SR140_HUMAN Loading...

U2 snRNP-associated SURP motif-containing protein

AlphaFold DB , UniProt , Accession O15042, Species HUMAN (Homo sapiens, Human), Gene U2SURP, Length 1,029 aa.

						>SR140_HUMAN|O15042|U2SURP
MADKTPGGSQKASSKTRSSDVHSSGSSDAHMDASGPSDSDMPSRTRPKSPRKHNYRNESARESLCDSPHQNLSRPLLENKLKAFSIGKMSTAKRTLSKKEQEELKKKEDEKAAAEIYEEFLAAFEGSDGNKVKTFVRGGVVNAAKEEHETDEKRGKIYKPSSRFADQKNPPNQSSNERPPSLLVIETKKPPLKKGEKEKKKSNLELFKEELKQIQEERDERHKTKGRLSRFEPPQSDSDGQRRSMDAPSRRNRSSGVLDDYAPGSHDVGDPSTTNLYLGNINPQMNEEMLCQEFGRFGPLASVKIMWPRTDEERARERNCGFVAFMNRRDAERALKNLNGKMIMSFEMKLGWGKAVPIPPHPIYIPPSMMEHTLPPPPSGLPFNAQPRERLKNPNAPMLPPPKNKEDFEKTLSQAIVKVVIPTERNLLALIHRMIEFVVREGPMFEAMIMNREINNPMFRFLFENQTPAHVYYRWKLYSILQGDSPTKWRTEDFRMFKNGSFWRPPPLNPYLHGMSEEQETEAFVEEPSKKGALKEEQRDKLEEILRGLTPRKNDIGDAMVFCLNNAEAAEEIVDCITESLSILKTPLPKKIARLYLVSDVLYNSSAKVANASYYRKFFETKLCQIFSDLNATYRTIQGHLQSENFKQRVMTCFRAWEDWAIYPEPFLIKLQNIFLGLVNIIEEKETEDVPDDLDGAPIEEELDGAPLEDVDGIPIDATPIDDLDGVPIKSLDDDLDGVPLDATEDSKKNEPIFKVAPSKWEAVDESELEAQAVTTSKWELFDQHEESEEEENQNQEEESEDEEDTQSSKSEEHHLYSNPIKEEMTESKFSKYSEMSEEKRAKLREIELKVMKFQDELESGKRPKKPGQSFQEQVEHYRDKLLQREKEKELERERERDKKDKEKLESRSKDKKEKDECTPTRKERKRRHSTSPSPSRSSSGRRVKSPSPKSERSERSERSHKESSRSRSSHKDSPRDVSKKAKRSPSGSRTPKRSRRSRSRSPKKSGKKSRSQSRSPHRSHKKSKKNKH
					

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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	45.6	Very low	44.4	Very low	230 Å²	230	136.1 Å²	136.1	100%	1.133	82%	0.815	S	S	*	*				0	124.2	0	-60.1	83.6	169.1	0	0	106.2
2	A	39.1	Very low	44.2	Very low	96 Å²	96	132.3 Å²	132.3	79%	0.793	81%	0.809	S	S	*	*			cis	66.8	129.2	35.9	0	0	0	0	0	111.5
3	D	42	Very low	44.2	Very low	126 Å²	126	131.9 Å²	131.9	67%	0.674	82%	0.816	S	S	*	*			cis	-162.2	172.8	11.9	-157.2	-1.2	0	0	0	112.9
4	K	48.2	Very low	44.1	Very low	174 Å²	174	131.6 Å²	131.6	76%	0.757	82%	0.821	S	S	*	*			trans	67.1	101.4	154.3	-77.4	151.7	-178.2	127	0	122.9
5	T	43.3	Very low	43.7	Very low	129 Å²	129	134.6 Å²	134.6	79%	0.791	82%	0.817	S	S	*	*			trans	-65.4	-170.7	138.1	48.6	0	0	0	0	112.9
6	P	55.9	Low	43.6	Very low	126 Å²	126	134.9 Å²	134.9	82%	0.818	82%	0.82	S	S	*	*			cis	-135.3	-175.4	-30.3	29.4	-8.6	0	0	0	114.2
7	G	43.6	Very low	43.2	Very low	81 Å²	81	139.4 Å²	139.4	84%	0.835	82%	0.818	S	S	*	*			trans	144.4	123.8	136.5	0	0	0	0	0	119.4
8	G	47.6	Very low	42.8	Very low	79 Å²	79	137.7 Å²	137.7	81%	0.814	82%	0.815	S	S	*	*			trans	164.3	142.1	171.1	0	0	0	0	0	111.6
9	S	40.6	Very low	42.5	Very low	119 Å²	119	135.3 Å²	135.3	83%	0.832	81%	0.806	S	S	*	*			trans	-162.8	173	-170.4	-157.6	0	0	0	0	115.8
10	Q	41.7	Very low	42.3	Very low	154 Å²	154	135.4 Å²	135.4	72%	0.72	80%	0.802	S	S	*	*			trans	88.8	143.3	171.9	-54	-165.9	70.3	0	0	117.2
11	K	41.3	Very low	42.1	Very low	183 Å²	183	134.6 Å²	134.6	80%	0.796	80%	0.798	S	S	*	*			cis	-172.7	136.1	-18.6	-115.9	-179.9	-172.5	160.8	0	112
12	A	41.8	Very low	41.8	Very low	90 Å²	90	132.1 Å²	132.1	74%	0.744	78%	0.784	S	S	*	*			trans	-179.9	120.7	146.6	0	0	0	0	0	107.5
13	S	43.8	Very low	41.7	Very low	128 Å²	128	132.6 Å²	132.6	90%	0.895	78%	0.781	S	S	*	*				66.5	128.5	77.4	-65	0	0	0	0	113.1
14	S	43.6	Very low	41.6	Very low	127 Å²	127	132.5 Å²	132.5	89%	0.888	79%	0.791	S	S	*	*			cis	-123.3	-170.2	19.9	64	0	0	0	0	114.8
15	K	37.1	Very low	41.1	Very low	177 Å²	177	127.4 Å²	127.4	77%	0.77	79%	0.788	S	S	*	*			trans	-168.7	122	-152.7	178.7	-168.8	-175	-179.1	0	117.4
16	T	42.4	Very low	40.8	Very low	139 Å²	139	127.2 Å²	127.2	85%	0.853	79%	0.791	S	S	*	*			trans	-155.6	129.9	157	31.5	0	0	0	0	107.3
17	R	36.9	Very low	40	Very low	212 Å²	212	126.2 Å²	126.2	80%	0.8	79%	0.787	S	S	*	*			cis	68.4	106.7	44.5	-78.7	-167.4	160.1	-166	-7.8	113.7
18	S	36.3	Very low	39.8	Very low	108 Å²	108	129.8 Å²	129.8	76%	0.755	79%	0.787	S	S	*	*				86	138.9	78.6	-65.9	0	0	0	0	112.1
19	S	37.3	Very low	39.5	Very low	93 Å²	93	130.9 Å²	130.9	65%	0.65	79%	0.788	S	S	*	*			cis	-165	-179.1	-3.9	47.3	0	0	0	0	110.9
20	D	38.6	Very low	39.6	Very low	136 Å²	136	134.1 Å²	134.1	73%	0.727	79%	0.79	S	S	*	*			trans	67.9	107.7	160.2	-51	-57.2	0	0	0	118.4
21	V	38	Very low	39.8	Very low	119 Å²	119	136 Å²	136	72%	0.721	80%	0.801	S	S	*	*				84.9	99.7	69.1	168.7	0	0	0	0	114.2
22	H	39.5	Very low	39.8	Very low	179 Å²	179	135.1 Å²	135.1	83%	0.829	81%	0.805	S	S	*	*			trans	179.5	121.5	134	-102.3	75.3	0	0	0	115.4
23	S	36.3	Very low	39.9	Very low	106 Å²	106	135.1 Å²	135.1	74%	0.741	81%	0.805	S	S	*	*			trans	46.9	138.1	143.1	-135.9	0	0	0	0	125.3
24	S	40.2	Very low	39.8	Very low	124 Å²	124	135.3 Å²	135.3	87%	0.867	81%	0.806	S	S	*	*			trans	66	152	164.6	70.2	0	0	0	0	118.3
25	G	36.9	Very low	39.8	Very low	67 Å²	67	132.7 Å²	132.7	69%	0.691	80%	0.8	S	S	*	*			cis	167	151.2	-8.8	0	0	0	0	0	112.7
26	S	37.6	Very low	40.2	Very low	124 Å²	124	130.5 Å²	130.5	87%	0.867	80%	0.803	S	S	*	*			trans	68.8	162.4	-179.9	-60.8	0	0	0	0	117.3
27	S	39.7	Very low	40.2	Very low	105 Å²	105	129.3 Å²	129.3	73%	0.734	80%	0.801	S	S	*	*				178.2	153.1	-52.3	53.3	0	0	0	0	110.3
28	D	38.2	Very low	40.7	Very low	157 Å²	157	127.3 Å²	127.3	84%	0.84	81%	0.806	S	S	*	*			trans	-18.7	147.9	172.7	-79.1	-77.6	0	0	0	121.5
29	A	42.4	Very low	40.9	Very low	101 Å²	101	127.1 Å²	127.1	84%	0.835	81%	0.805	S	S	*	*			trans	-144.2	61.5	170.2	0	0	0	0	0	113.9
30	H	42	Very low	41.3	Very low	188 Å²	188	130.7 Å²	130.7	87%	0.87	82%	0.817	S	S	*	*			trans	-84.1	123.1	160	-118.2	-75.6	0	0	0	109.4
31	M	46.5	Very low	41.3	Very low	194 Å²	194	132.4 Å²	132.4	96%	0.956	82%	0.822	S	S	*	*			trans	-83.6	121.7	179.8	-81.3	-163.4	170.8	0	0	112.5
32	D	41.8	Very low	41.5	Very low	164 Å²	164	132 Å²	132	88%	0.877	82%	0.822	S	S	*	*			trans	-127.2	136	162.8	-152.2	-12.9	0	0	0	108.2
33	A	42.8	Very low	41.3	Very low	89 Å²	89	128.8 Å²	128.8	74%	0.736	82%	0.82	S	S	*	*			trans	-117.8	111	-161.2	0	0	0	0	0	112.8
34	S	41.1	Very low	41.6	Very low	132 Å²	132	135 Å²	135	92%	0.923	83%	0.827	S	S	*	*			trans	-158.3	138.3	173.4	-84.5	0	0	0	0	113.9
35	G	43.9	Very low	41.7	Very low	73 Å²	73	135.5 Å²	135.5	75%	0.753	83%	0.825	S	S	*	*			trans	142.4	175.3	168.7	0	0	0	0	0	114.1
36	P	45.9	Very low	41.8	Very low	130 Å²	130	142.6 Å²	142.6	84%	0.844	83%	0.831	S	S	*	*			cis	-114.1	171.6	-8.1	39.3	-28.4	0	0	0	113
37	S	41.8	Very low	42.2	Very low	115 Å²	115	142.3 Å²	142.3	80%	0.804	83%	0.826	S	S	*	*			trans	-126.6	117.3	169.1	58.4	0	0	0	0	110.3
38	D	47.9	Very low	42.2	Very low	170 Å²	170	145.7 Å²	145.7	91%	0.909	83%	0.827	S	S	*	*			trans	-71.4	150.7	176	-86.3	-49.3	0	0	0	112.8
39	S	40.6	Very low	42.1	Very low	104 Å²	104	142.9 Å²	142.9	73%	0.727	82%	0.82	S	S	*	*			trans	-105.1	140.8	-177.6	55.7	0	0	0	0	112.4
40	D	46	Very low	42.2	Very low	168 Å²	168	144.4 Å²	144.4	90%	0.898	82%	0.821	S	S	*	*			trans	-163.9	167.1	130.6	-122.5	-35.4	0	0	0	115.2
