 IonicContact OE1-NE 2.78Å; E1083-R1087 PolarHBondContact OE1-NE 3.28Å; E1083-R1087 IonicContact OE1-NH2 2.64Å; E1083-R1087 PolarHBondContact OE1-NH2 2.73Å; E1083-R1087 WeakPolarHBondContact OE2-CG 3.27Å; E1083-R1087 IonicContact OE2-CZ 2.68Å; E1083-R1087 IonicContact OE2-NE 3.18Å; E1083-R1087 PolarHBondContact OE2-NE 3.08Å; E1083-R1087 IonicContact OE2-NH2 3.33Å
1088	G	85.6	Confident	83	Confident	10 Å²	10	62.4 Å²	62.4	10%	0.103	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	131.9	174.8	0	0	0	0	0	113.3	K811 W821	K811-G1088 WeakPolarHBondContact CD-O 3.31Å; K811-G1088 WeakPolarHBondContact CE-O 3.43Å; K811-G1088 PolarHBondContact NZ-O 3.37Å; W821-G1088 VanDerWaalsContact CD2-CA 3.44Å
1089	G	85.1	Confident	83.3	Confident	10 Å²	10	61.2 Å²	61.2	10%	0.103	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	167.5	-176.9	0	0	0	0	0	114.8	K811 Y813	K811-G1089 WeakPolarHBondContact CB-O 3.45Å; K811-G1089 WeakPolarHBondContact CG-O 3.43Å; Y813-G1089 PolarHBondContact O-N 3.1Å
1090	Y	86.3	Confident	83.4	Confident	135 Å²	135	62.3 Å²	62.3	53%	0.529	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-91.4	143.6	165.6	-70	-77.8	0	0	0	110.2	K811 T1092	K811-Y1090 HydrophobicContact CG-CD1 4.49Å; K811-Y1090 HydrophobicContact CG-CE1 4.38Å; Y1090-T1092 PolarHBondContact O-N 3.03Å
1091	S	86.1	Confident	83.7	Confident	43 Å²	43	64.2 Å²	64.2	30%	0.301	35%	0.345	S	S	.	.			trans	-78.2	77.1	-173.1	-55.8	0	0	0	0	112.4
1092	T	87.3	Confident	84.2	Confident	61 Å²	61	63.4 Å²	63.4	37%	0.374	34%	0.336	S	S	.	.			trans	-73.2	157.7	173.1	83	0	0	0	0	111.3	Y1090 Q1094 T1095 L1096	Y1090-T1092 PolarHBondContact O-N 3.03Å; T1092-Q1094 PolarHBondContact O-N 3.44Å; T1092-Q1094 PolarHBondContact OG1-N 3.03Å; T1092-T1095 WeakPolarHBondContact O-CB 3.46Å; T1092-T1095 PolarHBondContact O-N 3.5Å; T1092-T1095 VanDerWaalsContact O-N 3.08Å; T1092-T1095 WeakPolarHBondContact OG1-CB 3.49Å; T1092-T1095 PolarHBondContact OG1-N 3.07Å; T1092-T1095 PolarHBondContact OG1-OG1 3.49Å; T1092-L1096 WeakPolarHBondContact O-CG 3.23Å; T1092-L1096 PolarHBondContact O-N 2.96Å
1093	P	84.9	Confident	84.7	Confident	116 Å²	116	58.9 Å²	58.9	75%	0.753	31%	0.313	S	S	*	.	H	α-helix	trans	-56.7	-33.9	173.6	-26.7	35.9	0	0	0	113.6	L1096 A1097	P1093-L1096 PolarHBondContact O-N 3.45Å; P1093-A1097 WeakPolarHBondContact O-CB 3.36Å; P1093-A1097 PolarHBondContact O-N 3.5Å
1094	Q	82.3	Confident	85.8	Confident	157 Å²	157	54.4 Å²	54.4	73%	0.734	29%	0.293	S	S	*	.	H	α-helix	trans	-71.2	-40.2	175.5	-176.9	175.9	-16.2	0	0	111.8	T1092 L1096 A1097 N1098	T1092-Q1094 PolarHBondContact O-N 3.44Å; T1092-Q1094 PolarHBondContact OG1-N 3.03Å; Q1094-L1096 VanDerWaalsContact C-N 3.3Å; Q1094-L1096 PolarHBondContact O-N 2.81Å; Q1094-A1097 PolarHBondContact O-N 3.34Å; Q1094-N1098 PolarHBondContact O-N 3.18Å
1095	T	84.6	Confident	86.3	Confident	16 Å²	16	52 Å²	52	10%	0.098	28%	0.282	C	S	.	.	H	α-helix	trans	-60.9	-39.8	172.9	-50.5	0	0	0	0	111	T1092	T1092-T1095 WeakPolarHBondContact O-CB 3.46Å; T1092-T1095 PolarHBondContact O-N 3.5Å; T1092-T1095 VanDerWaalsContact O-N 3.08Å; T1092-T1095 WeakPolarHBondContact OG1-CB 3.49Å; T1092-T1095 PolarHBondContact OG1-N 3.07Å; T1092-T1095 PolarHBondContact OG1-OG1 3.49Å
1096	L	85.8	Confident	86.8	Confident	63 Å²	63	52.5 Å²	52.5	33%	0.33	28%	0.278	S	S	.	.	H	α-helix	trans	-74.3	-30	177.6	-67.6	173	0	0	0	113	Y813 T1092 P1093 Q1094 N1098 R1099	Y813-L1096 HydrophobicContact CD2-CD2 4.33Å; Y813-L1096 HydrophobicContact CE2-CD2 3.9Å; T1092-L1096 WeakPolarHBondContact O-CG 3.23Å; T1092-L1096 PolarHBondContact O-N 2.96Å; P1093-L1096 PolarHBondContact O-N 3.45Å; Q1094-L1096 VanDerWaalsContact C-N 3.3Å; Q1094-L1096 PolarHBondContact O-N 2.81Å; L1096-N1098 VanDerWaalsContact C-N 3.3Å; L1096-N1098 PolarHBondContact O-N 3.34Å; L1096-R1099 VanDerWaalsContact O-CB 3.24Å; L1096-R1099 WeakPolarHBondContact O-CB 3.1Å; L1096-R1099 VanDerWaalsContact O-CG 3.28Å; L1096-R1099 WeakPolarHBondContact O-CG 3.43Å; L1096-R1099 PolarHBondContact O-N 3.02Å
1097	A	84.8	Confident	87.2	Confident	61 Å²	61	53.5 Å²	53.5	50%	0.504	28%	0.283	S	S	.	.	H	α-helix	trans	-66.8	-29.2	174.1	0	0	0	0	0	112.9	P1093 Q1094 R1099 D1100	P1093-A1097 WeakPolarHBondContact O-CB 3.36Å; P1093-A1097 PolarHBondContact O-N 3.5Å; Q1094-A1097 PolarHBondContact O-N 3.34Å; A1097-R1099 PolarHBondContact O-N 2.98Å; A1097-D1100 PolarHBondContact O-N 2.98Å; A1097-D1100 VanDerWaalsContact O-N 3.16Å
1098	N	85.1	Confident	87.5	Confident	48 Å²	48	50.3 Å²	50.3	26%	0.257	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-6.6	173	-69.1	-20.8	0	0	0	113.7	T816 M818 Q1094 L1096 R1101	T816-N1098 PolarHBondContact O-ND2 3.24Å; M818-N1098 HydrophobicContact SD-CB 3.88Å; Q1094-N1098 PolarHBondContact O-N 3.18Å; L1096-N1098 VanDerWaalsContact C-N 3.3Å; L1096-N1098 PolarHBondContact O-N 3.34Å; N1098-R1101 WeakPolarHBondContact O-CD 3.34Å; N1098-R1101 PolarHBondContact O-NE 3.27Å
1099	R	86.8	Confident	87.7	Confident	25 Å²	25	50 Å²	50	9%	0.094	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-18.4	175.5	-53.3	-177.7	57.8	-135.5	-7.9	113.7	Y813 S871 L1096 A1097 R1101	Y813-R1099 VanDerWaalsContact OH-CZ 3.3Å; Y813-R1099 PolarHBondContact OH-NH1 3.42Å; S871-R1099 VanDerWaalsContact O-CZ 3.27Å; S871-R1099 PolarHBondContact O-NE 3.22Å; S871-R1099 PolarHBondContact O-NH2 2.85Å; L1096-R1099 VanDerWaalsContact O-CB 3.24Å; L1096-R1099 WeakPolarHBondContact O-CB 3.1Å; L1096-R1099 VanDerWaalsContact O-CG 3.28Å; L1096-R1099 WeakPolarHBondContact O-CG 3.43Å; L1096-R1099 PolarHBondContact O-N 3.02Å; A1097-R1099 PolarHBondContact O-N 2.98Å; R1099-R1101 PolarHBondContact O-N 2.97Å
1100	D	84.4	Confident	87.7	Confident	68 Å²	68	55 Å²	55	36%	0.364	30%	0.298	S	S	.	.			trans	-73.9	80.1	178	-175.1	22.4	0	0	0	110.1	H655 A1097	H655-D1100 IonicContact CE1-OD2 3.54Å; A1097-D1100 PolarHBondContact O-N 2.98Å; A1097-D1100 VanDerWaalsContact O-N 3.16Å
1101	R	88.7	Confident	87.3	Confident	50 Å²	50	53 Å²	53	19%	0.189	30%	0.296	C	S	.	.			trans	-144.2	138.9	-175.9	-63.3	-177.8	-68.4	118.2	-12.4	108.6	M818 S871 N872 G1070 N1098 R1099	M818-R1101 VanDerWaalsContact CE-CZ 3.46Å; M818-R1101 PolarHBondContact O-NH2 3.48Å; M818-R1101 VanDerWaalsContact O-NH2 3.09Å; S871-R1101 PolarHBondContact OG-NH2 3.25Å; N872-R1101 WeakPolarHBondContact CB-O 3.33Å; G1070-R1101 PolarHBondContact O-NH1 2.85Å; G1070-R1101 PolarHBondContact O-NH2 3.19Å; N1098-R1101 WeakPolarHBondContact O-CD 3.34Å; N1098-R1101 PolarHBondContact O-NE 3.27Å; R1099-R1101 PolarHBondContact O-N 2.97Å
1102	C	89.1	Confident	87.2	Confident	17 Å²	17	53.4 Å²	53.4	12%	0.115	31%	0.308	C	S	.	.			trans	-57.4	153.4	175	-85.5	0	0	0	0	112.5	N651 N872 L1179 M1180 Q1181	N651-C1102 PolarHBondContact ND2-SG 2.85Å; N651-C1102 PolarHBondContact O-SG 3.21Å; N651-C1102 VanDerWaalsContact O-SG 3.4Å; N872-C1102 PolarHBondContact ND2-O 3.47Å; C1102-L1179 HydrophobicContact CB-CB 4.19Å; C1102-L1179 HydrophobicContact CB-CD2 4.43Å; C1102-M1180 CarbonylContact C-O 3.53Å; C1102-M1180 WeakPolarHBondContact CA-O 3.37Å; C1102-M1180 PolarHBondContact SG-O 2.8Å; C1102-Q1181 VanDerWaalsContact SG-CD 3.52Å; C1102-Q1181 PolarHBondContact SG-OE1 3.32Å; C1102-Q1181 VanDerWaalsContact SG-OE1 3.39Å
1103	R	88.9	Confident	87.1	Confident	38 Å²	38	53.7 Å²	53.7	14%	0.143	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	144.4	170.5	67.4	-166.1	-167.5	177.8	10	109.5	N872 F873 E877 L1179 M1180	N872-R1103 PolarHBondContact O-NH1 3.43Å; F873-R1103 HydrophobicContact CE1-CB 4.46Å; F873-R1103 HydrophobicContact CE2-CB 4.45Å; F873-R1103 HydrophobicContact CZ-CB 4.03Å; E877-R1103 IonicContact OE1-CZ 2.79Å; E877-R1103 VanDerWaalsContact OE1-CZ 3.27Å; E877-R1103 IonicContact OE1-NH1 3.22Å; E877-R1103 PolarHBondContact OE1-NH1 2.84Å; E877-R1103 IonicContact OE1-NH2 3.87Å; E877-R1103 PolarHBondContact OE1-NH2 3.34Å; E877-R1103 IonicContact OE2-CZ 3.2Å; E877-R1103 IonicContact OE2-NH1 3.69Å; E877-R1103 PolarHBondContact OE2-NH1 3.09Å; R1103-L1179 WeakPolarHBondContact O-CA 3.46Å; R1103-M1180 HydrophobicContact CG-CB 4.04Å; R1103-M1180 PolarHBondContact N-O 3.43Å; R1103-M1180 PolarHBondContact O-N 2.86Å
1104	V	92.3	Very high	87.3	Confident	6 Å²	6	48.6 Å²	48.6	4%	0.036	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	137.1	172	-173.5	0	0	0	0	108.8	A565 L568 L1067 F1139 L1179	A565-V1104 HydrophobicContact CB-CG1 3.94Å; L568-V1104 HydrophobicContact CD1-CG1 3.9Å; L568-V1104 HydrophobicContact CD2-CB 4.33Å; L568-V1104 HydrophobicContact CD2-CG1 3.85Å; L568-V1104 HydrophobicContact CD2-CG2 4.08Å; L568-V1104 HydrophobicContact CG-CG1 4.47Å; L1067-V1104 HydrophobicContact CD1-CG2 3.83Å; V1104-F1139 HydrophobicContact CG1-CZ 4.05Å; V1104-L1179 HydrophobicContact CG2-CD2 3.9Å
1105	A	91.9	Very high	87.5	Confident	16 Å²	16	42.8 Å²	42.8	13%	0.132	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	165.3	173.3	0	0	0	0	0	110.9	C1178 M1180	A1105-C1178 PolarHBondContact N-O 3.32Å; A1105-C1178 PolarHBondContact O-N 2.93Å; A1105-M1180 HydrophobicContact CB-CG 3.94Å; A1105-M1180 HydrophobicContact CB-SD 3.49Å; A1105-M1180 WeakPolarHBondContact CB-SD 3.27Å