41	M	38.8	Very low	42	Very low	172 Å²	172	146.3 Å²	146.3	85%	0.847	82%	0.821	S	S	*	*			trans	-107.4	-175.8	-173.3	-108.8	-160.3	-174.6	0	0	112.9
42	P	41.5	Very low	41.8	Very low	111 Å²	111	146 Å²	146	72%	0.721	82%	0.815	S	S	*	*			cis	-131.9	-168	-19.8	29.9	-7.2	0	0	0	114
43	S	36.4	Very low	41.7	Very low	111 Å²	111	145.9 Å²	145.9	78%	0.776	81%	0.808	S	S	*	*			trans	-55	146.7	-179.3	55.2	0	0	0	0	118.9
44	R	41.7	Very low	41.6	Very low	237 Å²	237	147.3 Å²	147.3	89%	0.894	80%	0.803	S	S	*	*			trans	-160.8	116.3	151.8	-114.5	173.5	-166.8	-144.1	2.6	116.7
45	T	41.3	Very low	41.3	Very low	134 Å²	134	150.6 Å²	150.6	82%	0.822	80%	0.797	S	S	*	*			trans	43.3	136.4	138.4	55.8	0	0	0	0	124.3
46	R	39.9	Very low	41	Very low	215 Å²	215	156.5 Å²	156.5	81%	0.811	80%	0.796	S	S	*	*			trans	-94.2	151.1	-178.8	178.1	-163.1	-172.2	-150	8.5	115
47	P	45.4	Very low	40.4	Very low	118 Å²	118	157.2 Å²	157.2	77%	0.766	79%	0.793	S	S	*	*			trans	-129.3	135.2	135.5	35.1	-23.8	0	0	0	111.8
48	K	39.7	Very low	40.2	Very low	176 Å²	176	159.4 Å²	159.4	77%	0.765	79%	0.791	S	S	*	*				81.4	91.4	60.3	-80.5	-168.3	175	-179.9	0	115.6
49	S	37.3	Very low	39.6	Very low	99 Å²	99	156.5 Å²	156.5	69%	0.692	78%	0.784	S	S	*	*			trans	-7.8	158.8	151.2	-170.1	0	0	0	0	120.9
50	P	44.7	Very low	39.5	Very low	132 Å²	132	155.3 Å²	155.3	86%	0.857	78%	0.78	S	S	*	*				-129.6	173.6	109.7	37.3	-29.9	0	0	0	115.7
51	R	37.4	Very low	39	Very low	228 Å²	228	157.7 Å²	157.7	86%	0.86	78%	0.777	S	S	*	*			trans	-107.9	162.7	-173.4	-64.9	169.8	164.3	173.7	-7	113.8
52	K	41.1	Very low	38.9	Very low	189 Å²	189	156.7 Å²	156.7	82%	0.822	77%	0.77	S	S	*	*			trans	-165.6	121.3	136.2	-100.6	152.5	-175.2	-174.9	0	108.5
53	H	40.3	Very low	38.6	Very low	161 Å²	161	156 Å²	156	75%	0.745	77%	0.768	S	S	*	*				60.3	133.8	98.9	-71.7	-62.7	0	0	0	114
54	N	40.4	Very low	38.7	Very low	118 Å²	118	157.7 Å²	157.7	63%	0.631	77%	0.767	S	S	*	*			cis	-161.2	154.5	9.6	-115.3	-6.8	0	0	0	112.8
55	Y	35.8	Very low	38.4	Very low	201 Å²	201	151.6 Å²	151.6	79%	0.788	76%	0.76	S	S	*	*			trans	30.5	149.2	133.2	-77.4	-107.3	0	0	0	121.4
56	R	37.8	Very low	38.1	Very low	197 Å²	197	151.6 Å²	151.6	74%	0.743	76%	0.755	S	S	*	*			cis	-159.4	172.1	9.9	-175	169.1	170.3	137.5	-2.1	110.8	E58	R56-E58 IonicContact NE-OE2 2.66Å
57	N	33.2	Very low	38	Very low	145 Å²	145	146.2 Å²	146.2	78%	0.775	75%	0.75	S	S	*	*			trans	-65.2	-178.9	170.6	-74.2	-9.3	0	0	0	115.5
58	E	37.1	Very low	37.9	Very low	162 Å²	162	145.7 Å²	145.7	76%	0.757	75%	0.747	S	S	*	*			trans	95.8	145.2	160.9	-60	165	144.5	0	0	115.2	R56	R56-E58 IonicContact NE-OE2 2.66Å
59	S	35.6	Very low	37.8	Very low	109 Å²	109	145.2 Å²	145.2	76%	0.762	75%	0.747	S	S	*	*			cis	153.5	136	-29.4	176.3	0	0	0	0	107.3
60	A	37.5	Very low	37.8	Very low	79 Å²	79	147.9 Å²	147.9	65%	0.653	75%	0.749	S	S	*	*			trans	65.7	133.1	168.4	0	0	0	0	0	120.2
61	R	35.8	Very low	37.2	Very low	218 Å²	218	148.9 Å²	148.9	82%	0.823	75%	0.746	S	S	*	*			trans	67.3	156.4	146.9	-71.3	170.6	147.2	131.8	0.6	117.7
62	E	36.7	Very low	37.2	Very low	151 Å²	151	146.7 Å²	146.7	71%	0.706	75%	0.751	S	S	*	*			cis	-143.8	-167.8	0.9	-145.5	123.5	-131	0	0	111.8
63	S	36.2	Very low	37	Very low	97 Å²	97	142.5 Å²	142.5	68%	0.678	75%	0.746	S	S	*	*			trans	-73	-179.4	171	51.9	0	0	0	0	111.9
64	L	37.3	Very low	37	Very low	146 Å²	146	145.9 Å²	145.9	76%	0.764	75%	0.752	S	S	*	*			cis	-174.2	145.8	33.7	-172.7	64.8	0	0	0	111.7
65	C	35.5	Very low	37.2	Very low	109 Å²	109	145.7 Å²	145.7	74%	0.736	76%	0.757	S	S	*	*			trans	58.5	169.9	160	-77.2	0	0	0	0	118.7
66	D	35.9	Very low	37.4	Very low	134 Å²	134	143.3 Å²	143.3	72%	0.717	76%	0.757	S	S	*	*			cis	-146.5	143.7	-0.7	-148.8	2	0	0	0	115.1
67	S	36.8	Very low	37.8	Very low	102 Å²	102	140.3 Å²	140.3	71%	0.713	76%	0.755	S	S	*	*			trans	50.7	164.1	140.1	-71.7	0	0	0	0	125.2
68	P	44	Very low	38.1	Very low	107 Å²	107	141.2 Å²	141.2	70%	0.695	76%	0.755	S	S	*	*			trans	-121.3	179.5	-156.9	44	-33.1	0	0	0	115.4
69	H	37.8	Very low	38.4	Very low	166 Å²	166	140.9 Å²	140.9	77%	0.769	76%	0.758	S	S	*	*			trans	-163.9	127.7	144.3	-103.8	-78.5	0	0	0	115.1
70	Q	37.4	Very low	38.7	Very low	155 Å²	155	145.2 Å²	145.2	72%	0.724	76%	0.763	S	S	*	*			trans	43.9	128.5	141.7	-63.4	175.7	17.3	0	0	124.9
71	N	31.3	Very low	38.9	Very low	152 Å²	152	148.9 Å²	148.9	81%	0.813	77%	0.771	S	S	*	*			trans	26.2	124.8	134.6	-62.7	-25.6	0	0	0	121.8
72	L	38.3	Very low	39.2	Very low	183 Å²	183	148.5 Å²	148.5	96%	0.958	78%	0.775	S	S	*	*			trans	-147	171.1	139.8	-139.4	71.8	0	0	0	111.2
73	S	35.4	Very low	39.6	Very low	101 Å²	101	145.8 Å²	145.8	71%	0.706	78%	0.779	S	S	*	*			trans	-146.3	177.2	-165.3	73.8	0	0	0	0	114.8
74	R	41.1	Very low	39.8	Very low	232 Å²	232	150.9 Å²	150.9	88%	0.875	79%	0.789	S	S	*	*			trans	85.4	161.4	157.2	-88.3	-178.2	-179	-143.2	1.1	117.4
75	P	44.5	Very low	39.9	Very low	114 Å²	114	148.4 Å²	148.4	74%	0.74	78%	0.784	S	S	*	*				-135.3	-108.1	-103.7	38.7	-14.3	0	0	0	114.8
76	L	40.9	Very low	40.2	Very low	150 Å²	150	151 Å²	151	79%	0.785	79%	0.789	S	S	*	*			trans	80.1	144.7	-165	-54.1	171.2	0	0	0	113.4
77	L	45.2	Very low	40.2	Very low	135 Å²	135	147.5 Å²	147.5	71%	0.707	78%	0.784	S	S	*	*			cis	-145.1	144.4	-30.7	-84.2	170.4	0	0	0	104.6
78	E	39.7	Very low	40.4	Very low	164 Å²	164	152.3 Å²	152.3	77%	0.766	79%	0.793	S	S	*	*			cis	84.9	100.6	45.7	-164.9	169.8	-128.7	0	0	115.4
79	N	44.1	Very low	40.1	Very low	154 Å²	154	155.5 Å²	155.5	82%	0.824	80%	0.8	S	S	*	*			trans	-163.7	153.7	150.3	-130.3	-58.1	0	0	0	113.5
80	K	42.1	Very low	40	Very low	201 Å²	201	152.7 Å²	152.7	87%	0.874	80%	0.799	S	S	*	*			trans	64.5	73	177.9	-64.2	-169.9	175.6	-177	0	117.9
81	L	41	Very low	40	Very low	156 Å²	156	151.7 Å²	151.7	82%	0.817	80%	0.804	S	S	*	*			trans	-112.2	137	158.6	-134.8	166.8	0	0	0	108.4
82	K	41.6	Very low	40.1	Very low	209 Å²	209	149.2 Å²	149.2	91%	0.909	81%	0.805	S	S	*	*			trans	159.3	100.1	150.9	-91.3	166.1	-175.9	-179.3	0	113.2
83	A	45.5	Very low	40.5	Very low	95 Å²	95	150 Å²	150	79%	0.785	80%	0.8	S	S	*	*			trans	-161.8	131	144	0	0	0	0	0	108.6
84	F	40.2	Very low	41.4	Very low	203 Å²	203	156.7 Å²	156.7	89%	0.89	81%	0.81	S	S	*	*			trans	-38.9	155.8	-174.2	-60.6	-96.1	0	0	0	117.4
85	S	40.4	Very low	41.8	Very low	94 Å²	94	152.2 Å²	152.2	66%	0.657	81%	0.809	S	S	*	*			cis	140.3	128.8	-14.4	-88.4	0	0	0	0	108.8
86	I	40.2	Very low	42.4	Very low	163 Å²	163	150.8 Å²	150.8	84%	0.836	80%	0.795	S	S	*	*			trans	66.6	130.3	160.8	-55.1	159.3	0	0	0	115.5
87	G	36.5	Very low	43.9	Very low	61 Å²	61	146.8 Å²	146.8	63%	0.629	78%	0.779	S	S	*	*			cis	118	107.5	-7.1	0	0	0	0	0	114.5
88	K	41.2	Very low	45.4	Very low	204 Å²	204	148 Å²	148	89%	0.887	78%	0.778	S	S	*	*			trans	-172.1	110.9	156.8	-106.2	155.6	-172.4	-179.8	0	114.2
89	M	38.6	Very low	47.3	Very low	173 Å²	173	146.4 Å²	146.4	85%	0.852	77%	0.769	S	S	*	*			trans	38	121.9	137.8	-58.9	-64.5	-87	0	0	122.8
90	S	34.4	Very low	48.9	Very low	107 Å²	107	143.2 Å²	143.2	75%	0.748	75%	0.749	S	S	*	*				58	108.6	127.1	-166.9	0	0	0	0	121.7
91	T	37.8	Very low	50.5	Low	134 Å²	134	139.2 Å²	139.2	82%	0.822	73%	0.734	S	S	*	*				-145.7	148.2	122.3	31.6	0	0	0	0	109.3
92	A	34.5	Very low	52.2	Low	101 Å²	101	138.1 Å²	138.1	84%	0.835	72%	0.724	S	S	*	*			trans	-80	135.6	-174.4	0	0	0	0	0	112.8
93	K	45.9	Very low	54.2	Low	198 Å²	198	133 Å²	133	86%	0.861	70%	0.704	S	S	*	*			trans	-131.8	144.3	164.4	-72.1	-173.6	177.3	179	0	109.7
94	R	54.7	Low	55.8	Low	243 Å²	243	133 Å²	133	92%	0.917	69%	0.69	S	S	*	*			trans	-58.3	138.6	-175.8	-71.8	176	172.2	142.5	-2.8	111	L96	R94-L96 PolarHBondContact O-N 2.8Å
95	T	48.6	Very low	57.9	Low	138 Å²	138	128.1 Å²	128.1	85%	0.847	67%	0.668	S	S	*	*			trans	-65.2	111.9	163.7	49.5	0	0	0	0	108.7
96	L	58.1	Low	60.1	Low	84 Å²	84	130 Å²	130	44%	0.44	67%	0.665	S	S	.	*			trans	-53.9	141.5	177.1	-65.7	169.6	0	0	0	110.8	R94 E100 Q101 L104	R94-L96 PolarHBondContact O-N 2.8Å; L96-E100 HydrophobicContact CB-CB 4.18Å; L96-E100 WeakPolarHBondContact CD2-OE1 3.32Å; L96-Q101 HydrophobicContact CB-CG 4.43Å; L96-L104 HydrophobicContact CD1-CD1 3.94Å
97	S	71.3	Confident	62.3	Low	66 Å²	66	129.7 Å²	129.7	46%	0.462	66%	0.658	S	S	.	*			trans	-59.8	150.8	177.7	-179.7	0	0	0	0	110.9	K99 E100 Q101	S97-K99 PolarHBondContact O-N 3.13Å; S97-K99 VanDerWaalsContact O-N 3.09Å; S97-K99 PolarHBondContact OG-N 2.82Å; S97-E100 WeakPolarHBondContact CB-OE2 3.36Å; S97-E100 PolarHBondContact N-OE2 2.84Å; S97-E100 WeakPolarHBondContact O-CB 3.43Å; S97-E100 PolarHBondContact O-N 3.21Å; S97-Q101 PolarHBondContact O-N 2.7Å
98	K	76.4	Confident	64.5	Low	159 Å²	159	133.5 Å²	133.5	69%	0.691	66%	0.659	S	S	*	*	H	α-helix	trans	-54.3	-32	173.6	-171.8	-179.1	179.7	-168.9	0	111.9	E102	K98-E102 WeakPolarHBondContact O-CB 3.36Å; K98-E102 PolarHBondContact O-N 2.59Å; K98-E102 VanDerWaalsContact O-N 3.15Å
99	K	79.7	Confident	66.5	Low	131 Å²	131	127.8 Å²	127.8	57%	0.57	64%	0.638	S	S	*	*	H	α-helix	trans	-66.8	-44.7	174.9	-166.9	-172.1	177.3	-125.8	0	112.1	S97 Q101 E102 E103	S97-K99 PolarHBondContact O-N 3.13Å; S97-K99 VanDerWaalsContact O-N 3.09Å; S97-K99 PolarHBondContact OG-N 2.82Å; K99-Q101 VanDerWaalsContact C-N 3.32Å; K99-Q101 PolarHBondContact O-N 3.21Å; K99-E102 PolarHBondContact O-N 3.28Å; K99-E102 VanDerWaalsContact O-N 3.15Å; K99-E103 WeakPolarHBondContact CE-OE1 3.34Å; K99-E103 IonicContact NZ-OE1 2.76Å; K99-E103 PolarHBondContact NZ-OE1 3.43Å; K99-E103 IonicContact NZ-OE2 2.71Å; K99-E103 PolarHBondContact O-N 2.94Å
100	E	78.8	Confident	68.9	Low	87 Å²	87	124.9 Å²	124.9	41%	0.407	62%	0.622	S	S	.	*	H	α-helix	trans	-63.2	-38.2	176.6	-70.8	170.9	107.5	0	0	111.6	L96 S97 E102 E103 L104	L96-E100 HydrophobicContact CB-CB 4.18Å; L96-E100 WeakPolarHBondContact CD2-OE1 3.32Å; S97-E100 WeakPolarHBondContact CB-OE2 3.36Å; S97-E100 PolarHBondContact N-OE2 2.84Å; S97-E100 WeakPolarHBondContact O-CB 3.43Å; S97-E100 PolarHBondContact O-N 3.21Å; E100-E102 VanDerWaalsContact C-N 3.29Å; E100-E102 PolarHBondContact O-N 3.16Å; E100-E103 PolarHBondContact O-N 3.09Å; E100-L104 VanDerWaalsContact O-CB 3.28Å; E100-L104 WeakPolarHBondContact O-CB 3.49Å; E100-L104 WeakPolarHBondContact O-CG 3.5Å; E100-L104 PolarHBondContact O-N 3.27Å
101	Q	74.6	Confident	71.4	Confident	118 Å²	118	125.6 Å²	125.6	55%	0.551	61%	0.612	S	S	*	*	H	α-helix	trans	-64.1	-34.4	174.5	-67.2	-176.2	-7.1	0	0	112.5	L96 S97 K99 K105	L96-Q101 HydrophobicContact CB-CG 4.43Å; S97-Q101 PolarHBondContact O-N 2.7Å; K99-Q101 VanDerWaalsContact C-N 3.32Å; K99-Q101 PolarHBondContact O-N 3.21Å; Q101-K105 VanDerWaalsContact O-CB 3.24Å; Q101-K105 WeakPolarHBondContact O-CB 3.35Å; Q101-K105 PolarHBondContact O-N 2.98Å; Q101-K105 VanDerWaalsContact O-N 3.08Å
102	E	77.5	Confident	73.7	Confident	132 Å²	132	121.2 Å²	121.2	62%	0.617	59%	0.59	S	S	*	*	H	α-helix	trans	-79.6	-34.6	179.5	-157	150.2	-130.6	0	0	111.7	K98 K99 E100 K106	K98-E102 WeakPolarHBondContact O-CB 3.36Å; K98-E102 PolarHBondContact O-N 2.59Å; K98-E102 VanDerWaalsContact O-N 3.15Å; K99-E102 PolarHBondContact O-N 3.28Å; K99-E102 VanDerWaalsContact O-N 3.15Å; E100-E102 VanDerWaalsContact C-N 3.29Å; E100-E102 PolarHBondContact O-N 3.16Å; E102-K106 WeakPolarHBondContact O-CB 3.41Å; E102-K106 PolarHBondContact O-N 3.29Å
103	E	82.8	Confident	76.1	Confident	103 Å²	103	119.2 Å²	119.2	48%	0.481	57%	0.573	S	S	.	*	H	α-helix	trans	-70.1	-43.7	171	-78.2	173.5	166	0	0	112.6	K99 E100 K106 K107	K99-E103 WeakPolarHBondContact CE-OE1 3.34Å; K99-E103 IonicContact NZ-OE1 2.76Å; K99-E103 PolarHBondContact NZ-OE1 3.43Å; K99-E103 IonicContact NZ-OE2 2.71Å; K99-E103 PolarHBondContact O-N 2.94Å; E100-E103 PolarHBondContact O-N 3.09Å; E103-K106 PolarHBondContact O-N 3.44Å; E103-K107 WeakPolarHBondContact O-CB 3.36Å; E103-K107 PolarHBondContact O-N 2.88Å
104	L	80.5	Confident	78.1	Confident	94 Å²	94	112.4 Å²	112.4	49%	0.492	55%	0.554	S	S	.	*	H	α-helix	trans	-59.6	-47.9	172.9	-80.3	169.6	0	0	0	111	L96 E100 K106 K107 E108	L96-L104 HydrophobicContact CD1-CD1 3.94Å; E100-L104 VanDerWaalsContact O-CB 3.28Å; E100-L104 WeakPolarHBondContact O-CB 3.49Å; E100-L104 WeakPolarHBondContact O-CG 3.5Å; E100-L104 PolarHBondContact O-N 3.27Å; L104-K106 VanDerWaalsContact C-N 3.34Å; L104-K106 PolarHBondContact O-N 3.22Å; L104-K107 WeakPolarHBondContact O-CB 3.25Å; L104-K107 PolarHBondContact O-N 2.9Å; L104-K107 VanDerWaalsContact O-N 3.1Å; L104-E108 PolarHBondContact O-N 3.13Å
105	K	83.6	Confident	79.5	Confident	100 Å²	100	105.9 Å²	105.9	44%	0.435	53%	0.534	S	S	.	.	H	α-helix	trans	-64.1	-37.9	178.2	-177.3	159.8	-170.7	148.4	0	112.6	Q101 K107 E108 D109	Q101-K105 VanDerWaalsContact O-CB 3.24Å; Q101-K105 WeakPolarHBondContact O-CB 3.35Å; Q101-K105 PolarHBondContact O-N 2.98Å; Q101-K105 VanDerWaalsContact O-N 3.08Å; K105-K107 VanDerWaalsContact C-N 3.31Å; K105-K107 PolarHBondContact O-N 3.43Å; K105-E108 PolarHBondContact O-N 3.05Å; K105-D109 WeakPolarHBondContact O-CB 3.42Å; K105-D109 PolarHBondContact O-N 2.88Å
106	K	85.9	Confident	81.1	Confident	133 Å²	133	104.7 Å²	104.7	58%	0.578	52%	0.521	S	S	*	.	H	α-helix	trans	-60.1	-44.2	172.3	-170.5	-161.8	168.9	-148.1	0	110.4	E102 E103 L104 E108 D109 E110	E102-K106 WeakPolarHBondContact O-CB 3.41Å; E102-K106 PolarHBondContact O-N 3.29Å; E103-K106 PolarHBondContact O-N 3.44Å; L104-K106 VanDerWaalsContact C-N 3.34Å; L104-K106 PolarHBondContact O-N 3.22Å; K106-E108 VanDerWaalsContact C-N 3.34Å; K106-E108 PolarHBondContact O-N 3.04Å; K106-D109 PolarHBondContact O-N 3.46Å; K106-E110 WeakPolarHBondContact CE-OE2 3.38Å; K106-E110 IonicContact NZ-OE2 3Å; K106-E110 PolarHBondContact NZ-OE2 3.14Å; K106-E110 WeakPolarHBondContact O-CB 3.47Å; K106-E110 PolarHBondContact O-N 3.42Å