1106	Q	92.8	Very high	87.6	Confident	50 Å²	50	47.6 Å²	47.6	23%	0.234	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	139.9	165	-83.5	164.6	-25.6	0	0	109.9	A565 Q566 Y1142 I1176 F1177	A565-Q1106 HydrophobicContact CB-CG 3.86Å; Q566-Q1106 PolarHBondContact O-NE2 3.38Å; Q1106-Y1142 VanDerWaalsContact NE2-CD1 3.31Å; Q1106-I1176 WeakPolarHBondContact CA-O 3.21Å; Q1106-F1177 HydrophobicContact CG-CD1 4.06Å; Q1106-F1177 HydrophobicContact CG-CE1 4.25Å
1107	L	91.8	Very high	87.7	Confident	35 Å²	35	45.7 Å²	45.7	18%	0.183	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	133.3	171.1	-60.8	173.8	0	0	0	108.9	F1114 M1136 L1175 I1176 C1178	L1107-F1114 HydrophobicContact CD1-CD2 4.49Å; L1107-F1114 HydrophobicContact CD1-CE2 4.06Å; L1107-M1136 HydrophobicContact CD1-SD 3.98Å; L1107-L1175 CarbonylContact O-C 3.58Å; L1107-L1175 WeakPolarHBondContact O-CA 3.36Å; L1107-I1176 PolarHBondContact N-O 2.84Å; L1107-I1176 PolarHBondContact O-N 3.39Å; L1107-C1178 HydrophobicContact CD1-CB 4.32Å
1108	A	92.8	Very high	87.6	Confident	32 Å²	32	42.8 Å²	42.8	26%	0.264	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	149.5	167.4	0	0	0	0	0	110.7	L1175	A1108-L1175 HydrophobicContact CB-CD2 3.7Å
1109	L	89.9	Confident	87.5	Confident	2 Å²	2	47 Å²	47	1%	0.01	27%	0.268	C	S	.	.	S	Bend	trans	-93.5	-13.5	169.1	-63	-175.9	0	0	0	113.2	D1111 F1114 A1115 L1126 L1170 P1172 D1174 I1176	L1109-D1111 VanDerWaalsContact C-N 3.25Å; L1109-D1111 PolarHBondContact O-N 2.92Å; L1109-F1114 HydrophobicContact CD2-CB 3.98Å; L1109-A1115 VanDerWaalsContact O-CA 3.22Å; L1109-A1115 WeakPolarHBondContact O-CA 3.36Å; L1109-A1115 WeakPolarHBondContact O-CB 3.43Å; L1109-L1126 HydrophobicContact CD2-CD1 4.29Å; L1109-L1126 HydrophobicContact CD2-CD2 4.1Å; L1109-L1170 HydrophobicContact CD1-CB 4.17Å; L1109-L1170 HydrophobicContact CD1-CD1 4.18Å; L1109-L1170 HydrophobicContact CD1-CD2 4.22Å; L1109-L1170 HydrophobicContact CD1-CG 4.43Å; L1109-P1172 CarbonylContact C-O 3.43Å; L1109-P1172 WeakPolarHBondContact CB-O 3.31Å; L1109-D1174 HydrophobicContact CD1-CB 4.2Å; L1109-D1174 PolarHBondContact N-O 2.8Å; L1109-I1176 HydrophobicContact CD1-CD1 4.19Å; L1109-I1176 HydrophobicContact CD1-CG1 4.2Å; L1109-I1176 HydrophobicContact CD2-CG1 3.96Å; L1109-I1176 HydrophobicContact CG-CD1 4.49Å; L1109-I1176 HydrophobicContact CG-CG1 3.97Å
1110	L	85.4	Confident	87.2	Confident	117 Å²	117	47.8 Å²	47.8	61%	0.613	29%	0.285	S	S	*	.	S	Bend	trans	-63	-30.7	177.5	-67.6	173.8	0	0	0	113	P1172 T1173	L1110-P1172 HydrophobicContact CD2-CB 4.39Å; L1110-P1172 VanDerWaalsContact CD2-O 3.29Å; L1110-P1172 WeakPolarHBondContact CD2-O 3.48Å; L1110-P1172 VanDerWaalsContact CG-O 3.3Å; L1110-P1172 WeakPolarHBondContact CG-O 3.45Å; L1110-P1172 PolarHBondContact N-O 2.86Å; L1110-P1172 VanDerWaalsContact N-O 3.16Å; L1110-T1173 HydrophobicContact CD2-CG2 4.32Å
1111	D	78.9	Confident	87.5	Confident	91 Å²	91	45.3 Å²	45.3	49%	0.487	28%	0.276	S	S	.	.	S	Bend	trans	-141.8	148.3	-174.3	65.6	-52.7	0	0	0	113.1	L1109	L1109-D1111 VanDerWaalsContact C-N 3.25Å; L1109-D1111 PolarHBondContact O-N 2.92Å
1112	G	82.8	Confident	87.7	Confident	53 Å²	53	44.6 Å²	44.6	55%	0.546	28%	0.278	S	S	.	.	S	Bend	trans	99.6	-162.3	178.3	0	0	0	0	0	115	F1114 A1115	G1112-F1114 PolarHBondContact O-N 2.96Å; G1112-F1114 VanDerWaalsContact O-N 3.11Å; G1112-A1115 PolarHBondContact O-N 3.34Å
1113	P	84.5	Confident	88	Confident	66 Å²	66	43.8 Å²	43.8	43%	0.429	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	6	-165	33.6	-37.8	0	0	0	115	K1129 Y1134	P1113-K1129 VanDerWaalsContact O-CE 3.32Å; P1113-K1129 WeakPolarHBondContact O-CE 3.3Å; P1113-K1129 PolarHBondContact O-NZ 2.82Å; P1113-Y1134 HydrophobicContact CB-CE2 4.42Å; P1113-Y1134 WeakPolarHBondContact CB-OH 3.28Å; P1113-Y1134 HydrophobicContact CG-CE2 4.16Å
1114	F	89.6	Confident	88.3	Confident	10 Å²	10	42 Å²	42	4%	0.044	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	1.2	-178	-54.7	-62.5	0	0	0	113.6	L1107 L1109 G1112 D1116 L1117 G1118 L1126 K1129 A1130 Y1134	L1107-F1114 HydrophobicContact CD1-CD2 4.49Å; L1107-F1114 HydrophobicContact CD1-CE2 4.06Å; L1109-F1114 HydrophobicContact CD2-CB 3.98Å; G1112-F1114 PolarHBondContact O-N 2.96Å; G1112-F1114 VanDerWaalsContact O-N 3.11Å; F1114-D1116 VanDerWaalsContact C-OD1 3.3Å; F1114-D1116 WeakPolarHBondContact CA-OD1 3.47Å; F1114-D1116 PolarHBondContact O-N 2.88Å; F1114-L1117 WeakPolarHBondContact O-CB 3.49Å; F1114-L1117 PolarHBondContact O-N 3.48Å; F1114-G1118 PolarHBondContact O-N 3.49Å; F1114-L1126 HydrophobicContact CB-CD1 3.76Å; F1114-L1126 HydrophobicContact CD1-CD1 3.57Å; F1114-L1126 HydrophobicContact CD2-CD1 4.36Å; F1114-L1126 HydrophobicContact CE1-CD1 4.23Å; F1114-L1126 HydrophobicContact CG-CD1 3.65Å; F1114-K1129 HydrophobicContact CD1-CD 4.07Å; F1114-K1129 HydrophobicContact CD1-CG 4.41Å; F1114-K1129 HydrophobicContact CE1-CB 4.45Å; F1114-K1129 HydrophobicContact CE1-CD 4.28Å; F1114-K1129 HydrophobicContact CE1-CG 4.11Å; F1114-A1130 HydrophobicContact CE1-CB 3.97Å; F1114-A1130 HydrophobicContact CZ-CB 3.75Å; F1114-Y1134 HydrophobicContact CE1-CD2 4.34Å; F1114-Y1134 HydrophobicContact CE1-CE2 4.16Å; F1114-Y1134 HydrophobicContact CE2-CE2 4.47Å; F1114-Y1134 AromaticContact CZ-CD2 3.66Å; F1114-Y1134 HydrophobicContact CZ-CD2 3.66Å; F1114-Y1134 AromaticContact CZ-CE2 3.69Å; F1114-Y1134 HydrophobicContact CZ-CE2 3.69Å
1115	A	87.6	Confident	88.4	Confident	34 Å²	34	45.1 Å²	45.1	28%	0.281	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-62.4	-26.8	179.3	0	0	0	0	0	112.9	L1109 G1112 L1117 G1118	L1109-A1115 VanDerWaalsContact O-CA 3.22Å; L1109-A1115 WeakPolarHBondContact O-CA 3.36Å; L1109-A1115 WeakPolarHBondContact O-CB 3.43Å; G1112-A1115 PolarHBondContact O-N 3.34Å; A1115-L1117 PolarHBondContact O-N 3.15Å; A1115-G1118 PolarHBondContact O-N 3.44Å
1116	D	86.9	Confident	88.5	Confident	117 Å²	117	44.5 Å²	44.5	63%	0.626	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-64.4	-12.2	170.9	64.3	-37.5	0	0	0	114.7	F1114 K1129	F1114-D1116 VanDerWaalsContact C-OD1 3.3Å; F1114-D1116 WeakPolarHBondContact CA-OD1 3.47Å; F1114-D1116 PolarHBondContact O-N 2.88Å; D1116-K1129 IonicContact OD1-NZ 2.7Å; D1116-K1129 PolarHBondContact OD1-NZ 3.48Å; D1116-K1129 IonicContact OD2-NZ 3.36Å; D1116-K1129 PolarHBondContact OD2-NZ 2.95Å
1117	L	87.4	Confident	88.6	Confident	23 Å²	23	42.1 Å²	42.1	12%	0.12	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-108.6	-8	172.7	-72.8	158.9	0	0	0	112.8	F1114 A1115 G1121 D1125 L1126 K1129	F1114-L1117 WeakPolarHBondContact O-CB 3.49Å; F1114-L1117 PolarHBondContact O-N 3.48Å; A1115-L1117 PolarHBondContact O-N 3.15Å; L1117-G1121 VanDerWaalsContact O-CA 3.31Å; L1117-G1121 WeakPolarHBondContact O-CA 3.4Å; L1117-G1121 PolarHBondContact O-N 3.36Å; L1117-D1125 HydrophobicContact CD2-CB 3.94Å; L1117-L1126 HydrophobicContact CD1-CB 4.25Å; L1117-L1126 HydrophobicContact CD1-CD1 4.24Å; L1117-K1129 HydrophobicContact CD1-CB 4.43Å; L1117-K1129 HydrophobicContact CD1-CD 3.53Å
1118	G	81.8	Confident	88.8	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-34.6	178.7	0	0	0	0	0	112.7	F1114 A1115 G1120 V1171 P1172	F1114-G1118 PolarHBondContact O-N 3.49Å; A1115-G1118 PolarHBondContact O-N 3.44Å; G1118-G1120 VanDerWaalsContact C-N 3.28Å; G1118-G1120 PolarHBondContact O-N 2.96Å; G1118-V1171 CarbonylContact O-C 3.55Å; G1118-P1172 WeakPolarHBondContact O-CD 3.2Å; G1118-P1172 VanDerWaalsContact O-N 3.12Å
1119	D	83.3	Confident	88.8	Confident	136 Å²	136	42.3 Å²	42.3	73%	0.727	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	66.3	-177.8	-66.8	-26	0	0	0	112.1
1120	G	80.6	Confident	89	Confident	43 Å²	43	42.2 Å²	42.2	44%	0.443	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.6	22.5	176.2	0	0	0	0	0	114.9	G1118 L1170	G1118-G1120 VanDerWaalsContact C-N 3.28Å; G1118-G1120 PolarHBondContact O-N 2.96Å; G1120-L1170 PolarHBondContact N-O 3.21Å
1121	G	90	Very high	89.4	Confident	16 Å²	16	36.8 Å²	36.8	17%	0.165	23%	0.231	C	C	.	.			trans	-75.5	163.8	174	0	0	0	0	0	113.3	L1117 L1170	L1117-G1121 VanDerWaalsContact O-CA 3.31Å; L1117-G1121 WeakPolarHBondContact O-CA 3.4Å; L1117-G1121 PolarHBondContact O-N 3.36Å; G1121-L1170 WeakPolarHBondContact O-CB 3.33Å; G1121-L1170 WeakPolarHBondContact O-CG 3.34Å; G1121-L1170 PolarHBondContact O-N 3.06Å
1122	C	94.4	Very high	90	Very high	35 Å²	35	38.2 Å²	38.2	24%	0.236	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-86.4	137.2	176.5	-71	0	0	0	0	112	G1124 D1125 L1126	C1122-G1124 PolarHBondContact O-N 2.9Å; C1122-D1125 PolarHBondContact O-N 3.34Å; C1122-D1125 VanDerWaalsContact O-N 3.1Å; C1122-L1126 PolarHBondContact O-N 2.69Å