107	K	86.2	Confident	82.3	Confident	158 Å²	158	107.5 Å²	107.5	69%	0.687	53%	0.527	S	S	*	.	H	α-helix	trans	-66.4	-32.7	180	-167.3	171.6	-178.1	176.2	0	113.1	E103 L104 K105 K111	E103-K107 WeakPolarHBondContact O-CB 3.36Å; E103-K107 PolarHBondContact O-N 2.88Å; L104-K107 WeakPolarHBondContact O-CB 3.25Å; L104-K107 PolarHBondContact O-N 2.9Å; L104-K107 VanDerWaalsContact O-N 3.1Å; K105-K107 VanDerWaalsContact C-N 3.31Å; K105-K107 PolarHBondContact O-N 3.43Å; K107-K111 WeakPolarHBondContact O-CB 3.39Å; K107-K111 PolarHBondContact O-N 3.11Å
108	E	83.3	Confident	82.8	Confident	140 Å²	140	111 Å²	111	65%	0.654	54%	0.536	S	S	*	.	H	α-helix	trans	-70.6	-49.4	170.2	-71	-177.6	142.8	0	0	112.3	L104 K105 K106 E110 K111 A112	L104-E108 PolarHBondContact O-N 3.13Å; K105-E108 PolarHBondContact O-N 3.05Å; K106-E108 VanDerWaalsContact C-N 3.34Å; K106-E108 PolarHBondContact O-N 3.04Å; E108-E110 PolarHBondContact O-N 2.82Å; E108-K111 PolarHBondContact O-N 3.49Å; E108-A112 WeakPolarHBondContact O-CB 3.3Å; E108-A112 PolarHBondContact O-N 2.83Å
109	D	84.4	Confident	83	Confident	85 Å²	85	110.3 Å²	110.3	46%	0.455	54%	0.535	S	S	.	.	H	α-helix	trans	-58.2	-35.3	176.2	-79.3	-18.5	0	0	0	110.5	K105 K106 A113 R997	K105-D109 WeakPolarHBondContact O-CB 3.42Å; K105-D109 PolarHBondContact O-N 2.88Å; K106-D109 PolarHBondContact O-N 3.46Å; D109-A113 WeakPolarHBondContact O-CB 3.28Å; D109-A113 PolarHBondContact O-N 2.93Å; D109-R997 IonicContact OD2-NH1 2.77Å
110	E	87.3	Confident	83	Confident	112 Å²	112	109.8 Å²	109.8	52%	0.523	53%	0.533	S	S	.	.	H	α-helix	trans	-75.9	-41.9	177.7	-172.8	164.2	-171.9	0	0	112.8	K106 E108 A113 A114	K106-E110 WeakPolarHBondContact CE-OE2 3.38Å; K106-E110 IonicContact NZ-OE2 3Å; K106-E110 PolarHBondContact NZ-OE2 3.14Å; K106-E110 WeakPolarHBondContact O-CB 3.47Å; K106-E110 PolarHBondContact O-N 3.42Å; E108-E110 PolarHBondContact O-N 2.82Å; E110-A113 PolarHBondContact O-N 3.35Å; E110-A114 PolarHBondContact O-N 2.93Å
111	K	87.4	Confident	82.9	Confident	121 Å²	121	108.8 Å²	108.8	53%	0.526	53%	0.53	S	S	.	.	H	α-helix	trans	-63.8	-44.6	173.1	-166.7	-161.8	171.3	-118.6	0	111.1	K107 E108 A113 A114 E115	K107-K111 WeakPolarHBondContact O-CB 3.39Å; K107-K111 PolarHBondContact O-N 3.11Å; E108-K111 PolarHBondContact O-N 3.49Å; K111-A113 VanDerWaalsContact C-N 3.27Å; K111-A113 PolarHBondContact O-N 3.01Å; K111-A114 WeakPolarHBondContact O-CB 3.39Å; K111-A114 PolarHBondContact O-N 3.49Å; K111-A114 VanDerWaalsContact O-N 3.11Å; K111-E115 VanDerWaalsContact NZ-CD 3.26Å; K111-E115 IonicContact NZ-OE1 3.02Å; K111-E115 PolarHBondContact NZ-OE1 2.84Å; K111-E115 IonicContact NZ-OE2 2.64Å; K111-E115 PolarHBondContact NZ-OE2 2.97Å; K111-E115 WeakPolarHBondContact O-CB 3.4Å; K111-E115 PolarHBondContact O-N 3.3Å
112	A	85.4	Confident	83	Confident	43 Å²	43	106.5 Å²	106.5	36%	0.355	53%	0.531	S	S	.	.	H	α-helix	trans	-62.6	-34.6	178.1	0	0	0	0	0	112.1	E108 I116	E108-A112 WeakPolarHBondContact O-CB 3.3Å; E108-A112 PolarHBondContact O-N 2.83Å; A112-I116 WeakPolarHBondContact O-CB 3.42Å; A112-I116 WeakPolarHBondContact O-CD1 3.38Å; A112-I116 VanDerWaalsContact O-CG1 3.24Å; A112-I116 WeakPolarHBondContact O-CG1 3.41Å; A112-I116 PolarHBondContact O-N 3.24Å
113	A	85.2	Confident	82.9	Confident	59 Å²	59	103.9 Å²	103.9	49%	0.488	53%	0.532	S	S	.	.	H	α-helix	trans	-67.3	-38.2	172.9	0	0	0	0	0	112.6	D109 E110 K111 Y117	D109-A113 WeakPolarHBondContact O-CB 3.28Å; D109-A113 PolarHBondContact O-N 2.93Å; E110-A113 PolarHBondContact O-N 3.35Å; K111-A113 VanDerWaalsContact C-N 3.27Å; K111-A113 PolarHBondContact O-N 3.01Å; A113-Y117 WeakPolarHBondContact O-CB 3.44Å; A113-Y117 PolarHBondContact O-N 2.98Å
114	A	88.1	Confident	82	Confident	55 Å²	55	106.4 Å²	106.4	46%	0.455	54%	0.542	S	S	.	.	H	α-helix	trans	-67.5	-42.6	174.4	0	0	0	0	0	112.2	E110 K111 I116 Y117 E118	E110-A114 PolarHBondContact O-N 2.93Å; K111-A114 WeakPolarHBondContact O-CB 3.39Å; K111-A114 PolarHBondContact O-N 3.49Å; K111-A114 VanDerWaalsContact O-N 3.11Å; A114-I116 PolarHBondContact O-N 2.83Å; A114-Y117 CarbonylContact O-C 3.46Å; A114-Y117 WeakPolarHBondContact O-CB 3.47Å; A114-Y117 PolarHBondContact O-N 3.47Å; A114-Y117 VanDerWaalsContact O-N 3.09Å; A114-E118 WeakPolarHBondContact O-CB 3.47Å; A114-E118 PolarHBondContact O-N 3.21Å
115	E	84.9	Confident	81.1	Confident	106 Å²	106	109.7 Å²	109.7	50%	0.495	55%	0.554	S	S	.	*	H	α-helix	trans	-64.8	-38.8	179.8	-154.5	153.9	-128.6	0	0	111.2	K111 E119	K111-E115 VanDerWaalsContact NZ-CD 3.26Å; K111-E115 IonicContact NZ-OE1 3.02Å; K111-E115 PolarHBondContact NZ-OE1 2.84Å; K111-E115 IonicContact NZ-OE2 2.64Å; K111-E115 PolarHBondContact NZ-OE2 2.97Å; K111-E115 WeakPolarHBondContact O-CB 3.4Å; K111-E115 PolarHBondContact O-N 3.3Å; E115-E119 WeakPolarHBondContact O-CB 3.19Å; E115-E119 PolarHBondContact O-N 2.94Å
116	I	81.8	Confident	79.3	Confident	112 Å²	112	108.1 Å²	108.1	57%	0.574	57%	0.567	S	S	*	*	H	α-helix	trans	-69	-33.4	171.2	-68.6	166.3	0	0	0	112.1	A112 A114 F120	A112-I116 WeakPolarHBondContact O-CB 3.42Å; A112-I116 WeakPolarHBondContact O-CD1 3.38Å; A112-I116 VanDerWaalsContact O-CG1 3.24Å; A112-I116 WeakPolarHBondContact O-CG1 3.41Å; A112-I116 PolarHBondContact O-N 3.24Å; A114-I116 PolarHBondContact O-N 2.83Å; I116-F120 VanDerWaalsContact O-CB 3.26Å; I116-F120 WeakPolarHBondContact O-CB 3.37Å; I116-F120 PolarHBondContact O-N 3.36Å
117	Y	83.6	Confident	77.1	Confident	144 Å²	144	107.2 Å²	107.2	57%	0.565	58%	0.577	S	S	*	*	H	α-helix	trans	-73.2	-35.8	176.6	-176.6	-110.7	0	0	0	112	A113 A114 F120 L121	A113-Y117 WeakPolarHBondContact O-CB 3.44Å; A113-Y117 PolarHBondContact O-N 2.98Å; A114-Y117 CarbonylContact O-C 3.46Å; A114-Y117 WeakPolarHBondContact O-CB 3.47Å; A114-Y117 PolarHBondContact O-N 3.47Å; A114-Y117 VanDerWaalsContact O-N 3.09Å; Y117-F120 PolarHBondContact O-N 2.97Å; Y117-L121 HydrophobicContact CD1-CD1 4.09Å; Y117-L121 HydrophobicContact CE1-CD1 3.53Å; Y117-L121 HydrophobicContact CE1-CG 4.18Å; Y117-L121 HydrophobicContact CE2-CG 4.41Å; Y117-L121 WeakPolarHBondContact O-CG 3.38Å; Y117-L121 PolarHBondContact O-N 3.11Å
118	E	81.9	Confident	74.8	Confident	139 Å²	139	107.5 Å²	107.5	65%	0.65	59%	0.586	S	S	*	*	H	α-helix	trans	-67.5	-44.2	173	-170.7	170.2	-167.5	0	0	111.2	A114 F120 L121 A122	A114-E118 WeakPolarHBondContact O-CB 3.47Å; A114-E118 PolarHBondContact O-N 3.21Å; E118-F120 VanDerWaalsContact C-N 3.29Å; E118-F120 PolarHBondContact O-N 3.26Å; E118-L121 PolarHBondContact O-N 3.19Å; E118-A122 VanDerWaalsContact O-CB 3.27Å; E118-A122 WeakPolarHBondContact O-CB 3.49Å; E118-A122 PolarHBondContact O-N 3.37Å
119	E	80	Confident	72.8	Confident	144 Å²	144	104.2 Å²	104.2	67%	0.673	59%	0.59	S	S	*	*	H	α-helix	trans	-59.3	-40	170.4	-172.7	179.1	-157.4	0	0	111.6	E115 A123	E115-E119 WeakPolarHBondContact O-CB 3.19Å; E115-E119 PolarHBondContact O-N 2.94Å; E119-A123 WeakPolarHBondContact O-CB 3.49Å; E119-A123 PolarHBondContact O-N 3.49Å