1123	Y	95.4	Very high	90.4	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-55.1	-34.4	175.9	176.2	-99.4	0	0	0	112.8	F623 D1125 L1126 F1127 C1138 F1139 G1140 I1141 P1164 F1168 L1170	F623-Y1123 HydrophobicContact CE2-CE1 4.37Å; F623-Y1123 HydrophobicContact CZ-CD1 4.02Å; F623-Y1123 AromaticContact CZ-CE1 3.8Å; F623-Y1123 HydrophobicContact CZ-CE1 3.8Å; Y1123-D1125 PolarHBondContact O-N 3.33Å; Y1123-L1126 WeakPolarHBondContact O-CB 3.5Å; Y1123-L1126 PolarHBondContact O-N 3.15Å; Y1123-F1127 WeakPolarHBondContact O-CB 3.24Å; Y1123-F1127 PolarHBondContact O-N 3.38Å; Y1123-C1138 HydrophobicContact CE2-CB 4.26Å; Y1123-C1138 PolarHBondContact OH-O 3.49Å; Y1123-F1139 PolarHBondContact OH-N 2.83Å; Y1123-G1140 PolarHBondContact OH-N 2.94Å; Y1123-I1141 HydrophobicContact CD2-CD1 3.89Å; Y1123-I1141 HydrophobicContact CD2-CG1 3.99Å; Y1123-I1141 HydrophobicContact CE2-CD1 4.47Å; Y1123-I1141 HydrophobicContact CE2-CG1 4.1Å; Y1123-I1141 HydrophobicContact CG-CD1 4.47Å; Y1123-P1164 HydrophobicContact CD1-CB 4.47Å; Y1123-P1164 HydrophobicContact CD1-CG 3.79Å; Y1123-P1164 HydrophobicContact CD2-CG 4Å; Y1123-P1164 HydrophobicContact CE1-CG 3.81Å; Y1123-P1164 HydrophobicContact CE2-CG 4.01Å; Y1123-P1164 HydrophobicContact CG-CG 3.89Å; Y1123-F1168 PolarHBondContact N-O 2.92Å; Y1123-L1170 HydrophobicContact CD2-CD2 4.25Å
1124	G	94.2	Very high	90.7	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.5	-34.4	177.7	0	0	0	0	0	115.1	C1122 C1128 Y1166	C1122-G1124 PolarHBondContact O-N 2.9Å; G1124-C1128 WeakPolarHBondContact O-CB 3.14Å; G1124-C1128 PolarHBondContact O-N 3.5Å; G1124-C1128 PolarHBondContact O-SG 3.18Å; G1124-Y1166 VanDerWaalsContact CA-CD2 3.46Å; G1124-Y1166 VanDerWaalsContact CA-CE2 3.42Å; G1124-Y1166 PolarHBondContact N-O 3.39Å
1125	D	94.2	Very high	90.8	Very high	72 Å²	72	42.3 Å²	42.3	39%	0.385	24%	0.236	S	C	.	.	H	α-helix	trans	-73.3	-40.6	175.7	-71.1	-39.8	0	0	0	111.2	L1117 C1122 Y1123 C1128 K1129 Y1166	L1117-D1125 HydrophobicContact CD2-CB 3.94Å; C1122-D1125 PolarHBondContact O-N 3.34Å; C1122-D1125 VanDerWaalsContact O-N 3.1Å; Y1123-D1125 PolarHBondContact O-N 3.33Å; D1125-C1128 PolarHBondContact O-N 3.09Å; D1125-K1129 VanDerWaalsContact O-CB 3.3Å; D1125-K1129 WeakPolarHBondContact O-CB 3.38Å; D1125-K1129 PolarHBondContact O-N 3.25Å; D1125-Y1166 PolarHBondContact OD1-OH 3.39Å
1126	L	94.6	Very high	91.1	Very high	3 Å²	3	42 Å²	42	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-57.4	-50.2	170.6	175.5	66	0	0	0	111.6	L1109 F1114 L1117 C1122 Y1123 C1128 K1129 A1130 L1170 I1176	L1109-L1126 HydrophobicContact CD2-CD1 4.29Å; L1109-L1126 HydrophobicContact CD2-CD2 4.1Å; F1114-L1126 HydrophobicContact CB-CD1 3.76Å; F1114-L1126 HydrophobicContact CD1-CD1 3.57Å; F1114-L1126 HydrophobicContact CD2-CD1 4.36Å; F1114-L1126 HydrophobicContact CE1-CD1 4.23Å; F1114-L1126 HydrophobicContact CG-CD1 3.65Å; L1117-L1126 HydrophobicContact CD1-CB 4.25Å; L1117-L1126 HydrophobicContact CD1-CD1 4.24Å; C1122-L1126 PolarHBondContact O-N 2.69Å; Y1123-L1126 WeakPolarHBondContact O-CB 3.5Å; Y1123-L1126 PolarHBondContact O-N 3.15Å; L1126-C1128 VanDerWaalsContact C-N 3.33Å; L1126-C1128 PolarHBondContact O-N 3.36Å; L1126-K1129 PolarHBondContact O-N 2.69Å; L1126-A1130 VanDerWaalsContact O-CB 3.29Å; L1126-A1130 WeakPolarHBondContact O-CB 3.32Å; L1126-A1130 PolarHBondContact O-N 2.96Å; L1126-L1170 HydrophobicContact CB-CD1 3.95Å; L1126-L1170 HydrophobicContact CD2-CD1 3.81Å; L1126-L1170 HydrophobicContact CD2-CD2 4.39Å; L1126-L1170 HydrophobicContact CG-CD1 4.47Å; L1126-I1176 HydrophobicContact CD2-CD1 4Å; L1126-I1176 HydrophobicContact CD2-CG1 3.91Å; L1126-I1176 HydrophobicContact CD2-CG2 4.28Å
1127	F	95.6	Very high	91.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-55	-48.8	176.5	176.3	-89.4	0	0	0	111.2	F623 L629 Y1123 L1131 L1137 C1138	F623-F1127 HydrophobicContact CB-CD1 4.15Å; F623-F1127 HydrophobicContact CB-CE1 3.53Å; F623-F1127 HydrophobicContact CB-CZ 3.95Å; F623-F1127 AromaticContact CD1-CD1 3.65Å; F623-F1127 HydrophobicContact CD1-CD1 3.65Å; F623-F1127 AromaticContact CD1-CE1 3.94Å; F623-F1127 HydrophobicContact CD1-CE1 3.94Å; F623-F1127 HydrophobicContact CD1-CG 4.12Å; F623-F1127 HydrophobicContact CD2-CE1 4.34Å; F623-F1127 HydrophobicContact CD2-CE2 4.43Å; F623-F1127 HydrophobicContact CD2-CZ 4.26Å; F623-F1127 HydrophobicContact CE1-CB 4.38Å; F623-F1127 HydrophobicContact CE1-CD1 4.23Å; F623-F1127 HydrophobicContact CE1-CG 4.26Å; F623-F1127 AromaticContact CG-CD1 3.86Å; F623-F1127 HydrophobicContact CG-CD1 3.86Å; F623-F1127 AromaticContact CG-CE1 3.67Å; F623-F1127 HydrophobicContact CG-CE1 3.67Å; F623-F1127 HydrophobicContact CG-CG 4.39Å; F623-F1127 HydrophobicContact CG-CZ 4.03Å; L629-F1127 HydrophobicContact CD1-CE2 3.59Å; L629-F1127 HydrophobicContact CD1-CZ 4.1Å; Y1123-F1127 WeakPolarHBondContact O-CB 3.24Å; Y1123-F1127 PolarHBondContact O-N 3.38Å; F1127-L1131 HydrophobicContact CE1-CD2 3.8Å; F1127-L1131 HydrophobicContact CZ-CD2 3.94Å; F1127-L1131 WeakPolarHBondContact O-CB 3.23Å; F1127-L1131 PolarHBondContact O-N 3.31Å; F1127-L1137 HydrophobicContact CE2-CD1 3.55Å; F1127-L1137 HydrophobicContact CE2-CG 4.2Å; F1127-L1137 HydrophobicContact CZ-CD1 3.65Å; F1127-C1138 HydrophobicContact CD2-CB 4.17Å; F1127-C1138 WeakPolarHBondContact CD2-O 3.45Å; F1127-C1138 WeakPolarHBondContact CE2-O 3.46Å
1128	C	94.6	Very high	91.8	Very high	13 Å²	13	35.4 Å²	35.4	9%	0.088	19%	0.194	C	C	.	.	H	α-helix	trans	-65.6	-40.1	179.7	-71.1	0	0	0	0	112.9	G1124 D1125 L1126 K1132	G1124-C1128 WeakPolarHBondContact O-CB 3.14Å; G1124-C1128 PolarHBondContact O-N 3.5Å; G1124-C1128 PolarHBondContact O-SG 3.18Å; D1125-C1128 PolarHBondContact O-N 3.09Å; L1126-C1128 VanDerWaalsContact C-N 3.33Å; L1126-C1128 PolarHBondContact O-N 3.36Å; C1128-K1132 VanDerWaalsContact O-CB 3.28Å; C1128-K1132 WeakPolarHBondContact O-CB 3.39Å; C1128-K1132 WeakPolarHBondContact O-CD 3.3Å; C1128-K1132 VanDerWaalsContact O-CG 3.24Å; C1128-K1132 WeakPolarHBondContact O-CG 3.4Å; C1128-K1132 PolarHBondContact O-N 2.8Å
1129	K	93.9	Very high	92.4	Very high	58 Å²	58	35.7 Å²	35.7	25%	0.252	20%	0.195	S	C	.	.	H	α-helix	trans	-69.1	-44.1	179	-171.5	-178.7	170.3	-171.4	0	111.8	P1113 F1114 D1116 L1117 D1125 L1126 T1133	P1113-K1129 VanDerWaalsContact O-CE 3.32Å; P1113-K1129 WeakPolarHBondContact O-CE 3.3Å; P1113-K1129 PolarHBondContact O-NZ 2.82Å; F1114-K1129 HydrophobicContact CD1-CD 4.07Å; F1114-K1129 HydrophobicContact CD1-CG 4.41Å; F1114-K1129 HydrophobicContact CE1-CB 4.45Å; F1114-K1129 HydrophobicContact CE1-CD 4.28Å; F1114-K1129 HydrophobicContact CE1-CG 4.11Å; D1116-K1129 IonicContact OD1-NZ 2.7Å; D1116-K1129 PolarHBondContact OD1-NZ 3.48Å; D1116-K1129 IonicContact OD2-NZ 3.36Å; D1116-K1129 PolarHBondContact OD2-NZ 2.95Å; L1117-K1129 HydrophobicContact CD1-CB 4.43Å; L1117-K1129 HydrophobicContact CD1-CD 3.53Å; D1125-K1129 VanDerWaalsContact O-CB 3.3Å; D1125-K1129 WeakPolarHBondContact O-CB 3.38Å; D1125-K1129 PolarHBondContact O-N 3.25Å; L1126-K1129 PolarHBondContact O-N 2.69Å; K1129-T1133 WeakPolarHBondContact O-CB 3.27Å; K1129-T1133 PolarHBondContact O-N 3.15Å; K1129-T1133 VanDerWaalsContact O-N 3.1Å; K1129-T1133 PolarHBondContact O-OG1 3.4Å
1130	A	93.6	Very high	93	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-44.3	177.8	0	0	0	0	0	112.2	F1114 L1126 Y1134 N1135 M1136	F1114-A1130 HydrophobicContact CE1-CB 3.97Å; F1114-A1130 HydrophobicContact CZ-CB 3.75Å; L1126-A1130 VanDerWaalsContact O-CB 3.29Å; L1126-A1130 WeakPolarHBondContact O-CB 3.32Å; L1126-A1130 PolarHBondContact O-N 2.96Å; A1130-Y1134 PolarHBondContact O-N 3.43Å; A1130-N1135 PolarHBondContact O-N 3.4Å; A1130-M1136 CarbonylContact C-O 3.42Å; A1130-M1136 HydrophobicContact CB-CB 4.29Å; A1130-M1136 PolarHBondContact O-N 3.48Å
1131	L	93.9	Very high	93.7	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-69.7	-41.1	-179	-175.7	61.8	0	0	0	112.5	P616 C619 F1127 N1135 M1136 L1137	P616-L1131 HydrophobicContact CB-CD1 3.91Å; P616-L1131 HydrophobicContact CB-CG 4.06Å; P616-L1131 HydrophobicContact CG-CD1 4.44Å; C619-L1131 HydrophobicContact CB-CD2 3.76Å; F1127-L1131 HydrophobicContact CE1-CD2 3.8Å; F1127-L1131 HydrophobicContact CZ-CD2 3.94Å; F1127-L1131 WeakPolarHBondContact O-CB 3.23Å; F1127-L1131 PolarHBondContact O-N 3.31Å; L1131-N1135 VanDerWaalsContact O-CA 3.25Å; L1131-N1135 WeakPolarHBondContact O-CA 3.17Å; L1131-N1135 PolarHBondContact O-N 3.4Å; L1131-N1135 VanDerWaalsContact O-N 3.16Å; L1131-M1136 WeakPolarHBondContact CA-O 3.48Å; L1131-M1136 PolarHBondContact N-O 2.98Å; L1131-L1137 HydrophobicContact CD1-CD1 4.15Å; L1131-L1137 HydrophobicContact CD2-CD1 4.42Å
1132	K	91.7	Very high	94	Very high	122 Å²	122	26.6 Å²	26.6	53%	0.53	13%	0.133	S	C	.	.	H	α-helix	trans	-70.7	-46.4	178.9	-75.1	172.1	-179.2	169.5	0	113.2	E620 C1128	E620-K1132 WeakPolarHBondContact OE1-CE 3.43Å; E620-K1132 IonicContact OE1-NZ 2.67Å; E620-K1132 PolarHBondContact OE1-NZ 3.27Å; E620-K1132 WeakPolarHBondContact OE2-CE 3.33Å; E620-K1132 IonicContact OE2-NZ 3.79Å; C1128-K1132 VanDerWaalsContact O-CB 3.28Å; C1128-K1132 WeakPolarHBondContact O-CB 3.39Å; C1128-K1132 WeakPolarHBondContact O-CD 3.3Å; C1128-K1132 VanDerWaalsContact O-CG 3.24Å; C1128-K1132 WeakPolarHBondContact O-CG 3.4Å; C1128-K1132 PolarHBondContact O-N 2.8Å
1133	T	90.7	Very high	94.1	Very high	88 Å²	88	25.9 Å²	25.9	54%	0.54	13%	0.125	S	C	.	.	H	α-helix	trans	-83.6	-36.3	-171.5	-55.4	0	0	0	0	112.3	K1129	K1129-T1133 WeakPolarHBondContact O-CB 3.27Å; K1129-T1133 PolarHBondContact O-N 3.15Å; K1129-T1133 VanDerWaalsContact O-N 3.1Å; K1129-T1133 PolarHBondContact O-OG1 3.4Å
1134	Y	90.3	Very high	94	Very high	95 Å²	95	27.5 Å²	27.5	37%	0.373	13%	0.134	S	C	.	.	H	α-helix	trans	-122.6	-2.6	-170.7	-57.2	-80.2	0	0	0	114.4	P1113 F1114 A1130 M1136	P1113-Y1134 HydrophobicContact CB-CE2 4.42Å; P1113-Y1134 WeakPolarHBondContact CB-OH 3.28Å; P1113-Y1134 HydrophobicContact CG-CE2 4.16Å; F1114-Y1134 HydrophobicContact CE1-CD2 4.34Å; F1114-Y1134 HydrophobicContact CE1-CE2 4.16Å; F1114-Y1134 HydrophobicContact CE2-CE2 4.47Å; F1114-Y1134 AromaticContact CZ-CD2 3.66Å; F1114-Y1134 HydrophobicContact CZ-CD2 3.66Å; F1114-Y1134 AromaticContact CZ-CE2 3.69Å; F1114-Y1134 HydrophobicContact CZ-CE2 3.69Å; A1130-Y1134 PolarHBondContact O-N 3.43Å; Y1134-M1136 HydrophobicContact CD1-CE 4.45Å; Y1134-M1136 HydrophobicContact CG-CE 4.24Å; Y1134-M1136 HydrophobicContact CG-SD 4.35Å; Y1134-M1136 PolarHBondContact O-N 3.01Å
1135	N	92.4	Very high	93.8	Very high	32 Å²	32	29.1 Å²	29.1	17%	0.171	14%	0.14	C	C	.	.			trans	54.9	26	-170	-51.8	-99	0	0	0	112.9	N651 A1130 L1131 Q1181	N651-N1135 PolarHBondContact ND2-O 3.33Å; A1130-N1135 PolarHBondContact O-N 3.4Å; L1131-N1135 VanDerWaalsContact O-CA 3.25Å; L1131-N1135 WeakPolarHBondContact O-CA 3.17Å; L1131-N1135 PolarHBondContact O-N 3.4Å; L1131-N1135 VanDerWaalsContact O-N 3.16Å; N1135-Q1181 HydrophobicContact CB-CG 3.84Å; N1135-Q1181 PolarHBondContact O-NE2 2.97Å; N1135-Q1181 VanDerWaalsContact O-NE2 3.11Å
1136	M	93.3	Very high	93.4	Very high	27 Å²	27	26.8 Å²	26.8	13%	0.133	13%	0.127	C	C	.	.			trans	-85.8	122.5	175.6	-67	176.5	-176.2	0	0	109.1	L1107 A1130 L1131 Y1134 L1179 M1180	L1107-M1136 HydrophobicContact CD1-SD 3.98Å; A1130-M1136 CarbonylContact C-O 3.42Å; A1130-M1136 HydrophobicContact CB-CB 4.29Å; A1130-M1136 PolarHBondContact O-N 3.48Å; L1131-M1136 WeakPolarHBondContact CA-O 3.48Å; L1131-M1136 PolarHBondContact N-O 2.98Å; Y1134-M1136 HydrophobicContact CD1-CE 4.45Å; Y1134-M1136 HydrophobicContact CG-CE 4.24Å; Y1134-M1136 HydrophobicContact CG-SD 4.35Å; Y1134-M1136 PolarHBondContact O-N 3.01Å; M1136-L1179 WeakPolarHBondContact CA-O 3.29Å; M1136-M1180 HydrophobicContact CE-CE 3.52Å; M1136-M1180 HydrophobicContact CE-CG 4.32Å
1137	L	94.8	Very high	92.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	110.7	174.4	-168.8	80.5	0	0	0	109.1	C619 L629 M630 I631 N651 F1127 L1131 C1178 L1179	C619-L1137 HydrophobicContact CB-CD1 4.25Å; L629-L1137 HydrophobicContact CD1-CD1 4.4Å; L629-L1137 HydrophobicContact CD1-CD2 4.47Å; L629-L1137 HydrophobicContact CD1-CG 4.45Å; M630-L1137 WeakPolarHBondContact O-CD2 3.4Å; I631-L1137 HydrophobicContact CB-CD2 4.3Å; I631-L1137 HydrophobicContact CG1-CD2 3.92Å; N651-L1137 HydrophobicContact CB-CB 4.33Å; N651-L1137 PolarHBondContact ND2-N 3.31Å; F1127-L1137 HydrophobicContact CE2-CD1 3.55Å; F1127-L1137 HydrophobicContact CE2-CG 4.2Å; F1127-L1137 HydrophobicContact CZ-CD1 3.65Å; L1131-L1137 HydrophobicContact CD1-CD1 4.15Å; L1131-L1137 HydrophobicContact CD2-CD1 4.42Å; L1137-C1178 CarbonylContact O-C 3.33Å; L1137-C1178 VanDerWaalsContact O-CA 3.24Å; L1137-C1178 WeakPolarHBondContact O-CA 3.1Å; L1137-L1179 HydrophobicContact CB-CB 4.32Å; L1137-L1179 HydrophobicContact CD2-CD1 4.17Å; L1137-L1179 PolarHBondContact N-O 3.05Å; L1137-L1179 PolarHBondContact O-N 3.06Å
1138	C	95.4	Very high	91.8	Very high	1 Å²	1	31 Å²	31	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	138.2	169.2	-60.9	0	0	0	0	109.7	Y1123 F1127 I1176 F1177	Y1123-C1138 HydrophobicContact CE2-CB 4.26Å; Y1123-C1138 PolarHBondContact OH-O 3.49Å; F1127-C1138 HydrophobicContact CD2-CB 4.17Å; F1127-C1138 WeakPolarHBondContact CD2-O 3.45Å; F1127-C1138 WeakPolarHBondContact CE2-O 3.46Å; C1138-I1176 HydrophobicContact CB-CG2 4.03Å; C1138-F1177 WeakPolarHBondContact CA-O 3.26Å
1139	F	93	Very high	91	Very high	6 Å²	6	34.4 Å²	34.4	3%	0.026	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	0.5	-177.2	62.1	-84.1	0	0	0	115.5	L568 M571 L629 I631 V1104 Y1123 N1163 F1177 L1179	L568-F1139 HydrophobicContact CD1-CE2 3.7Å; L568-F1139 HydrophobicContact CD1-CZ 3.76Å; M571-F1139 HydrophobicContact CE-CD2 4.5Å; M571-F1139 HydrophobicContact SD-CD2 3.44Å; M571-F1139 WeakPolarHBondContact SD-CD2 3.36Å; M571-F1139 HydrophobicContact SD-CE2 3.28Å; M571-F1139 WeakPolarHBondContact SD-CE2 3.49Å; M571-F1139 HydrophobicContact SD-CZ 4.42Å; L629-F1139 HydrophobicContact CD2-CB 3.82Å; I631-F1139 HydrophobicContact CD1-CB 4.35Å; V1104-F1139 HydrophobicContact CG1-CZ 4.05Å; Y1123-F1139 PolarHBondContact OH-N 2.83Å; F1139-N1163 PolarHBondContact O-N 3.26Å; F1139-N1163 VanDerWaalsContact O-N 3.12Å; F1139-F1177 HydrophobicContact CD1-CB 4.39Å; F1139-F1177 WeakPolarHBondContact CD1-O 3.3Å; F1139-F1177 HydrophobicContact CD2-CB 4.36Å; F1139-F1177 HydrophobicContact CE1-CB 4.1Å; F1139-F1177 HydrophobicContact CE2-CB 4.09Å; F1139-F1177 HydrophobicContact CZ-CB 3.95Å; F1139-F1177 PolarHBondContact N-O 2.86Å; F1139-L1179 HydrophobicContact CD1-CG 4.16Å; F1139-L1179 HydrophobicContact CE1-CD2 4.26Å; F1139-L1179 HydrophobicContact CE1-CG 3.82Å
1140	G	95.8	Very high	89.9	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.6	177.4	171	0	0	0	0	0	113.5	Y1123 I1161 F1177	Y1123-G1140 PolarHBondContact OH-N 2.94Å; G1140-I1161 CarbonylContact C-O 3.21Å; G1140-I1161 WeakPolarHBondContact CA-O 3.08Å; G1140-F1177 PolarHBondContact O-N 3.46Å
1141	I	96.4	Very high	88.9	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	149	-178.1	-56.1	169.7	0	0	0	109.2	Y1123 R1143 I1161 P1164 F1168 L1170 D1174 I1176	Y1123-I1141 HydrophobicContact CD2-CD1 3.89Å; Y1123-I1141 HydrophobicContact CD2-CG1 3.99Å; Y1123-I1141 HydrophobicContact CE2-CD1 4.47Å; Y1123-I1141 HydrophobicContact CE2-CG1 4.1Å; Y1123-I1141 HydrophobicContact CG-CD1 4.47Å; I1141-R1143 HydrophobicContact CG2-CB 4.08Å; I1141-I1161 HydrophobicContact CB-CB 4.29Å; I1141-I1161 PolarHBondContact N-O 3.02Å; I1141-I1161 PolarHBondContact O-N 2.93Å; I1141-P1164 HydrophobicContact CD1-CB 4.33Å; I1141-P1164 HydrophobicContact CD1-CG 3.73Å; I1141-P1164 HydrophobicContact CG1-CG 3.97Å; I1141-F1168 HydrophobicContact CD1-CD1 3.57Å; I1141-F1168 HydrophobicContact CD1-CE1 3.61Å; I1141-L1170 HydrophobicContact CD1-CD2 3.89Å; I1141-D1174 HydrophobicContact CG2-CB 3.92Å; I1141-I1176 HydrophobicContact CB-CD1 4.36Å; I1141-I1176 HydrophobicContact CG1-CD1 3.78Å; I1141-I1176 HydrophobicContact CG2-CD1 4.2Å
1142	Y	96.8	Very high	87.9	Confident	5 Å²	5	48.2 Å²	48.2	2%	0.02	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	82.8	173.1	-170.3	-134.7	0	0	0	108.5	Q566 C1038 Q1106 R1158 Y1159 V1160 L1175 F1177	Q566-Y1142 HydrophobicContact CB-CE1 3.97Å; Q566-Y1142 HydrophobicContact CG-CE1 4.24Å; Q566-Y1142 VanDerWaalsContact CG-OH 3.29Å; Q566-Y1142 WeakPolarHBondContact CG-OH 3.4Å; Q566-Y1142 PolarHBondContact OE1-OH 3.18Å; C1038-Y1142 PolarHBondContact O-OH 3.13Å; Q1106-Y1142 VanDerWaalsContact NE2-CD1 3.31Å; Y1142-R1158 HydrophobicContact CD1-CB 3.88Å; Y1142-R1158 HydrophobicContact CD1-CG 4.35Å; Y1142-R1158 HydrophobicContact CD2-CB 3.71Å; Y1142-R1158 HydrophobicContact CE1-CB 3.67Å; Y1142-R1158 HydrophobicContact CE1-CG 4.24Å; Y1142-R1158 HydrophobicContact CE2-CB 3.49Å; Y1142-R1158 VanDerWaalsContact CE2-CB 3.49Å; Y1142-R1158 VanDerWaalsContact CE2-O 3.27Å; Y1142-R1158 WeakPolarHBondContact CE2-O 3.48Å; Y1142-R1158 HydrophobicContact CG-CB 3.88Å; Y1142-R1158 VanDerWaalsContact CZ-CB 3.46Å; Y1142-R1158 PolarHBondContact O-NH1 2.95Å; Y1142-Y1159 CarbonylContact C-O 3.59Å; Y1142-Y1159 WeakPolarHBondContact CA-O 3.29Å; Y1142-V1160 HydrophobicContact CD2-CG2 4.08Å; Y1142-V1160 HydrophobicContact CE2-CG2 4.32Å; Y1142-L1175 HydrophobicContact CD1-CB 4.39Å; Y1142-L1175 HydrophobicContact CD1-CD1 4.15Å; Y1142-L1175 PolarHBondContact N-O 3.26Å; Y1142-L1175 PolarHBondContact O-N 3.08Å; Y1142-F1177 HydrophobicContact CD2-CE2 4.39Å; Y1142-F1177 HydrophobicContact CD2-CZ 4.29Å; Y1142-F1177 HydrophobicContact CG-CE2 4.23Å; Y1142-F1177 HydrophobicContact CG-CZ 4.17Å