120	F	80.3	Confident	70.8	Confident	120 Å²	120	107.4 Å²	107.4	53%	0.526	61%	0.607	S	S	.	*	H	α-helix	trans	-67.2	-37.6	176.6	-179.3	-94	0	0	0	113.3	I116 Y117 E118 F124	I116-F120 VanDerWaalsContact O-CB 3.26Å; I116-F120 WeakPolarHBondContact O-CB 3.37Å; I116-F120 PolarHBondContact O-N 3.36Å; Y117-F120 PolarHBondContact O-N 2.97Å; E118-F120 VanDerWaalsContact C-N 3.29Å; E118-F120 PolarHBondContact O-N 3.26Å; F120-F124 HydrophobicContact CE2-CE2 4.14Å; F120-F124 HydrophobicContact CZ-CE2 4.04Å; F120-F124 WeakPolarHBondContact O-CD2 3.43Å
121	L	76.3	Confident	68.8	Low	67 Å²	67	111.8 Å²	111.8	35%	0.351	62%	0.624	S	S	.	*	H	α-helix	trans	-73.9	-41.9	174.8	-71.7	-179.7	0	0	0	112	Y117 E118 A123 F124 E125	Y117-L121 HydrophobicContact CD1-CD1 4.09Å; Y117-L121 HydrophobicContact CE1-CD1 3.53Å; Y117-L121 HydrophobicContact CE1-CG 4.18Å; Y117-L121 HydrophobicContact CE2-CG 4.41Å; Y117-L121 WeakPolarHBondContact O-CG 3.38Å; Y117-L121 PolarHBondContact O-N 3.11Å; E118-L121 PolarHBondContact O-N 3.19Å; L121-A123 PolarHBondContact O-N 3.26Å; L121-F124 PolarHBondContact O-N 2.92Å; L121-E125 PolarHBondContact O-N 3.35Å; L121-E125 VanDerWaalsContact O-N 3.13Å
122	A	77.5	Confident	66.3	Low	69 Å²	69	113 Å²	113	57%	0.57	64%	0.641	S	S	*	*	H	α-helix	trans	-59.3	-30.6	175.3	0	0	0	0	0	112.3	E118 F124	E118-A122 VanDerWaalsContact O-CB 3.27Å; E118-A122 WeakPolarHBondContact O-CB 3.49Å; E118-A122 PolarHBondContact O-N 3.37Å; A122-F124 PolarHBondContact O-N 2.94Å
123	A	74	Confident	64.5	Low	77 Å²	77	120.4 Å²	120.4	64%	0.636	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-7.5	172.5	0	0	0	0	0	114.9	E119 L121	E119-A123 WeakPolarHBondContact O-CB 3.49Å; E119-A123 PolarHBondContact O-N 3.49Å; L121-A123 PolarHBondContact O-N 3.26Å
124	F	63.7	Low	62.6	Low	156 Å²	156	123.9 Å²	123.9	68%	0.684	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121	-21.6	179	-81.8	-86.3	0	0	0	115.2	F120 L121 A122	F120-F124 HydrophobicContact CE2-CE2 4.14Å; F120-F124 HydrophobicContact CZ-CE2 4.04Å; F120-F124 WeakPolarHBondContact O-CD2 3.43Å; L121-F124 PolarHBondContact O-N 2.92Å; A122-F124 PolarHBondContact O-N 2.94Å
125	E	61.4	Low	60	Low	163 Å²	163	131 Å²	131	76%	0.762	70%	0.702	S	S	*	*	S	Bend	trans	-97.5	10.9	-177.4	-61.6	-168.4	143.8	0	0	114.3	L121 S127	L121-E125 PolarHBondContact O-N 3.35Å; L121-E125 VanDerWaalsContact O-N 3.13Å; E125-S127 PolarHBondContact O-N 3.31Å; E125-S127 VanDerWaalsContact O-N 3.15Å
126	G	46.3	Very low	57.9	Low	68 Å²	68	132.2 Å²	132.2	70%	0.701	72%	0.716	S	S	*	*			trans	-80.9	84.2	-176.9	0	0	0	0	0	116.7
127	S	40.9	Very low	55.9	Low	113 Å²	113	138.5 Å²	138.5	79%	0.79	73%	0.733	S	S	*	*			trans	72.7	131.4	161	-164.3	0	0	0	0	119.5	E125	E125-S127 PolarHBondContact O-N 3.31Å; E125-S127 VanDerWaalsContact O-N 3.15Å
128	D	37	Very low	54.1	Low	165 Å²	165	135.1 Å²	135.1	88%	0.882	74%	0.741	S	S	*	*			trans	-62.5	138.2	169.6	-57.2	-87.5	0	0	0	112.8
129	G	42.3	Very low	52.3	Low	70 Å²	70	131.5 Å²	131.5	72%	0.722	74%	0.741	S	S	*	*			trans	-176.7	8.9	-174.9	0	0	0	0	0	120.8	K131	G129-K131 PolarHBondContact O-N 3.46Å
130	N	41.1	Very low	50.6	Low	153 Å²	153	131.7 Å²	131.7	82%	0.818	75%	0.752	S	S	*	*			trans	39.4	75.2	164.3	-174.1	22.4	0	0	0	118.4
131	K	45.3	Very low	48.6	Very low	203 Å²	203	132.7 Å²	132.7	88%	0.883	77%	0.768	S	S	*	*			trans	-173.3	106.1	145.3	-100.8	146.5	-169.4	173.6	0	111.6	G129	G129-K131 PolarHBondContact O-N 3.46Å
132	V	34.9	Very low	46.7	Very low	146 Å²	146	137 Å²	137	89%	0.885	79%	0.791	S	S	*	*			trans	-80.8	127	177.7	-180	0	0	0	0	111
133	K	47.2	Very low	44.8	Very low	199 Å²	199	138.1 Å²	138.1	87%	0.865	80%	0.801	S	S	*	*			trans	-134.8	143.3	158.1	-82.8	-169.2	174.5	-177.7	0	110.1
134	T	45.2	Very low	43.1	Very low	132 Å²	132	139 Å²	139	81%	0.81	81%	0.808	S	S	*	*			trans	-67.4	140.1	-166.7	-40.3	0	0	0	0	113.3
135	F	34.4	Very low	41.7	Very low	205 Å²	205	138.9 Å²	138.9	90%	0.899	81%	0.807	S	S	*	*			trans	-65.8	144.2	173.5	-75.3	-93.2	0	0	0	112.3
136	V	40.7	Very low	40.6	Very low	131 Å²	131	137.9 Å²	137.9	79%	0.794	80%	0.802	S	S	*	*			trans	-112.9	140.7	-174.6	171.6	0	0	0	0	111.4
137	R	39.3	Very low	40	Very low	245 Å²	245	141.3 Å²	141.3	93%	0.925	80%	0.8	S	S	*	*			trans	-81	114.7	166.6	-166.6	74.9	170.1	162.1	-0.8	108.3
138	G	45.9	Very low	39.7	Very low	72 Å²	72	143.1 Å²	143.1	74%	0.742	80%	0.796	S	S	*	*			trans	-70	171.5	-171	0	0	0	0	0	115.8
139	G	45.1	Very low	39.8	Very low	63 Å²	63	142.6 Å²	142.6	65%	0.649	79%	0.788	S	S	*	*			cis	174.9	-157.7	3.3	0	0	0	0	0	113.2
140	V	43.4	Very low	39.5	Very low	149 Å²	149	144.6 Å²	144.6	90%	0.903	79%	0.787	S	S	*	*			trans	61.9	143.2	-174.3	-113.7	0	0	0	0	114.1
141	V	38.5	Very low	39.2	Very low	141 Å²	141	143.8 Å²	143.8	86%	0.855	78%	0.782	S	S	*	*			cis	-127.8	173.4	10.7	-174.9	0	0	0	0	110.4
142	N	36.7	Very low	38.8	Very low	157 Å²	157	140.5 Å²	140.5	84%	0.84	77%	0.77	S	S	*	*			trans	-115.5	176.8	-165.7	-154.5	8.7	0	0	0	114.1
143	A	37.9	Very low	39.3	Very low	93 Å²	93	141.8 Å²	141.8	77%	0.769	76%	0.764	S	S	*	*			trans	88.5	136.7	172.5	0	0	0	0	0	116.6
144	A	37.2	Very low	38.9	Very low	96 Å²	96	144.1 Å²	144.1	79%	0.793	77%	0.767	S	S	*	*			cis	-151.5	-176.1	-1.6	0	0	0	0	0	113.1
145	K	35.5	Very low	38.4	Very low	153 Å²	153	141.3 Å²	141.3	67%	0.665	76%	0.764	S	S	*	*			trans	-16.5	154.7	160.5	-84.9	164.8	143.3	-71.3	0	117.7	E147	K145-E147 IonicContact NZ-OE1 3.41Å; K145-E147 PolarHBondContact NZ-OE1 3.39Å
146	E	36.7	Very low	38.8	Very low	141 Å²	141	141.6 Å²	141.6	66%	0.659	77%	0.765	S	S	*	*			cis	-157.2	-179.6	33.8	-140.1	135.8	-127.5	0	0	114.6
147	E	33.9	Very low	38.7	Very low	141 Å²	141	144 Å²	144	66%	0.659	77%	0.772	S	S	*	*			trans	-37.5	161.7	167.9	-63.4	121.4	-126.9	0	0	115.8	K145	K145-E147 IonicContact NZ-OE1 3.41Å; K145-E147 PolarHBondContact NZ-OE1 3.39Å
148	H	36.4	Very low	38.8	Very low	150 Å²	150	141.6 Å²	141.6	69%	0.694	76%	0.764	S	S	*	*			cis	-161.4	179.2	13.7	-134.1	-146.4	0	0	0	107.5
149	E	39.1	Very low	38.3	Very low	154 Å²	154	147.3 Å²	147.3	72%	0.72	77%	0.768	S	S	*	*			cis	-155.2	-125.4	0.6	-161.3	163.9	174.1	0	0	110.6
150	T	34.1	Very low	38	Very low	113 Å²	113	149.2 Å²	149.2	69%	0.693	77%	0.77	S	S	*	*			trans	-83.1	166.7	176.5	45.7	0	0	0	0	113.2
151	D	36.1	Very low	37.6	Very low	135 Å²	135	147.8 Å²	147.8	72%	0.722	77%	0.766	S	S	*	*			cis	-158.8	179	32.6	-152.1	9.4	0	0	0	116.8
152	E	36.4	Very low	37.6	Very low	135 Å²	135	145.9 Å²	145.9	63%	0.631	76%	0.759	S	S	*	*			trans	-55.4	136.5	-173.2	-44.1	175.4	132.3	0	0	117.6
153	K	46.2	Very low	37.5	Very low	172 Å²	172	149.1 Å²	149.1	75%	0.748	76%	0.759	S	S	*	*				177.8	156.2	104.6	-92.5	147.9	-163	93.2	0	115.6
154	R	38.2	Very low	37.4	Very low	249 Å²	249	154.6 Å²	154.6	94%	0.94	77%	0.766	S	S	*	*			trans	-56.6	144.3	-178.7	-50.7	165.7	-172.6	-177.6	0.7	111.4
155	G	35.2	Very low	37.3	Very low	73 Å²	73	153.4 Å²	153.4	75%	0.753	76%	0.757	S	S	*	*			cis	108.5	92.8	13.6	0	0	0	0	0	112.2
156	K	42	Very low	37.3	Very low	211 Å²	211	153.2 Å²	153.2	92%	0.917	76%	0.763	S	S	*	*			trans	-153.3	105.3	175.5	-85.7	177.1	-179.3	172.5	0	111.7
157	I	38.7	Very low	37.4	Very low	182 Å²	182	153.9 Å²	153.9	93%	0.933	77%	0.766	S	S	*	*			trans	-129.8	153.4	159.8	-80	-177.3	0	0	0	108.4
158	Y	40.9	Very low	37.6	Very low	193 Å²	193	155.3 Å²	155.3	76%	0.757	77%	0.77	S	S	*	*			trans	-90.4	147.5	-144.6	173.6	-99.7	0	0	0	115.7	P160	Y158-P160 HydrophobicContact CE1-CB 4.13Å; Y158-P160 HydrophobicContact CE1-CG 3.86Å
159	K	35.5	Very low	37.5	Very low	192 Å²	192	155.5 Å²	155.5	84%	0.835	78%	0.776	S	S	*	*			trans	-131.1	132.1	163.1	-68.1	-177.8	179.5	-178.3	0	108.9
160	P	39.1	Very low	37.8	Very low	104 Å²	104	153.7 Å²	153.7	68%	0.675	78%	0.777	S	S	*	*			trans	-89.9	124.1	154.3	31.4	-23.5	0	0	0	109.4	Y158	Y158-P160 HydrophobicContact CE1-CB 4.13Å; Y158-P160 HydrophobicContact CE1-CG 3.86Å
161	S	35.3	Very low	38.2	Very low	118 Å²	118	152.9 Å²	152.9	83%	0.825	77%	0.774	S	S	*	*			trans	-112.5	147.7	168.9	-173.9	0	0	0	0	109.7
162	S	38.1	Very low	38	Very low	102 Å²	102	152.8 Å²	152.8	71%	0.713	77%	0.774	S	S	*	*			trans	-78.5	163.2	165.6	-177.2	0	0	0	0	111.2
163	R	34.4	Very low	38	Very low	224 Å²	224	154 Å²	154	85%	0.845	78%	0.78	S	S	*	*			trans	90.4	112.9	169.8	-58.3	-178.1	168.3	-160	-4.9	119.9
164	F	37.1	Very low	37.5	Very low	209 Å²	209	150.1 Å²	150.1	92%	0.917	77%	0.774	S	S	*	*			trans	-162.2	141.4	147.9	-84.1	-63.2	0	0	0	105.9
165	A	34.1	Very low	37.3	Very low	71 Å²	71	143.2 Å²	143.2	59%	0.587	76%	0.764	S	S	*	*			cis	69.8	121.7	8.1	0	0	0	0	0	115.7
166	D	36.2	Very low	37.2	Very low	149 Å²	149	145.8 Å²	145.8	80%	0.797	76%	0.76	S	S	*	*			cis	-154.5	165.6	-1.4	-88.9	-44.7	0	0	0	110
167	Q	37.8	Very low	37	Very low	154 Å²	154	142.1 Å²	142.1	72%	0.72	75%	0.746	S	S	*	*			trans	142.1	133.6	132.4	-75.3	-177.2	36.3	0	0	117.9
168	K	38.4	Very low	36.9	Very low	172 Å²	172	143.2 Å²	143.2	75%	0.748	74%	0.739	S	S	*	*			trans	79.3	89.3	147	-68.8	158.6	178	156.8	0	122.4
169	N	34.8	Very low	36.9	Very low	154 Å²	154	139 Å²	139	82%	0.824	74%	0.735	S	S	*	*				25.2	161.3	112.4	-60.8	13	0	0	0	121.9
170	P	44.7	Very low	37.4	Very low	115 Å²	115	135.4 Å²	135.4	75%	0.747	73%	0.731	S	S	*	*			cis	-142.9	-144.8	-40.9	44.6	-25.1	0	0	0	110.6
171	P	42.5	Very low	37.4	Very low	97 Å²	97	135.7 Å²	135.7	63%	0.63	74%	0.736	S	S	*	*			cis	-121.9	-172.7	-42.7	39.5	-23.5	0	0	0	113.7
172	N	32.8	Very low	37.6	Very low	132 Å²	132	137.7 Å²	137.7	71%	0.706	74%	0.736	S	S	*	*			trans	67	160.1	160.4	-67.1	-1	0	0	0	117.4
173	Q	36.4	Very low	37.6	Very low	162 Å²	162	140.5 Å²	140.5	76%	0.757	74%	0.743	S	S	*	*			cis	-170.5	163.2	-16.3	-103.6	165.8	-43.8	0	0	106.4
174	S	36.2	Very low	37.6	Very low	89 Å²	89	135.9 Å²	135.9	62%	0.622	74%	0.739	S	S	*	*			cis	-174.4	166.3	-25.6	48.8	0	0	0	0	109.7
175	S	32.6	Very low	37.7	Very low	104 Å²	104	133.9 Å²	133.9	73%	0.727	74%	0.736	S	S	*	*			trans	63.7	153.6	170.4	39.9	0	0	0	0	117.6
176	N	33.5	Very low	37.9	Very low	128 Å²	128	137.5 Å²	137.5	68%	0.684	74%	0.741	S	S	*	*			cis	-155.9	153.3	0.4	-121.4	21.2	0	0	0	112.2
177	E	38.2	Very low	37.8	Very low	133 Å²	133	136.2 Å²	136.2	62%	0.621	74%	0.738	S	S	*	*			trans	53.3	156.2	140.3	-62	-165.7	111.9	0	0	122.4
178	R	37.3	Very low	37.7	Very low	205 Å²	205	138.3 Å²	138.3	77%	0.774	75%	0.745	S	S	*	*			cis	-176.3	176.9	-17.1	-106.1	-166.1	157.1	144.9	-22	108.3
179	P	39.3	Very low	37.5	Very low	106 Å²	106	139.7 Å²	139.7	69%	0.688	75%	0.751	S	S	*	*				-137.6	-141.5	-53.8	49.2	-28.4	0	0	0	110.9
180	P	46.6	Very low	37.5	Very low	115 Å²	115	138 Å²	138	75%	0.747	75%	0.749	S	S	*	*			trans	-138.3	-167.6	-136.9	38.6	-12.2	0	0	0	116.7
181	S	38.8	Very low	37.1	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	75%	0.752	S	S	*	*				147.6	137.8	114.3	63.4	0	0	0	0	115.1
182	L	38.9	Very low	36.7	Very low	159 Å²	159	142 Å²	142	83%	0.832	76%	0.764	S	S	*	*			trans	-162.9	106.7	130.8	-153.7	141	0	0	0	112.1
183	L	39.1	Very low	37	Very low	162 Å²	162	145.7 Å²	145.7	85%	0.848	77%	0.774	S	S	*	*			trans	37.1	147.8	156.9	-55.7	178.5	0	0	0	124
184	V	34.5	Very low	36.8	Very low	127 Å²	127	148.2 Å²	148.2	77%	0.77	78%	0.783	S	S	*	*			trans	-146.5	152.1	-175.5	166.5	0	0	0	0	108.7
185	I	39.9	Very low	36.5	Very low	166 Å²	166	147.6 Å²	147.6	85%	0.851	79%	0.79	S	S	*	*			trans	-125.5	123.7	158.9	-59.7	-176.5	0	0	0	111.6
186	E	37.6	Very low	36.6	Very low	147 Å²	147	152 Å²	152	69%	0.687	80%	0.799	S	S	*	*			trans	-38.4	148.1	175.6	-50.4	-176.5	154.3	0	0	116.3
187	T	33.2	Very low	36.6	Very low	122 Å²	122	155.4 Å²	155.4	75%	0.748	81%	0.808	S	S	*	*			cis	82.4	124.6	27.5	86.2	0	0	0	0	118.6
188	K	36.2	Very low	36.7	Very low	198 Å²	198	158.4 Å²	158.4	86%	0.861	82%	0.822	S	S	*	*			trans	-167.5	150.4	148.9	-105	148	-170.1	158.2	0	111.7
189	K	33.9	Very low	37.2	Very low	201 Å²	201	158.1 Å²	158.1	87%	0.874	83%	0.827	S	S	*	*			trans	-141.2	150.3	176.9	-84.5	-179.8	176	172.9	0	107.2
190	P	35.6	Very low	37.8	Very low	119 Å²	119	163 Å²	163	77%	0.773	84%	0.837	S	S	*	*				-155.2	-153.3	85.6	38.2	-14.9	0	0	0	112.8
191	P	36.4	Very low	38.5	Very low	124 Å²	124	162.5 Å²	162.5	81%	0.805	82%	0.823	S	S	*	*				-117.4	-174	-61.5	31.3	-14.1	0	0	0	113.4
192	L	33.4	Very low	40.2	Very low	171 Å²	171	160.5 Å²	160.5	90%	0.895	81%	0.809	S	S	*	*			trans	-64.8	142.8	-176.8	-67.6	154.6	0	0	0	115.8
193	K	39.1	Very low	41.8	Very low	211 Å²	211	159.6 Å²	159.6	92%	0.917	81%	0.805	S	S	*	*			trans	-150.5	166.4	146.7	-113.8	171.8	-172.5	177.1	0	111.9	G195	K193-G195 PolarHBondContact O-N 3.5Å
194	K	32.3	Very low	43.3	Very low	214 Å²	214	157.2 Å²	157.2	93%	0.93	79%	0.792	S	S	*	*			trans	-77.9	111.4	-163.2	-70.8	176.5	176.6	175.5	0	114.3
195	G	30.3	Very low	45.2	Very low	76 Å²	76	156.1 Å²	156.1	78%	0.784	78%	0.779	S	S	*	*				27.7	140.6	128.7	0	0	0	0	0	123.4	K193	K193-G195 PolarHBondContact O-N 3.5Å
196	E	35.5	Very low	46.9	Very low	197 Å²	197	152.5 Å²	152.5	92%	0.921	76%	0.761	S	S	*	*			trans	-132.8	170	143.1	-141.4	174.3	165.1	0	0	110.5
197	K	32.8	Very low	48.7	Very low	200 Å²	200	150.9 Å²	150.9	87%	0.87	75%	0.752	S	S	*	*			trans	-108.1	83.2	-165.5	-69.7	176.9	178.4	173	0	113.3
198	E	39.6	Very low	51.1	Low	195 Å²	195	151.4 Å²	151.4	91%	0.911	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-76.6	135.6	163.9	-67.4	-150.9	121.6	0	0	111.7
199	K	47.5	Very low	53.2	Low	200 Å²	200	146 Å²	146	87%	0.87	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-82.7	123.6	-173.7	-63.5	169.5	-176	171.1	0	109.1	K201	K199-K201 PolarHBondContact O-N 2.95Å; K199-K201 VanDerWaalsContact O-N 3.13Å