1143	R	95.1	Very high	87.3	Confident	20 Å²	20	45.2 Å²	45.2	8%	0.075	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	141.6	-167.3	173.8	160.4	-71.6	176.3	3.5	111.1	I1141 R1145 A1147 R1158 Y1159 I1161 F1168 E1169 D1174	I1141-R1143 HydrophobicContact CG2-CB 4.08Å; R1143-R1145 PolarHBondContact O-N 2.91Å; R1143-A1147 HydrophobicContact CG-CB 4.01Å; R1143-R1158 CarbonylContact O-C 3.59Å; R1143-R1158 WeakPolarHBondContact O-CA 3.37Å; R1143-R1158 WeakPolarHBondContact O-CB 3.47Å; R1143-Y1159 HydrophobicContact CB-CE1 4.09Å; R1143-Y1159 HydrophobicContact CG-CE1 3.98Å; R1143-Y1159 PolarHBondContact N-O 3.43Å; R1143-Y1159 VanDerWaalsContact O-CD1 3.29Å; R1143-Y1159 WeakPolarHBondContact O-CD1 3.41Å; R1143-Y1159 PolarHBondContact O-N 2.95Å; R1143-I1161 HydrophobicContact CB-CD1 4.14Å; R1143-F1168 VanDerWaalsContact NH1-CE1 3.33Å; R1143-E1169 PolarHBondContact NH2-O 3.2Å; R1143-D1174 WeakPolarHBondContact CA-OD1 3.47Å; R1143-D1174 WeakPolarHBondContact CB-OD1 3.22Å; R1143-D1174 WeakPolarHBondContact CG-OD1 3.23Å; R1143-D1174 IonicContact CZ-OD2 2.72Å; R1143-D1174 IonicContact NE-OD1 2.73Å; R1143-D1174 PolarHBondContact NE-OD1 3.33Å; R1143-D1174 IonicContact NE-OD2 3.29Å; R1143-D1174 PolarHBondContact NE-OD2 3.47Å; R1143-D1174 VanDerWaalsContact NE-OD2 3.17Å; R1143-D1174 IonicContact NH2-OD2 2.84Å; R1143-D1174 PolarHBondContact NH2-OD2 2.95Å
1144	L	93.3	Very high	86.7	Confident	34 Å²	34	49.2 Å²	49.2	18%	0.178	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60	134.4	173	-76.1	165.7	0	0	0	110.1	D1146 A1147 T1156 K1157 R1158 T1173	L1144-D1146 VanDerWaalsContact C-N 3.29Å; L1144-D1146 PolarHBondContact O-N 2.74Å; L1144-A1147 HydrophobicContact CB-CB 4.1Å; L1144-A1147 WeakPolarHBondContact O-CB 3.26Å; L1144-A1147 PolarHBondContact O-N 2.74Å; L1144-A1147 VanDerWaalsContact O-N 3.13Å; L1144-T1156 WeakPolarHBondContact CD2-O 3.35Å; L1144-K1157 WeakPolarHBondContact CA-O 3.26Å; L1144-R1158 HydrophobicContact CD2-CG 3.71Å; L1144-R1158 HydrophobicContact CG-CG 4.07Å; L1144-T1173 HydrophobicContact CD1-CG2 4.35Å
1145	R	89.7	Confident	86.5	Confident	34 Å²	34	46.2 Å²	46.2	13%	0.128	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-51.1	-51.2	-178.2	-171.2	-168.7	68.6	-167.2	-5.1	111.1	W589 D1021 R1143 A1147 H1148 C1155 K1157 Y1159	W589-R1145 HydrophobicContact CB-CG 4Å; W589-R1145 HydrophobicContact CD2-CG 4.48Å; W589-R1145 HydrophobicContact CG-CG 3.76Å; D1021-R1145 PolarHBondContact O-NH1 2.72Å; D1021-R1145 IonicContact OD2-CZ 2.69Å; D1021-R1145 IonicContact OD2-NH1 2.75Å; D1021-R1145 PolarHBondContact OD2-NH1 2.96Å; D1021-R1145 IonicContact OD2-NH2 3.17Å; R1143-R1145 PolarHBondContact O-N 2.91Å; R1145-A1147 VanDerWaalsContact C-N 3.27Å; R1145-A1147 PolarHBondContact O-N 2.77Å; R1145-H1148 PolarHBondContact O-CE1 3.05Å; R1145-H1148 PolarHBondContact O-ND1 3.2Å; R1145-C1155 PolarHBondContact NH2-SG 2.72Å; R1145-K1157 PolarHBondContact N-O 2.88Å; R1145-Y1159 HydrophobicContact CB-CD1 4.43Å
1146	D	86.5	Confident	86.2	Confident	23 Å²	23	48 Å²	48	12%	0.123	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-84.9	7.8	-172.3	-59.4	-5	0	0	0	113.1	L1144 H1148 L1149 S1153 C1155	L1144-D1146 VanDerWaalsContact C-N 3.29Å; L1144-D1146 PolarHBondContact O-N 2.74Å; D1146-H1148 PolarHBondContact O-N 2.78Å; D1146-L1149 HydrophobicContact CB-CD1 4.05Å; D1146-L1149 WeakPolarHBondContact O-CB 3.32Å; D1146-L1149 PolarHBondContact O-N 3Å; D1146-S1153 WeakPolarHBondContact OD2-CB 3.46Å; D1146-S1153 PolarHBondContact OD2-OG 3.45Å; D1146-C1155 VanDerWaalsContact OD2-CB 3.23Å; D1146-C1155 WeakPolarHBondContact OD2-CB 3.47Å
1147	A	80.2	Confident	86.2	Confident	36 Å²	36	48.4 Å²	48.4	30%	0.298	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-64.9	-19.4	-175.9	0	0	0	0	0	115.1	R1143 L1144 R1145	R1143-A1147 HydrophobicContact CG-CB 4.01Å; L1144-A1147 HydrophobicContact CB-CB 4.1Å; L1144-A1147 WeakPolarHBondContact O-CB 3.26Å; L1144-A1147 PolarHBondContact O-N 2.74Å; L1144-A1147 VanDerWaalsContact O-N 3.13Å; R1145-A1147 VanDerWaalsContact C-N 3.27Å; R1145-A1147 PolarHBondContact O-N 2.77Å
1148	H	76.4	Confident	86.2	Confident	55 Å²	55	50.2 Å²	50.2	26%	0.255	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-86.5	-10.5	176.7	62.9	-78.5	0	0	0	112.5	D587 R1145 D1146	D587-H1148 PolarHBondContact O-CD2 3.28Å; D587-H1148 PolarHBondContact O-NE2 2.75Å; R1145-H1148 PolarHBondContact O-CE1 3.05Å; R1145-H1148 PolarHBondContact O-ND1 3.2Å; D1146-H1148 PolarHBondContact O-N 2.78Å
1149	L	77.7	Confident	86.2	Confident	84 Å²	84	50.2 Å²	50.2	44%	0.44	29%	0.286	S	S	.	.	S	Bend	trans	-86.9	137.9	-177.9	-57.9	179	0	0	0	111.1	D1146 T1151	D1146-L1149 HydrophobicContact CB-CD1 4.05Å; D1146-L1149 WeakPolarHBondContact O-CB 3.32Å; D1146-L1149 PolarHBondContact O-N 3Å; L1149-T1151 PolarHBondContact O-N 3.26Å
1150	S	70.6	Confident	86.4	Confident	127 Å²	127	49.9 Å²	49.9	89%	0.888	29%	0.285	S	S	*	.	S	Bend	trans	-71.1	-12.8	178.4	56.5	0	0	0	0	114.2
1151	T	72.7	Confident	86.4	Confident	95 Å²	95	50 Å²	50	58%	0.583	29%	0.285	S	S	*	.	S	Bend	trans	-101.1	121.3	177	50.7	0	0	0	0	110.9	L1149 S1153	L1149-T1151 PolarHBondContact O-N 3.26Å; T1151-S1153 PolarHBondContact O-N 3.38Å
1152	P	73.3	Confident	86.4	Confident	129 Å²	129	50 Å²	50	84%	0.838	29%	0.285	S	S	*	.			trans	-69.1	103.8	-177.5	27.2	-34.2	0	0	0	112
1153	S	78.9	Confident	86.4	Confident	58 Å²	58	50.8 Å²	50.8	41%	0.406	29%	0.29	S	S	.	.			trans	-74.3	160.2	173.3	-178.4	0	0	0	0	112.2	D1146 T1151 C1155	D1146-S1153 WeakPolarHBondContact OD2-CB 3.46Å; D1146-S1153 PolarHBondContact OD2-OG 3.45Å; T1151-S1153 PolarHBondContact O-N 3.38Å; S1153-C1155 WeakPolarHBondContact OG-CB 3.27Å; S1153-C1155 PolarHBondContact OG-N 2.87Å; S1153-C1155 VanDerWaalsContact OG-N 3.09Å
1154	Q	79.2	Confident	86.4	Confident	173 Å²	173	49.9 Å²	49.9	81%	0.808	29%	0.287	S	S	*	.			trans	-93.8	-0.1	169.1	-65.1	-63.1	-64.8	0	0	112.8	T1156	Q1154-T1156 PolarHBondContact O-N 3.42Å
1155	C	84.4	Confident	86.4	Confident	31 Å²	31	50.8 Å²	50.8	21%	0.209	30%	0.295	C	S	.	.			trans	-69.4	114.8	-178.8	-169.3	0	0	0	0	111.3	R1145 D1146 S1153 K1157	R1145-C1155 PolarHBondContact NH2-SG 2.72Å; D1146-C1155 VanDerWaalsContact OD2-CB 3.23Å; D1146-C1155 WeakPolarHBondContact OD2-CB 3.47Å; S1153-C1155 WeakPolarHBondContact OG-CB 3.27Å; S1153-C1155 PolarHBondContact OG-N 2.87Å; S1153-C1155 VanDerWaalsContact OG-N 3.09Å; C1155-K1157 VanDerWaalsContact C-N 3.31Å
1156	T	87.5	Confident	86.5	Confident	70 Å²	70	51.8 Å²	51.8	43%	0.429	30%	0.299	S	S	.	.			trans	-87.5	3	178.5	65.2	0	0	0	0	113.6	N1002 L1144 Q1154	N1002-T1156 PolarHBondContact OD1-OG1 3.4Å; L1144-T1156 WeakPolarHBondContact CD2-O 3.35Å; Q1154-T1156 PolarHBondContact O-N 3.42Å
1157	K	91.6	Very high	86.9	Confident	35 Å²	35	57.2 Å²	57.2	15%	0.152	32%	0.323	C	S	.	.			trans	-63.4	140.6	178.1	-65.8	-177.9	-172.5	177.4	0	110.6	D1019 D1021 L1144 R1145 C1155	D1019-K1157 IonicContact OD1-NZ 3.8Å; D1019-K1157 PolarHBondContact OD1-NZ 3.33Å; D1019-K1157 WeakPolarHBondContact OD2-CE 3.41Å; D1019-K1157 IonicContact OD2-NZ 3.46Å; D1019-K1157 PolarHBondContact OD2-NZ 2.86Å; D1021-K1157 IonicContact OD1-NZ 2.72Å; D1021-K1157 PolarHBondContact OD1-NZ 3.39Å; D1021-K1157 IonicContact OD2-NZ 2.75Å; D1021-K1157 PolarHBondContact OD2-NZ 3.3Å; L1144-K1157 WeakPolarHBondContact CA-O 3.26Å; R1145-K1157 PolarHBondContact N-O 2.88Å; C1155-K1157 VanDerWaalsContact C-N 3.31Å
1158	R	94.7	Very high	87.6	Confident	38 Å²	38	56.3 Å²	56.3	14%	0.143	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	145.6	179.7	-67.6	171.9	177.5	-86.6	-2.4	109.8	C1038 Y1142 R1143 L1144 T1173	C1038-R1158 WeakPolarHBondContact CA-O 3.4Å; C1038-R1158 VanDerWaalsContact CB-O 3.25Å; C1038-R1158 WeakPolarHBondContact CB-O 3.14Å; C1038-R1158 PolarHBondContact SG-O 3.42Å; Y1142-R1158 HydrophobicContact CD1-CB 3.88Å; Y1142-R1158 HydrophobicContact CD1-CG 4.35Å; Y1142-R1158 HydrophobicContact CD2-CB 3.71Å; Y1142-R1158 HydrophobicContact CE1-CB 3.67Å; Y1142-R1158 HydrophobicContact CE1-CG 4.24Å; Y1142-R1158 HydrophobicContact CE2-CB 3.49Å; Y1142-R1158 VanDerWaalsContact CE2-CB 3.49Å; Y1142-R1158 VanDerWaalsContact CE2-O 3.27Å; Y1142-R1158 WeakPolarHBondContact CE2-O 3.48Å; Y1142-R1158 HydrophobicContact CG-CB 3.88Å; Y1142-R1158 VanDerWaalsContact CZ-CB 3.46Å; Y1142-R1158 PolarHBondContact O-NH1 2.95Å; R1143-R1158 CarbonylContact O-C 3.59Å; R1143-R1158 WeakPolarHBondContact O-CA 3.37Å; R1143-R1158 WeakPolarHBondContact O-CB 3.47Å; L1144-R1158 HydrophobicContact CD2-CG 3.71Å; L1144-R1158 HydrophobicContact CG-CG 4.07Å; R1158-T1173 VanDerWaalsContact CZ-O 3.25Å; R1158-T1173 PolarHBondContact NH1-O 2.87Å; R1158-T1173 PolarHBondContact NH2-O 3.5Å
1159	Y	95.9	Very high	88.4	Confident	1 Å²	1	60 Å²	60	0%	0.004	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	160.7	176	67.8	-81.3	0	0	0	110.9	W589 Y592 Y593 A1037 Y1142 R1143 R1145 I1161	W589-Y1159 HydrophobicContact CB-CD1 4Å; W589-Y1159 HydrophobicContact CB-CE1 3.74Å; W589-Y1159 HydrophobicContact CB-CE2 4.5Å; W589-Y1159 HydrophobicContact CB-CG 4.48Å; W589-Y1159 HydrophobicContact CE3-CD2 4.44Å; W589-Y1159 HydrophobicContact CE3-CG 4.29Å; W589-Y1159 WeakPolarHBondContact O-CE2 3.36Å; Y592-Y1159 WeakPolarHBondContact CB-OH 3.32Å; Y593-Y1159 HydrophobicContact CD2-CD2 4.43Å; A1037-Y1159 WeakPolarHBondContact O-CA 3.2Å; Y1142-Y1159 CarbonylContact C-O 3.59Å; Y1142-Y1159 WeakPolarHBondContact CA-O 3.29Å; R1143-Y1159 HydrophobicContact CB-CE1 4.09Å; R1143-Y1159 HydrophobicContact CG-CE1 3.98Å; R1143-Y1159 PolarHBondContact N-O 3.43Å; R1143-Y1159 VanDerWaalsContact O-CD1 3.29Å; R1143-Y1159 WeakPolarHBondContact O-CD1 3.41Å; R1143-Y1159 PolarHBondContact O-N 2.95Å; R1145-Y1159 HydrophobicContact CB-CD1 4.43Å; Y1159-I1161 HydrophobicContact CD2-CG1 4.04Å; Y1159-I1161 HydrophobicContact CE2-CD1 3.71Å; Y1159-I1161 HydrophobicContact CE2-CG1 3.59Å