200	K	53	Low	55.3	Low	208 Å²	208	141.1 Å²	141.1	90%	0.904	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-61.2	116.1	169.8	-66.9	-173.7	176.6	-173	0	108.9
201	K	61.5	Low	57.5	Low	104 Å²	104	139.9 Å²	139.9	45%	0.452	69%	0.688	S	S	.	*	P	Polyproline II helix	trans	-52.8	145.1	172.9	-66.7	-177.8	-175.3	175.5	0	110.1	K199 E205 E209	K199-K201 PolarHBondContact O-N 2.95Å; K199-K201 VanDerWaalsContact O-N 3.13Å; K201-E205 WeakPolarHBondContact CA-OE2 3.42Å; K201-E205 HydrophobicContact CB-CB 4.37Å; K201-E205 HydrophobicContact CB-CG 4.34Å; K201-E205 WeakPolarHBondContact CB-OE2 3.43Å; K201-E209 WeakPolarHBondContact CD-OE2 3.31Å; K201-E209 IonicContact NZ-OE1 3.38Å; K201-E209 PolarHBondContact NZ-OE1 3.13Å; K201-E209 IonicContact NZ-OE2 4Å; K201-E209 PolarHBondContact NZ-OE2 3.26Å
202	S	75	Confident	59.8	Low	70 Å²	70	140.1 Å²	140.1	49%	0.49	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-67.6	151.7	176.8	178.8	0	0	0	0	110.9	L204 E205 L206	S202-L204 PolarHBondContact O-N 3.02Å; S202-L204 VanDerWaalsContact O-N 3.14Å; S202-L204 PolarHBondContact OG-N 3.24Å; S202-E205 PolarHBondContact N-OE2 3.05Å; S202-E205 WeakPolarHBondContact O-CA 3.37Å; S202-E205 VanDerWaalsContact O-CB 3.31Å; S202-E205 WeakPolarHBondContact O-CB 3.46Å; S202-E205 PolarHBondContact O-N 3.41Å; S202-L206 PolarHBondContact O-N 2.7Å
203	N	72.6	Confident	62	Low	139 Å²	139	138.2 Å²	138.2	74%	0.743	66%	0.663	S	S	*	*	H	α-helix	trans	-54.8	-32.7	171.5	-91.2	8.6	0	0	0	112.2	E205 F207	N203-E205 VanDerWaalsContact C-N 3.28Å; N203-E205 PolarHBondContact O-N 2.98Å; N203-F207 WeakPolarHBondContact O-CB 3.33Å; N203-F207 PolarHBondContact O-N 2.88Å
204	L	68.6	Low	64	Low	112 Å²	112	132.4 Å²	132.4	59%	0.586	64%	0.641	S	S	*	*	H	α-helix	trans	-69.4	-26	175.5	-174.6	65.7	0	0	0	112.9	S202 K208	S202-L204 PolarHBondContact O-N 3.02Å; S202-L204 VanDerWaalsContact O-N 3.14Å; S202-L204 PolarHBondContact OG-N 3.24Å; L204-K208 WeakPolarHBondContact O-CD 3.45Å; L204-K208 VanDerWaalsContact O-CG 3.25Å; L204-K208 WeakPolarHBondContact O-CG 3.39Å; L204-K208 PolarHBondContact O-N 3.27Å
205	E	75.5	Confident	66.1	Low	104 Å²	104	127.4 Å²	127.4	49%	0.486	62%	0.621	S	S	.	*	H	α-helix	trans	-85.6	-42.3	179.8	-169.7	168.8	-135.8	0	0	110.4	K201 S202 N203 F207 K208 E209	K201-E205 WeakPolarHBondContact CA-OE2 3.42Å; K201-E205 HydrophobicContact CB-CB 4.37Å; K201-E205 HydrophobicContact CB-CG 4.34Å; K201-E205 WeakPolarHBondContact CB-OE2 3.43Å; S202-E205 PolarHBondContact N-OE2 3.05Å; S202-E205 WeakPolarHBondContact O-CA 3.37Å; S202-E205 VanDerWaalsContact O-CB 3.31Å; S202-E205 WeakPolarHBondContact O-CB 3.46Å; S202-E205 PolarHBondContact O-N 3.41Å; N203-E205 VanDerWaalsContact C-N 3.28Å; N203-E205 PolarHBondContact O-N 2.98Å; E205-F207 PolarHBondContact O-N 2.85Å; E205-K208 PolarHBondContact O-N 3.08Å; E205-E209 WeakPolarHBondContact O-CB 3.44Å; E205-E209 PolarHBondContact O-N 3.17Å
206	L	75.8	Confident	68.5	Low	91 Å²	91	128.7 Å²	128.7	48%	0.476	61%	0.607	S	S	.	*	H	α-helix	trans	-53.3	-50.1	167	-110.5	161.2	0	0	0	111.7	S202 K208 E209 E210	S202-L206 PolarHBondContact O-N 2.7Å; L206-K208 VanDerWaalsContact C-N 3.32Å; L206-K208 PolarHBondContact O-N 3.25Å; L206-E209 WeakPolarHBondContact O-CB 3.33Å; L206-E209 PolarHBondContact O-N 3.23Å; L206-E209 VanDerWaalsContact O-N 3.13Å; L206-E210 WeakPolarHBondContact O-CB 3.47Å; L206-E210 PolarHBondContact O-N 3.2Å
207	F	74.1	Confident	70.5	Confident	112 Å²	112	124 Å²	124	49%	0.491	59%	0.585	S	S	.	*	H	α-helix	trans	-65.7	-30.8	178.6	-174.3	-112.5	0	0	0	113.5	N203 E205 L211	N203-F207 WeakPolarHBondContact O-CB 3.33Å; N203-F207 PolarHBondContact O-N 2.88Å; E205-F207 PolarHBondContact O-N 2.85Å; F207-L211 HydrophobicContact CD1-CD1 3.97Å; F207-L211 HydrophobicContact CE1-CD1 3.54Å; F207-L211 HydrophobicContact CE1-CG 4.3Å; F207-L211 HydrophobicContact CE2-CG 4.49Å; F207-L211 HydrophobicContact CZ-CD1 3.87Å; F207-L211 HydrophobicContact CZ-CG 4.23Å; F207-L211 WeakPolarHBondContact O-CB 3.48Å; F207-L211 WeakPolarHBondContact O-CG 3.32Å; F207-L211 PolarHBondContact O-N 2.93Å
208	K	83.7	Confident	72.3	Confident	134 Å²	134	122.3 Å²	122.3	58%	0.583	57%	0.573	S	S	*	*	H	α-helix	trans	-71.3	-36.6	171.9	-78.6	172.2	-179.8	-179.2	0	112.2	L204 E205 L206 K212	L204-K208 WeakPolarHBondContact O-CD 3.45Å; L204-K208 VanDerWaalsContact O-CG 3.25Å; L204-K208 WeakPolarHBondContact O-CG 3.39Å; L204-K208 PolarHBondContact O-N 3.27Å; E205-K208 PolarHBondContact O-N 3.08Å; L206-K208 VanDerWaalsContact C-N 3.32Å; L206-K208 PolarHBondContact O-N 3.25Å; K208-K212 WeakPolarHBondContact O-CB 3.5Å; K208-K212 PolarHBondContact O-N 3.19Å
209	E	80.2	Confident	74.1	Confident	83 Å²	83	117.4 Å²	117.4	39%	0.388	55%	0.553	S	S	.	*	H	α-helix	trans	-70.4	-40.4	177.4	-164.3	161.9	-132.8	0	0	111.1	K201 E205 L206 K212 Q213	K201-E209 WeakPolarHBondContact CD-OE2 3.31Å; K201-E209 IonicContact NZ-OE1 3.38Å; K201-E209 PolarHBondContact NZ-OE1 3.13Å; K201-E209 IonicContact NZ-OE2 4Å; K201-E209 PolarHBondContact NZ-OE2 3.26Å; E205-E209 WeakPolarHBondContact O-CB 3.44Å; E205-E209 PolarHBondContact O-N 3.17Å; L206-E209 WeakPolarHBondContact O-CB 3.33Å; L206-E209 PolarHBondContact O-N 3.23Å; L206-E209 VanDerWaalsContact O-N 3.13Å; E209-K212 PolarHBondContact O-N 2.78Å; E209-Q213 PolarHBondContact O-N 3.38Å
210	E	79.3	Confident	75.4	Confident	100 Å²	100	113.4 Å²	113.4	47%	0.467	54%	0.538	S	S	.	.	H	α-helix	trans	-61.7	-51.7	171.5	-178.3	179	-158.2	0	0	112.2	L206 K212 Q213 I214	L206-E210 WeakPolarHBondContact O-CB 3.47Å; L206-E210 PolarHBondContact O-N 3.2Å; E210-K212 PolarHBondContact O-N 3.14Å; E210-Q213 PolarHBondContact O-N 2.96Å; E210-Q213 VanDerWaalsContact O-N 3.11Å; E210-I214 HydrophobicContact CG-CD1 4.04Å; E210-I214 WeakPolarHBondContact O-CG1 3.11Å; E210-I214 PolarHBondContact O-N 2.64Å
211	L	82.2	Confident	76.2	Confident	92 Å²	92	109.7 Å²	109.7	48%	0.482	52%	0.518	S	S	.	.	H	α-helix	trans	-58.9	-34.7	175	-80.5	173.7	0	0	0	112.5	F207 Q215	F207-L211 HydrophobicContact CD1-CD1 3.97Å; F207-L211 HydrophobicContact CE1-CD1 3.54Å; F207-L211 HydrophobicContact CE1-CG 4.3Å; F207-L211 HydrophobicContact CE2-CG 4.49Å; F207-L211 HydrophobicContact CZ-CD1 3.87Å; F207-L211 HydrophobicContact CZ-CG 4.23Å; F207-L211 WeakPolarHBondContact O-CB 3.48Å; F207-L211 WeakPolarHBondContact O-CG 3.32Å; F207-L211 PolarHBondContact O-N 2.93Å; L211-Q215 PolarHBondContact O-N 3.13Å
212	K	84.8	Confident	76.7	Confident	130 Å²	130	112 Å²	112	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-68.4	-46.2	174.2	-170.2	-165.3	168.5	-147.4	0	111.2	K208 E209 E210 I214 Q215 E216	K208-K212 WeakPolarHBondContact O-CB 3.5Å; K208-K212 PolarHBondContact O-N 3.19Å; E209-K212 PolarHBondContact O-N 2.78Å; E210-K212 PolarHBondContact O-N 3.14Å; K212-I214 VanDerWaalsContact C-N 3.35Å; K212-I214 PolarHBondContact O-N 3.39Å; K212-Q215 PolarHBondContact O-N 3.41Å; K212-E216 WeakPolarHBondContact CE-OE2 3.46Å; K212-E216 IonicContact NZ-OE2 2.77Å; K212-E216 PolarHBondContact NZ-OE2 3.44Å; K212-E216 WeakPolarHBondContact O-CB 3.29Å; K212-E216 PolarHBondContact O-N 3.5Å