1160	V	97.1	Very high	89.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	133.9	-172.7	175.9	0	0	0	0	111.7	G567 T570 M571 Y593 A1037 Y1142 F1177	G567-V1160 WeakPolarHBondContact O-CG2 3.42Å; T570-V1160 HydrophobicContact CG2-CB 4.42Å; T570-V1160 HydrophobicContact CG2-CG2 4.29Å; M571-V1160 HydrophobicContact CB-CG1 3.79Å; M571-V1160 HydrophobicContact CE-CG1 3.79Å; Y593-V1160 WeakPolarHBondContact CD2-O 3.42Å; Y593-V1160 HydrophobicContact CE2-CB 4.47Å; A1037-V1160 PolarHBondContact O-N 2.95Å; Y1142-V1160 HydrophobicContact CD2-CG2 4.08Å; Y1142-V1160 HydrophobicContact CE2-CG2 4.32Å; V1160-F1177 HydrophobicContact CG1-CE2 4.44Å; V1160-F1177 HydrophobicContact CG2-CZ 4.46Å
1161	I	96.8	Very high	90.1	Very high	1 Å²	1	52 Å²	52	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	108.8	170.2	-52.2	175.4	0	0	0	108.6	G1140 I1141 R1143 Y1159 P1164 F1168	G1140-I1161 CarbonylContact C-O 3.21Å; G1140-I1161 WeakPolarHBondContact CA-O 3.08Å; I1141-I1161 HydrophobicContact CB-CB 4.29Å; I1141-I1161 PolarHBondContact N-O 3.02Å; I1141-I1161 PolarHBondContact O-N 2.93Å; R1143-I1161 HydrophobicContact CB-CD1 4.14Å; Y1159-I1161 HydrophobicContact CD2-CG1 4.04Å; Y1159-I1161 HydrophobicContact CE2-CD1 3.71Å; Y1159-I1161 HydrophobicContact CE2-CG1 3.59Å; I1161-P1164 HydrophobicContact CG2-CB 4.05Å; I1161-P1164 HydrophobicContact CG2-CG 4.38Å; I1161-F1168 HydrophobicContact CD1-CE1 4.18Å; I1161-F1168 HydrophobicContact CD1-CZ 3.79Å
1162	T	96.1	Very high	90.9	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	134.9	177.2	9.8	0	0	0	0	111.8	M571 L575 G596	M571-T1162 HydrophobicContact CB-CG2 4.44Å; M571-T1162 HydrophobicContact CE-CG2 3.7Å; M571-T1162 HydrophobicContact CG-CG2 3.6Å; M571-T1162 HydrophobicContact SD-CG2 4.2Å; L575-T1162 HydrophobicContact CD2-CG2 3.98Å; L575-T1162 HydrophobicContact CG-CG2 4.31Å; G596-T1162 WeakPolarHBondContact CA-O 3.4Å; G596-T1162 WeakPolarHBondContact CA-OG1 3.44Å; G596-T1162 WeakPolarHBondContact O-CB 3.12Å; G596-T1162 PolarHBondContact O-OG1 3.49Å
1163	N	95.6	Very high	91.8	Very high	21 Å²	21	45.4 Å²	45.4	11%	0.112	24%	0.237	C	C	.	.	S	Bend	trans	43.8	53.2	170.6	-173.1	44.4	0	0	0	115.7	N599 L629 I667 F1139	N599-N1163 PolarHBondContact OD1-ND2 2.99Å; L629-N1163 VanDerWaalsContact CB-OD1 3.23Å; L629-N1163 WeakPolarHBondContact CB-OD1 3.49Å; L629-N1163 HydrophobicContact CD2-CB 4.06Å; L629-N1163 WeakPolarHBondContact CD2-OD1 3.32Å; I667-N1163 HydrophobicContact CG2-CB 3.74Å; F1139-N1163 PolarHBondContact O-N 3.26Å; F1139-N1163 VanDerWaalsContact O-N 3.12Å
1164	P	95.4	Very high	92.5	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.013	22%	0.218	C	C	.	.			trans	-63.5	152.6	-179.5	24.5	-31.4	0	0	0	112.3	Y1123 I1141 I1161 F1168	Y1123-P1164 HydrophobicContact CD1-CB 4.47Å; Y1123-P1164 HydrophobicContact CD1-CG 3.79Å; Y1123-P1164 HydrophobicContact CD2-CG 4Å; Y1123-P1164 HydrophobicContact CE1-CG 3.81Å; Y1123-P1164 HydrophobicContact CE2-CG 4.01Å; Y1123-P1164 HydrophobicContact CG-CG 3.89Å; I1141-P1164 HydrophobicContact CD1-CB 4.33Å; I1141-P1164 HydrophobicContact CD1-CG 3.73Å; I1141-P1164 HydrophobicContact CG1-CG 3.97Å; I1161-P1164 HydrophobicContact CG2-CB 4.05Å; I1161-P1164 HydrophobicContact CG2-CG 4.38Å; P1164-F1168 HydrophobicContact CB-CB 4Å; P1164-F1168 HydrophobicContact CB-CD1 4.02Å; P1164-F1168 HydrophobicContact CB-CD2 4.03Å; P1164-F1168 HydrophobicContact CB-CG 3.76Å
1165	P	93.6	Very high	93.2	Very high	53 Å²	53	36.3 Å²	36.3	34%	0.344	19%	0.189	S	C	.	.			trans	-65.9	165	-176.5	26.4	-34.6	0	0	0	113.2	E595 E1167 F1168	E595-P1165 WeakPolarHBondContact OE1-CD 3.49Å; E595-P1165 WeakPolarHBondContact OE1-CG 3.43Å; P1165-E1167 VanDerWaalsContact C-N 3.34Å; P1165-E1167 PolarHBondContact O-N 3.02Å; P1165-F1168 HydrophobicContact CG-CB 4.09Å; P1165-F1168 HydrophobicContact CG-CD2 4.12Å; P1165-F1168 WeakPolarHBondContact O-CB 3.28Å; P1165-F1168 PolarHBondContact O-N 2.91Å; P1165-F1168 VanDerWaalsContact O-N 3.13Å
1166	Y	92.6	Very high	93.8	Very high	55 Å²	55	34.9 Å²	34.9	22%	0.216	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-46.1	-177.6	-166.9	-83.7	0	0	0	113	F623 V624 G1124 D1125 F1168	F623-Y1166 AromaticContact CD1-CD2 3.94Å; F623-Y1166 HydrophobicContact CD1-CD2 3.94Å; F623-Y1166 HydrophobicContact CD1-CE2 4.46Å; F623-Y1166 AromaticContact CE1-CD2 3.71Å; F623-Y1166 HydrophobicContact CE1-CD2 3.71Å; F623-Y1166 HydrophobicContact CE1-CE2 4.45Å; V624-Y1166 HydrophobicContact CG2-CE2 3.98Å; G1124-Y1166 VanDerWaalsContact CA-CD2 3.46Å; G1124-Y1166 VanDerWaalsContact CA-CE2 3.42Å; G1124-Y1166 PolarHBondContact N-O 3.39Å; D1125-Y1166 PolarHBondContact OD1-OH 3.39Å; Y1166-F1168 PolarHBondContact O-N 2.84Å
1167	E	94.1	Very high	94.2	Very high	137 Å²	137	31.6 Å²	31.6	64%	0.64	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.1	13.8	-178.4	-40.5	-58.7	149.4	0	0	113.5	P1165 E1169	P1165-E1167 VanDerWaalsContact C-N 3.34Å; P1165-E1167 PolarHBondContact O-N 3.02Å; E1167-E1169 PolarHBondContact O-N 2.84Å
1168	F	94.6	Very high	94.4	Very high	16 Å²	16	29.9 Å²	29.9	7%	0.07	15%	0.152	C	C	.	.	P	Polyproline II helix	trans	-73.2	120.5	-177.2	-165.3	-92.8	0	0	0	110.8	Y592 Y1123 I1141 R1143 I1161 P1164 P1165 Y1166	Y592-F1168 AromaticContact CD1-CE2 3.84Å; Y592-F1168 HydrophobicContact CD1-CE2 3.84Å; Y592-F1168 AromaticContact CD1-CZ 3.94Å; Y592-F1168 HydrophobicContact CD1-CZ 3.94Å; Y592-F1168 HydrophobicContact CE1-CE2 4.32Å; Y592-F1168 HydrophobicContact CE1-CZ 4.49Å; Y1123-F1168 PolarHBondContact N-O 2.92Å; I1141-F1168 HydrophobicContact CD1-CD1 3.57Å; I1141-F1168 HydrophobicContact CD1-CE1 3.61Å; R1143-F1168 VanDerWaalsContact NH1-CE1 3.33Å; I1161-F1168 HydrophobicContact CD1-CE1 4.18Å; I1161-F1168 HydrophobicContact CD1-CZ 3.79Å; P1164-F1168 HydrophobicContact CB-CB 4Å; P1164-F1168 HydrophobicContact CB-CD1 4.02Å; P1164-F1168 HydrophobicContact CB-CD2 4.03Å; P1164-F1168 HydrophobicContact CB-CG 3.76Å; P1165-F1168 HydrophobicContact CG-CB 4.09Å; P1165-F1168 HydrophobicContact CG-CD2 4.12Å; P1165-F1168 WeakPolarHBondContact O-CB 3.28Å; P1165-F1168 PolarHBondContact O-N 2.91Å; P1165-F1168 VanDerWaalsContact O-N 3.13Å; Y1166-F1168 PolarHBondContact O-N 2.84Å
1169	E	93.4	Very high	94.3	Very high	133 Å²	133	28.2 Å²	28.2	62%	0.621	15%	0.146	S	C	*	.	B	Isolated β-bridge	trans	-67.3	131.9	-178.9	-175.3	174	-172.6	0	0	111.7	R1143 E1167	R1143-E1169 PolarHBondContact NH2-O 3.2Å; E1167-E1169 PolarHBondContact O-N 2.84Å
1170	L	93.1	Very high	94.1	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.01	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-92.3	145.8	176.4	-64.3	172.5	0	0	0	111.5	L1109 G1120 G1121 Y1123 L1126 I1141 I1176	L1109-L1170 HydrophobicContact CD1-CB 4.17Å; L1109-L1170 HydrophobicContact CD1-CD1 4.18Å; L1109-L1170 HydrophobicContact CD1-CD2 4.22Å; L1109-L1170 HydrophobicContact CD1-CG 4.43Å; G1120-L1170 PolarHBondContact N-O 3.21Å; G1121-L1170 WeakPolarHBondContact O-CB 3.33Å; G1121-L1170 WeakPolarHBondContact O-CG 3.34Å; G1121-L1170 PolarHBondContact O-N 3.06Å; Y1123-L1170 HydrophobicContact CD2-CD2 4.25Å; L1126-L1170 HydrophobicContact CB-CD1 3.95Å; L1126-L1170 HydrophobicContact CD2-CD1 3.81Å; L1126-L1170 HydrophobicContact CD2-CD2 4.39Å; L1126-L1170 HydrophobicContact CG-CD1 4.47Å; I1141-L1170 HydrophobicContact CD1-CD2 3.89Å; L1170-I1176 HydrophobicContact CD2-CD1 4.25Å
1171	V	91.4	Very high	93.7	Very high	40 Å²	40	32.2 Å²	32.2	24%	0.242	17%	0.165	C	C	.	.			trans	-111.3	137.2	172.3	-177.6	0	0	0	0	107.4	G1118 T1173 D1174	G1118-V1171 CarbonylContact O-C 3.55Å; V1171-T1173 WeakPolarHBondContact CG1-OG1 3.44Å; V1171-T1173 PolarHBondContact O-N 3.46Å; V1171-D1174 PolarHBondContact N-OD2 2.8Å; V1171-D1174 VanDerWaalsContact N-OD2 3.07Å; V1171-D1174 VanDerWaalsContact O-CB 3.29Å; V1171-D1174 WeakPolarHBondContact O-CB 3.36Å; V1171-D1174 PolarHBondContact O-N 3.25Å
1172	P	89.8	Confident	93.2	Very high	42 Å²	42	32.7 Å²	32.7	27%	0.273	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-19.7	-171.2	25	-34.4	0	0	0	113.2	L1109 L1110 G1118 D1174	L1109-P1172 CarbonylContact C-O 3.43Å; L1109-P1172 WeakPolarHBondContact CB-O 3.31Å; L1110-P1172 HydrophobicContact CD2-CB 4.39Å; L1110-P1172 VanDerWaalsContact CD2-O 3.29Å; L1110-P1172 WeakPolarHBondContact CD2-O 3.48Å; L1110-P1172 VanDerWaalsContact CG-O 3.3Å; L1110-P1172 WeakPolarHBondContact CG-O 3.45Å; L1110-P1172 PolarHBondContact N-O 2.86Å; L1110-P1172 VanDerWaalsContact N-O 3.16Å; G1118-P1172 WeakPolarHBondContact O-CD 3.2Å; G1118-P1172 VanDerWaalsContact O-N 3.12Å; P1172-D1174 VanDerWaalsContact C-N 3.31Å; P1172-D1174 PolarHBondContact O-N 3.2Å
1173	T	91	Very high	92.2	Very high	45 Å²	45	36.3 Å²	36.3	28%	0.276	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-5.7	173.5	54.7	0	0	0	0	114.7	L1110 L1144 R1158 V1171	L1110-T1173 HydrophobicContact CD2-CG2 4.32Å; L1144-T1173 HydrophobicContact CD1-CG2 4.35Å; R1158-T1173 VanDerWaalsContact CZ-O 3.25Å; R1158-T1173 PolarHBondContact NH1-O 2.87Å; R1158-T1173 PolarHBondContact NH2-O 3.5Å; V1171-T1173 WeakPolarHBondContact CG1-OG1 3.44Å; V1171-T1173 PolarHBondContact O-N 3.46Å
1174	D	93.7	Very high	90.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.204	C	C	.	.			trans	-67.6	149.7	-177	-74.1	-29.1	0	0	0	112.7	L1109 I1141 R1143 V1171 P1172 I1176	L1109-D1174 HydrophobicContact CD1-CB 4.2Å; L1109-D1174 PolarHBondContact N-O 2.8Å; I1141-D1174 HydrophobicContact CG2-CB 3.92Å; R1143-D1174 WeakPolarHBondContact CA-OD1 3.47Å; R1143-D1174 WeakPolarHBondContact CB-OD1 3.22Å; R1143-D1174 WeakPolarHBondContact CG-OD1 3.23Å; R1143-D1174 IonicContact CZ-OD2 2.72Å; R1143-D1174 IonicContact NE-OD1 2.73Å; R1143-D1174 PolarHBondContact NE-OD1 3.33Å; R1143-D1174 IonicContact NE-OD2 3.29Å; R1143-D1174 PolarHBondContact NE-OD2 3.47Å; R1143-D1174 VanDerWaalsContact NE-OD2 3.17Å; R1143-D1174 IonicContact NH2-OD2 2.84Å; R1143-D1174 PolarHBondContact NH2-OD2 2.95Å; V1171-D1174 PolarHBondContact N-OD2 2.8Å; V1171-D1174 VanDerWaalsContact N-OD2 3.07Å; V1171-D1174 VanDerWaalsContact O-CB 3.29Å; V1171-D1174 WeakPolarHBondContact O-CB 3.36Å; V1171-D1174 PolarHBondContact O-N 3.25Å; P1172-D1174 VanDerWaalsContact C-N 3.31Å; P1172-D1174 PolarHBondContact O-N 3.2Å; D1174-I1176 HydrophobicContact CB-CD1 4.44Å
1175	L	95.4	Very high	88.2	Confident	40 Å²	40	45.3 Å²	45.3	21%	0.209	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135.9	167	-60.7	-179.6	0	0	0	108.6	L1107 A1108 Y1142	L1107-L1175 CarbonylContact O-C 3.58Å; L1107-L1175 WeakPolarHBondContact O-CA 3.36Å; A1108-L1175 HydrophobicContact CB-CD2 3.7Å; Y1142-L1175 HydrophobicContact CD1-CB 4.39Å; Y1142-L1175 HydrophobicContact CD1-CD1 4.15Å; Y1142-L1175 PolarHBondContact N-O 3.26Å; Y1142-L1175 PolarHBondContact O-N 3.08Å
1176	I	95.9	Very high	86.1	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	124.2	-171.5	-54.8	-64.9	0	0	0	110.1	Q1106 L1107 L1109 L1126 C1138 I1141 L1170 D1174 C1178	Q1106-I1176 WeakPolarHBondContact CA-O 3.21Å; L1107-I1176 PolarHBondContact N-O 2.84Å; L1107-I1176 PolarHBondContact O-N 3.39Å; L1109-I1176 HydrophobicContact CD1-CD1 4.19Å; L1109-I1176 HydrophobicContact CD1-CG1 4.2Å; L1109-I1176 HydrophobicContact CD2-CG1 3.96Å; L1109-I1176 HydrophobicContact CG-CD1 4.49Å; L1109-I1176 HydrophobicContact CG-CG1 3.97Å; L1126-I1176 HydrophobicContact CD2-CD1 4Å; L1126-I1176 HydrophobicContact CD2-CG1 3.91Å; L1126-I1176 HydrophobicContact CD2-CG2 4.28Å; C1138-I1176 HydrophobicContact CB-CG2 4.03Å; I1141-I1176 HydrophobicContact CB-CD1 4.36Å; I1141-I1176 HydrophobicContact CG1-CD1 3.78Å; I1141-I1176 HydrophobicContact CG2-CD1 4.2Å; L1170-I1176 HydrophobicContact CD2-CD1 4.25Å; D1174-I1176 HydrophobicContact CB-CD1 4.44Å; I1176-C1178 PolarHBondContact O-N 3.34Å
1177	F	96.9	Very high	83.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	123.4	173.9	-68.4	-80.5	0	0	0	110.1	A565 Q566 L568 M571 Q1106 C1138 F1139 G1140 Y1142 V1160	A565-F1177 HydrophobicContact CB-CD1 4.13Å; A565-F1177 HydrophobicContact CB-CE1 4.1Å; Q566-F1177 WeakPolarHBondContact O-CE1 3.36Å; Q566-F1177 WeakPolarHBondContact O-CZ 3.19Å; L568-F1177 HydrophobicContact CB-CE1 4.24Å; L568-F1177 HydrophobicContact CD1-CD1 3.84Å; L568-F1177 HydrophobicContact CD1-CE1 4.07Å; M571-F1177 HydrophobicContact CE-CB 4.49Å; M571-F1177 HydrophobicContact CE-CD2 3.49Å; M571-F1177 VanDerWaalsContact CE-CD2 3.49Å; M571-F1177 HydrophobicContact CE-CE2 3.76Å; M571-F1177 HydrophobicContact CE-CG 4.08Å; M571-F1177 HydrophobicContact SD-CB 4.4Å; M571-F1177 HydrophobicContact SD-CD2 4.13Å; M571-F1177 HydrophobicContact SD-CE2 4.47Å; M571-F1177 HydrophobicContact SD-CG 4.14Å; Q1106-F1177 HydrophobicContact CG-CD1 4.06Å; Q1106-F1177 HydrophobicContact CG-CE1 4.25Å; C1138-F1177 WeakPolarHBondContact CA-O 3.26Å; F1139-F1177 HydrophobicContact CD1-CB 4.39Å; F1139-F1177 WeakPolarHBondContact CD1-O 3.3Å; F1139-F1177 HydrophobicContact CD2-CB 4.36Å; F1139-F1177 HydrophobicContact CE1-CB 4.1Å; F1139-F1177 HydrophobicContact CE2-CB 4.09Å; F1139-F1177 HydrophobicContact CZ-CB 3.95Å; F1139-F1177 PolarHBondContact N-O 2.86Å; G1140-F1177 PolarHBondContact O-N 3.46Å; Y1142-F1177 HydrophobicContact CD2-CE2 4.39Å; Y1142-F1177 HydrophobicContact CD2-CZ 4.29Å; Y1142-F1177 HydrophobicContact CG-CE2 4.23Å; Y1142-F1177 HydrophobicContact CG-CZ 4.17Å; V1160-F1177 HydrophobicContact CG1-CE2 4.44Å; V1160-F1177 HydrophobicContact CG2-CZ 4.46Å
1178	C	94.8	Very high	80.3	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	156	179.2	78.7	0	0	0	0	114.1	A1105 L1107 L1137 I1176	A1105-C1178 PolarHBondContact N-O 3.32Å; A1105-C1178 PolarHBondContact O-N 2.93Å; L1107-C1178 HydrophobicContact CD1-CB 4.32Å; L1137-C1178 CarbonylContact O-C 3.33Å; L1137-C1178 VanDerWaalsContact O-CA 3.24Å; L1137-C1178 WeakPolarHBondContact O-CA 3.1Å; I1176-C1178 PolarHBondContact O-N 3.34Å
1179	L	94	Very high	77.1	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.016	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	101.6	169.4	-68	169.8	0	0	0	109	I631 I650 N651 L1067 C1102 R1103 V1104 M1136 L1137 F1139	I631-L1179 HydrophobicContact CG2-CD1 4.01Å; I650-L1179 HydrophobicContact CG2-CD1 3.63Å; I650-L1179 HydrophobicContact CG2-CD2 4.2Å; N651-L1179 HydrophobicContact CB-CB 4.11Å; N651-L1179 HydrophobicContact CB-CD1 3.91Å; N651-L1179 PolarHBondContact ND2-O 3Å; N651-L1179 VanDerWaalsContact ND2-O 3.11Å; L1067-L1179 HydrophobicContact CD1-CD2 4.18Å; C1102-L1179 HydrophobicContact CB-CB 4.19Å; C1102-L1179 HydrophobicContact CB-CD2 4.43Å; R1103-L1179 WeakPolarHBondContact O-CA 3.46Å; V1104-L1179 HydrophobicContact CG2-CD2 3.9Å; M1136-L1179 WeakPolarHBondContact CA-O 3.29Å; L1137-L1179 HydrophobicContact CB-CB 4.32Å; L1137-L1179 HydrophobicContact CD2-CD1 4.17Å; L1137-L1179 PolarHBondContact N-O 3.05Å; L1137-L1179 PolarHBondContact O-N 3.06Å; F1139-L1179 HydrophobicContact CD1-CG 4.16Å; F1139-L1179 HydrophobicContact CE1-CD2 4.26Å; F1139-L1179 HydrophobicContact CE1-CG 3.82Å
1180	M	90.9	Very high	74.1	Confident	40 Å²	40	49.8 Å²	49.8	20%	0.197	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	138.9	175.2	-58	179.7	86.8	0	0	110.7	C1102 R1103 A1105 M1136	C1102-M1180 CarbonylContact C-O 3.53Å; C1102-M1180 WeakPolarHBondContact CA-O 3.37Å; C1102-M1180 PolarHBondContact SG-O 2.8Å; R1103-M1180 HydrophobicContact CG-CB 4.04Å; R1103-M1180 PolarHBondContact N-O 3.43Å; R1103-M1180 PolarHBondContact O-N 2.86Å; A1105-M1180 HydrophobicContact CB-CG 3.94Å; A1105-M1180 HydrophobicContact CB-SD 3.49Å; A1105-M1180 WeakPolarHBondContact CB-SD 3.27Å; M1136-M1180 HydrophobicContact CE-CE 3.52Å; M1136-M1180 HydrophobicContact CE-CG 4.32Å
1181	Q	89.3	Confident	71	Confident	44 Å²	44	53.5 Å²	53.5	21%	0.206	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-67.5	162.4	168.2	-57.2	-61.9	-21.5	0	0	111.4	N651 C1102 N1135	N651-Q1181 PolarHBondContact ND2-NE2 2.88Å; N651-Q1181 PolarHBondContact O-NE2 3.18Å; C1102-Q1181 VanDerWaalsContact SG-CD 3.52Å; C1102-Q1181 PolarHBondContact SG-OE1 3.32Å; C1102-Q1181 VanDerWaalsContact SG-OE1 3.39Å; N1135-Q1181 HydrophobicContact CB-CG 3.84Å; N1135-Q1181 PolarHBondContact O-NE2 2.97Å; N1135-Q1181 VanDerWaalsContact O-NE2 3.11Å
1182	F	84.9	Confident	68	Low	11 Å²	11	55.7 Å²	55.7	5%	0.048	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-85.6	118.1	170.2	-178	-102.2	0	0	0	110.6	N872 H874 H1184	N872-F1182 VanDerWaalsContact O-CD2 3.29Å; N872-F1182 WeakPolarHBondContact O-CD2 3.32Å; H874-F1182 AromaticContact CE1-CE2 3.38Å; H874-F1182 WeakPolarHBondContact CE1-CE2 3.33Å; H874-F1182 AromaticContact CE1-CZ 3.57Å; H874-F1182 AromaticContact ND1-CE2 3.84Å; H874-F1182 AromaticContact NE2-CE2 3.77Å; H874-F1182 AromaticContact NE2-CZ 3.49Å; H874-F1182 WeakPolarHBondContact NE2-CZ 3.34Å; F1182-H1184 AromaticContact CD1-CE1 4Å; F1182-H1184 AromaticContact CE1-CE1 3.94Å; F1182-H1184 AromaticContact CE1-ND1 3.77Å
1183	D	75.8	Confident	65	Low	78 Å²	78	60.7 Å²	60.7	42%	0.417	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-88.3	125.9	172.2	177.1	32.8	0	0	0	111.4	H874 N1185 A1186	H874-D1183 PolarHBondContact CE1-O 3.33Å; H874-D1183 VanDerWaalsContact CE1-O 3.31Å; D1183-N1185 WeakPolarHBondContact OD1-CB 3.21Å; D1183-N1185 PolarHBondContact OD1-N 2.81Å; D1183-A1186 WeakPolarHBondContact OD2-CB 3.43Å; D1183-A1186 PolarHBondContact OD2-N 3.19Å
1184	H	61.7	Low	62	Low	105 Å²	105	62.8 Å²	62.8	49%	0.486	36%	0.355	S	S	.	.	S	Bend	trans	-76.8	-23.6	174.8	-70.1	-85	0	0	0	113.4	F1182	F1182-H1184 AromaticContact CD1-CE1 4Å; F1182-H1184 AromaticContact CE1-CE1 3.94Å; F1182-H1184 AromaticContact CE1-ND1 3.77Å
1185	N	46.3	Very low	59	Low	106 Å²	106	71.6 Å²	71.6	57%	0.567	40%	0.396	S	S	*	.	S	Bend	trans	-86.1	-28	-170.3	-65.3	-38.5	0	0	0	113.7	D1183 G1187 Q1188 S1189	D1183-N1185 WeakPolarHBondContact OD1-CB 3.21Å; D1183-N1185 PolarHBondContact OD1-N 2.81Å; N1185-G1187 PolarHBondContact O-N 3.44Å; N1185-Q1188 PolarHBondContact O-N 3.23Å; N1185-S1189 PolarHBondContact O-N 2.8Å
1186	A	47.9	Very low	55.6	Low	39 Å²	39	75.3 Å²	75.3	32%	0.322	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-26.2	175.6	0	0	0	0	0	114.4	D1183 S1189	D1183-A1186 WeakPolarHBondContact OD2-CB 3.43Å; D1183-A1186 PolarHBondContact OD2-N 3.19Å; A1186-S1189 PolarHBondContact O-OG 3.31Å
1187	G	35	Very low	52.2	Low	44 Å²	44	80.3 Å²	80.3	45%	0.454	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-26.6	175.3	0	0	0	0	0	115.3	N1185	N1185-G1187 PolarHBondContact O-N 3.44Å
1188	Q	31.2	Very low	48.9	Very low	145 Å²	145	89.1 Å²	89.1	68%	0.678	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-32.5	-174.8	-68.4	-173.4	-11.3	0	0	112.9	N1185 R1190 A1191	N1185-Q1188 PolarHBondContact O-N 3.23Å; Q1188-R1190 PolarHBondContact O-N 2.96Å; Q1188-R1190 VanDerWaalsContact O-N 3.12Å; Q1188-A1191 PolarHBondContact O-N 3.47Å
1189	S	26.7	Very low	45.6	Very low	67 Å²	67	94.9 Å²	94.9	47%	0.469	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-17.2	-172.8	55.5	0	0	0	0	115.5	N1185 A1186	N1185-S1189 PolarHBondContact O-N 2.8Å; A1186-S1189 PolarHBondContact O-OG 3.31Å
1190	R	31.5	Very low	42.4	Very low	194 Å²	194	100.8 Å²	100.8	73%	0.732	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-17.8	172.6	-90.4	-177.8	166.2	167.6	-3.2	114.6	Q1188	Q1188-R1190 PolarHBondContact O-N 2.96Å; Q1188-R1190 VanDerWaalsContact O-N 3.12Å
1191	A	28	Very low	39.3	Very low	80 Å²	80	107.7 Å²	107.7	66%	0.661	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-22.5	-179	0	0	0	0	0	113.1	Q1188	Q1188-A1191 PolarHBondContact O-N 3.47Å
1192	S	26.9	Very low	36.3	Very low	85 Å²	85	111.6 Å²	111.6	59%	0.594	65%	0.647	S	S	*	*	S	Bend	trans	-96.3	-6.5	-176.8	51.6	0	0	0	0	114.9
1193	L	28.1	Very low	33.5	Very low	147 Å²	147	117 Å²	117	77%	0.77	69%	0.686	S	S	*	*	S	Bend	trans	-86.2	-6.7	-178	-86.9	167.7	0	0	0	114.5
1194	S	27.1	Very low	31.2	Very low	89 Å²	89	118.4 Å²	118.4	62%	0.622	70%	0.702	S	S	*	*	S	Bend	trans	-106.1	45.5	179.7	63.8	0	0	0	0	113.5
1195	H	30.4	Very low	29.5	Very low	186 Å²	186	122.8 Å²	122.8	86%	0.861	72%	0.72	S	S	*	*	S	Bend	trans	-177.5	83.4	153.6	-91.2	-54.1	0	0	0	111.8
1196	S	24.5	Very low	28.7	Very low	117 Å²	117	127.3 Å²	127.3	82%	0.818	73%	0.734	S	S	*	*			trans	-174.6	90.7	153.2	34.2	0	0	0	0	113.3
1197	S	23.8	Very low	27.6	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	75%	0.752	S	S	*	*			trans	-132.3	132.6	161.9	51.9	0	0	0	0	109.4
1198	H	27.6	Very low	27.3	Very low	185 Å²	185	133.4 Å²	133.4	86%	0.856	77%	0.768	S	S	*	*			trans	84.3	88.3	-173.6	-55.6	-73.3	0	0	0	118.2
1199	S	25.4	Very low	27.2	Very low	121 Å²	121	131.4 Å²	131.4	85%	0.846	77%	0.77	S	S	*	*				-169.2	89.5	127.4	31.3	0	0	0	0	111.3	Q1201	S1199-Q1201 PolarHBondContact O-N 2.93Å
1200	S	27.8	Very low	27.3	Very low	127 Å²	127	133.8 Å²	133.8	89%	0.888	78%	0.781	S	S	*	*			trans	-84.8	85	177.2	56	0	0	0	0	111.6
1201	Q	26.7	Very low	27.2	Very low	185 Å²	185	133 Å²	133	86%	0.864	79%	0.785	S	S	*	*			trans	-129.3	89.2	169.7	-83	-173.1	-22.1	0	0	111.7	S1199 S1203	S1199-Q1201 PolarHBondContact O-N 2.93Å; Q1201-S1203 PolarHBondContact O-N 3.26Å
1202	S	25.1	Very low	27.2	Very low	127 Å²	127	133.4 Å²	133.4	89%	0.888	78%	0.783	S	S	*	*			trans	-74.3	119.4	169	55.9	0	0	0	0	110.6
1203	S	25.8	Very low	27.3	Very low	124 Å²	124	136.8 Å²	136.8	87%	0.867	79%	0.793	S	S	*	*			trans	-126	144.6	164.2	70.1	0	0	0	0	110.4	Q1201	Q1201-S1203 PolarHBondContact O-N 3.26Å
1204	S	27.3	Very low	27.7	Very low	108 Å²	108	135.4 Å²	135.4	76%	0.755	79%	0.793	S	S	*	*			trans	-105.3	153.9	-161.4	60.1	0	0	0	0	113.7
1205	K	27.7	Very low	27.7	Very low	197 Å²	197	135.2 Å²	135.2	86%	0.857	79%	0.791	S	S	*	*			trans	-173.4	114	141.7	-100.7	146.1	-171	175	0	113.4
1206	K	28.2	Very low	27.6	Very low	200 Å²	200	132.8 Å²	132.8	87%	0.87	79%	0.79	S	S	*	*			trans	59.5	149.7	133.5	-70.6	-174.2	178.5	-173.1	0	119.6
1207	S	25.1	Very low	27.8	Very low	99 Å²	99	131 Å²	131	69%	0.692	78%	0.782	S	S	*	*			cis	-159.7	157.7	8.3	35.9	0	0	0	0	114.3
1208	S	28.6	Very low	28.1	Very low	113 Å²	113	133.6 Å²	133.6	79%	0.79	79%	0.788	S	S	*	*			trans	66.2	144	150.6	41.7	0	0	0	0	119.5
1209	S	29.6	Very low	28	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	79%	0.79	S	S	*	*			cis	-153.2	133.7	6.5	45.3	0	0	0	0	115.5
1210	V	27.6	Very low	29	Very low	116 Å²	116	135 Å²	135	70%	0.703	78%	0.78	S	S	*	*			trans	59.4	102.1	130.3	-173.7	0	0	0	0	120.1
1211	H	31	Very low	29	Very low	178 Å²	178	136.4 Å²	136.4	82%	0.824	78%	0.777	S	S	*	*				-163.3	-176.1	99.8	-107	-58.4	0	0	0	111
1212	S	26.9	Very low	29	Very low	88 Å²	88	138.5 Å²	138.5	62%	0.615	78%	0.777	S	S	*	*			trans	-144.4	130.6	-143.5	54.2	0	0	0	0	117.8
1213	I	28.3	Very low	29.7	Very low	157 Å²	157	137.6 Å²	137.6	81%	0.805	77%	0.768	S	S	*	*				60.8	140.3	127.4	-64.3	173.7	0	0	0	119.1
1214	P	38.4	Very low	29.7	Very low	117 Å²	117	140.4 Å²	140.4	76%	0.76	77%	0.765	S	S	*	*			cis	-118.5	-132.2	-4.3	30.6	-6.3	0	0	0	110.7
1215	S	25.9	Very low	29.7	Very low	85 Å²	85	140.1 Å²	140.1	59%	0.594	76%	0.763	S	S	*	*			cis	-166.8	152.7	-4.4	30.4	0	0	0	0	112.3
1216	T	27.5	Very low	29.6	Very low	135 Å²	135	141.5 Å²	141.5	83%	0.828	76%	0.763	S	S	*	*			trans	57	142.3	150.7	51.4	0	0	0	0	121.4
1217	A	29.4	Very low	29.6	Very low	80 Å²	80	139.2 Å²	139.2	66%	0.661	76%	0.755	S	S	*	*			cis	-165.6	163.4	-11.8	0	0	0	0	0	112.8
1218	N	29.5	Very low	29.6	Very low	160 Å²	160	140.2 Å²	140.2	86%	0.856	76%	0.762	S	S	*	*			trans	59.9	111.4	150.6	-63.1	-7.5	0	0	0	123.9
1219	R	26	Very low	29.7	Very low	238 Å²	238	144.9 Å²	144.9	90%	0.898	76%	0.762	S	S	*	*			trans	-31	172.3	137.1	-83.3	-179	170.8	-176.6	-2.6	116.8
1220	P	46.7	Very low	29.8	Very low	98 Å²	98	145.7 Å²	145.7	64%	0.636	76%	0.758	S	S	*	*			cis	-146.1	-166.7	-30.3	40.6	-20.7	0	0	0	115.4
1221	N	27.6	Very low	29.9	Very low	156 Å²	156	148.8 Å²	148.8	83%	0.834	76%	0.762	S	S	*	*			trans	100.9	128.3	145.6	-74.6	-8.4	0	0	0	123.9
1222	R	26.8	Very low	29.8	Very low	230 Å²	230	147.7 Å²	147.7	87%	0.868	76%	0.758	S	S	*	*			trans	-38	168.2	146.8	-101.9	-179.9	167	178	-3	114.9
1223	P	39.1	Very low	29.8	Very low	108 Å²	108	151.3 Å²	151.3	70%	0.701	76%	0.763	S	S	*	*			cis	-152.7	170.8	36.1	43.8	-23.2	0	0	0	121.1
1224	K	26.8	Very low	29.9	Very low	183 Å²	183	151.5 Å²	151.5	80%	0.796	76%	0.757	S	S	*	*			trans	46.9	124.7	137.7	-73	-177	175.4	-175.7	0	124.1
1225	S	27.2	Very low	29.5	Very low	102 Å²	102	151.6 Å²	151.6	71%	0.713	75%	0.748	S	S	*	*				22.3	143.4	127	66.2	0	0	0	0	120.9
1226	R	26.3	Very low	29.7	Very low	225 Å²	225	154.7 Å²	154.7	85%	0.849	76%	0.755	S	S	*	*				-171.5	176	70.3	-161.5	166.6	-174.5	172.5	3.4	113.4
1227	E	26.7	Very low	29.9	Very low	152 Å²	152	153.2 Å²	153.2	71%	0.71	75%	0.745	S	S	*	*			trans	-77.7	160.7	-175.8	-36.6	114.5	99.8	0	0	115.6
1228	S	26.4	Very low	30	Very low	120 Å²	120	159.4 Å²	159.4	84%	0.839	75%	0.753	S	S	*	*				150.5	166.8	121.9	56.7	0	0	0	0	113.1
1229	R	29.6	Very low	30.3	Very low	212 Å²	212	166.1 Å²	166.1	80%	0.8	77%	0.766	S	S	*	*				-166.6	159.5	-54.5	-153.5	-169	154.3	145.7	4.8	107.6
1230	D	32.4	Very low	30.5	Very low	119 Å²	119	162.6 Å²	162.6	64%	0.636	76%	0.76	S	S	*	*			trans	63.3	125.9	158.1	-55.6	-37.9	0	0	0	120.9
1231	K	28.8	Very low	29.6	Very low	181 Å²	181	165.9 Å²	165.9	79%	0.787	77%	0.766	S	S	*	*				-166.4	119.2	101.2	-104.6	169.2	-175.1	171.5	0	114.8
1232	Q	29.7	Very low	29.7	Very low	155 Å²	155	166.5 Å²	166.5	72%	0.724	76%	0.763	S	S	*	*			trans	67.1	144.3	136.8	-69.1	179.3	9.8	0	0	118.9
1233	K	27.7	Very low	29.9	Very low	165 Å²	165	162.8 Å²	162.8	72%	0.717	76%	0.756	S	S	*	*			cis	-154.6	140.8	21.3	-129.3	160.3	-169.9	179.9	0	111.2
1234	K	30.1	Very low	29.3	Very low	160 Å²	160	166.2 Å²	166.2	70%	0.696	76%	0.76	S	S	*	*			trans	44.3	147.6	133.6	-71	-174.4	149.8	-147.1	0	120.7
1235	E	29.6	Very low	29.5	Very low	119 Å²	119	165.1 Å²	165.1	56%	0.556	76%	0.757	S	S	*	*			cis	-156.5	135.6	11.3	-119.8	154.4	169.1	0	0	109.2
1236	M	29.6	Very low	29.7	Very low	151 Å²	151	169.6 Å²	169.6	74%	0.744	76%	0.761	S	S	*	*				70.7	139.9	97.4	-75.3	-144.3	-71.3	0	0	117.1
1237	V	31.9	Very low	29.9	Very low	104 Å²	104	165.3 Å²	165.3	63%	0.63	75%	0.754	S	S	*	*			cis	-166.8	144.2	-13.2	89.3	0	0	0	0	112.3
1238	Y	31.2	Very low	30.2	Very low	210 Å²	210	166.4 Å²	166.4	82%	0.824	76%	0.757	S	S	*	*			trans	55.9	164.6	164.7	-72.5	-81.8	0	0	0	118.1
1239	R	35.6	Very low	30.5	Very low	301 Å²	301	170.6 Å²	170.6	100%	1.136	75%	0.75	S	S	*	*			cis	-134.1	0	7.6	-160.5	175	-160.5	154	6.8	113.1

Retrieved 1,239 of 1,239 residues in 6613.8 ms (Link to these results)

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