213	Q	79.8	Confident	76.6	Confident	131 Å²	131	116.2 Å²	116.2	61%	0.612	54%	0.539	S	S	*	.	H	α-helix	trans	-59.1	-43.3	176.1	-80	-174.4	-15.6	0	0	112.1	E209 E210 Q215 E216 E217	E209-Q213 PolarHBondContact O-N 3.38Å; E210-Q213 PolarHBondContact O-N 2.96Å; E210-Q213 VanDerWaalsContact O-N 3.11Å; Q213-Q215 VanDerWaalsContact C-N 3.28Å; Q213-Q215 PolarHBondContact O-N 2.95Å; Q213-E216 PolarHBondContact O-N 3.44Å; Q213-E217 VanDerWaalsContact O-CB 3.3Å; Q213-E217 WeakPolarHBondContact O-CB 3.41Å; Q213-E217 PolarHBondContact O-N 3.18Å
214	I	79.1	Confident	76	Confident	88 Å²	88	113.4 Å²	113.4	45%	0.451	53%	0.527	S	S	.	.	H	α-helix	trans	-61.4	-37.6	177.6	-68.4	166.2	0	0	0	111.4	E210 K212 R218	E210-I214 HydrophobicContact CG-CD1 4.04Å; E210-I214 WeakPolarHBondContact O-CG1 3.11Å; E210-I214 PolarHBondContact O-N 2.64Å; K212-I214 VanDerWaalsContact C-N 3.35Å; K212-I214 PolarHBondContact O-N 3.39Å; I214-R218 VanDerWaalsContact O-CB 3.32Å; I214-R218 WeakPolarHBondContact O-CB 3.43Å; I214-R218 PolarHBondContact O-N 2.86Å
215	Q	77.5	Confident	75.5	Confident	110 Å²	110	116.1 Å²	116.1	51%	0.514	54%	0.535	S	S	.	.	H	α-helix	trans	-70.8	-43.1	175.1	-171.2	63.4	57.5	0	0	111.8	L211 K212 Q213 R218 D219	L211-Q215 PolarHBondContact O-N 3.13Å; K212-Q215 PolarHBondContact O-N 3.41Å; Q213-Q215 VanDerWaalsContact C-N 3.28Å; Q213-Q215 PolarHBondContact O-N 2.95Å; Q215-R218 PolarHBondContact O-N 3.31Å; Q215-D219 PolarHBondContact NE2-OD1 3.14Å; Q215-D219 PolarHBondContact O-N 2.92Å
216	E	80.3	Confident	74.2	Confident	103 Å²	103	114.4 Å²	114.4	48%	0.481	54%	0.544	S	S	.	.	H	α-helix	trans	-67.3	-43.1	-178.7	-167.2	151.8	-153.2	0	0	111.8	K212 Q213 R218 D219 E220	K212-E216 WeakPolarHBondContact CE-OE2 3.46Å; K212-E216 IonicContact NZ-OE2 2.77Å; K212-E216 PolarHBondContact NZ-OE2 3.44Å; K212-E216 WeakPolarHBondContact O-CB 3.29Å; K212-E216 PolarHBondContact O-N 3.5Å; Q213-E216 PolarHBondContact O-N 3.44Å; E216-R218 VanDerWaalsContact C-N 3.28Å; E216-R218 PolarHBondContact O-N 3.14Å; E216-D219 PolarHBondContact O-N 3Å; E216-E220 WeakPolarHBondContact O-CB 3.49Å; E216-E220 VanDerWaalsContact O-CG 3.3Å; E216-E220 WeakPolarHBondContact O-CG 3.31Å; E216-E220 PolarHBondContact O-N 3.39Å
217	E	78.4	Confident	72.9	Confident	99 Å²	99	120.4 Å²	120.4	46%	0.463	56%	0.561	S	S	.	*	H	α-helix	trans	-64.9	-30	173.6	-161.6	-150.7	173.6	0	0	112.3	Q213 R221	Q213-E217 VanDerWaalsContact O-CB 3.3Å; Q213-E217 WeakPolarHBondContact O-CB 3.41Å; Q213-E217 PolarHBondContact O-N 3.18Å; E217-R221 VanDerWaalsContact CD-NH1 3.31Å; E217-R221 WeakPolarHBondContact O-CB 3.3Å; E217-R221 WeakPolarHBondContact O-CG 3.47Å; E217-R221 PolarHBondContact O-N 2.87Å; E217-R221 VanDerWaalsContact O-N 3.1Å; E217-R221 PolarHBondContact O-NE 3.46Å; E217-R221 IonicContact OE1-CZ 2.7Å; E217-R221 IonicContact OE1-NH1 2.71Å; E217-R221 PolarHBondContact OE1-NH1 3.46Å; E217-R221 IonicContact OE1-NH2 3.38Å; E217-R221 PolarHBondContact OE1-NH2 3.43Å; E217-R221 IonicContact OE2-CZ 3.68Å; E217-R221 IonicContact OE2-NH1 2.81Å; E217-R221 IonicContact OE2-NH2 3.68Å; E217-R221 PolarHBondContact OE2-NH2 2.86Å
218	R	69.2	Low	71.5	Confident	163 Å²	163	122 Å²	122	62%	0.615	57%	0.574	S	S	*	*	H	α-helix	trans	-74.8	-40.6	175.6	-161.2	176.4	-164.6	103.7	2.7	111.6	I214 Q215 E216 H222	I214-R218 VanDerWaalsContact O-CB 3.32Å; I214-R218 WeakPolarHBondContact O-CB 3.43Å; I214-R218 PolarHBondContact O-N 2.86Å; Q215-R218 PolarHBondContact O-N 3.31Å; E216-R218 VanDerWaalsContact C-N 3.28Å; E216-R218 PolarHBondContact O-N 3.14Å; R218-H222 PolarHBondContact O-N 3.44Å; R218-H222 VanDerWaalsContact O-N 3.1Å
219	D	77.9	Confident	69.4	Low	93 Å²	93	121.3 Å²	121.3	50%	0.497	59%	0.586	S	S	.	*	H	α-helix	trans	-69.5	-39.6	175.2	-73	-6.5	0	0	0	111.3	Q215 E216 H222 K223	Q215-D219 PolarHBondContact NE2-OD1 3.14Å; Q215-D219 PolarHBondContact O-N 2.92Å; E216-D219 PolarHBondContact O-N 3Å; D219-H222 WeakPolarHBondContact O-CB 3.37Å; D219-H222 PolarHBondContact O-N 2.95Å; D219-K223 WeakPolarHBondContact O-CB 3.4Å; D219-K223 PolarHBondContact O-N 3.28Å
220	E	74.8	Confident	67.3	Low	116 Å²	116	127.9 Å²	127.9	54%	0.542	61%	0.607	S	S	.	*	H	α-helix	trans	-58.9	-48.4	171.8	-75.9	-116.9	113.9	0	0	112	E216 H222 K223 T224	E216-E220 WeakPolarHBondContact O-CB 3.49Å; E216-E220 VanDerWaalsContact O-CG 3.3Å; E216-E220 WeakPolarHBondContact O-CG 3.31Å; E216-E220 PolarHBondContact O-N 3.39Å; E220-H222 VanDerWaalsContact C-N 3.27Å; E220-H222 PolarHBondContact O-N 2.96Å; E220-K223 CarbonylContact O-C 3.58Å; E220-K223 WeakPolarHBondContact O-CA 3.28Å; E220-K223 WeakPolarHBondContact O-CB 3.29Å; E220-K223 PolarHBondContact O-N 3.44Å; E220-T224 PolarHBondContact O-N 2.87Å; E220-T224 PolarHBondContact O-OG1 3.25Å
221	R	70.8	Confident	65.3	Low	129 Å²	129	133.2 Å²	133.2	49%	0.487	63%	0.629	S	S	.	*	H	α-helix	trans	-61.5	-33.9	175.7	-79.5	-176.1	-70.7	-138.6	-2.3	112.8	E217 K223 T224 K225	E217-R221 VanDerWaalsContact CD-NH1 3.31Å; E217-R221 WeakPolarHBondContact O-CB 3.3Å; E217-R221 WeakPolarHBondContact O-CG 3.47Å; E217-R221 PolarHBondContact O-N 2.87Å; E217-R221 VanDerWaalsContact O-N 3.1Å; E217-R221 PolarHBondContact O-NE 3.46Å; E217-R221 IonicContact OE1-CZ 2.7Å; E217-R221 IonicContact OE1-NH1 2.71Å; E217-R221 PolarHBondContact OE1-NH1 3.46Å; E217-R221 IonicContact OE1-NH2 3.38Å; E217-R221 PolarHBondContact OE1-NH2 3.43Å; E217-R221 IonicContact OE2-CZ 3.68Å; E217-R221 IonicContact OE2-NH1 2.81Å; E217-R221 IonicContact OE2-NH2 3.68Å; E217-R221 PolarHBondContact OE2-NH2 2.86Å; R221-K223 VanDerWaalsContact C-N 3.32Å; R221-T224 PolarHBondContact O-OG1 2.95Å; R221-K225 VanDerWaalsContact O-CB 3.3Å; R221-K225 WeakPolarHBondContact O-CB 3.44Å; R221-K225 PolarHBondContact O-N 3.14Å; R221-K225 VanDerWaalsContact O-N 3.15Å
222	H	70.6	Confident	63	Low	152 Å²	152	137.2 Å²	137.2	70%	0.704	65%	0.645	S	S	*	*	H	α-helix	trans	-67.2	-33.2	171.9	-117.5	-64	0	0	0	112.8	R218 D219 E220	R218-H222 PolarHBondContact O-N 3.44Å; R218-H222 VanDerWaalsContact O-N 3.1Å; D219-H222 WeakPolarHBondContact O-CB 3.37Å; D219-H222 PolarHBondContact O-N 2.95Å; E220-H222 VanDerWaalsContact C-N 3.27Å; E220-H222 PolarHBondContact O-N 2.96Å
223	K	73.3	Confident	60.9	Low	159 Å²	159	136.9 Å²	136.9	69%	0.691	66%	0.656	S	S	*	*	H	α-helix	trans	-80	-33	-177.1	-154.5	175	-172.4	179.9	0	112.8	D219 E220 R221	D219-K223 WeakPolarHBondContact O-CB 3.4Å; D219-K223 PolarHBondContact O-N 3.28Å; E220-K223 CarbonylContact O-C 3.58Å; E220-K223 WeakPolarHBondContact O-CA 3.28Å; E220-K223 WeakPolarHBondContact O-CB 3.29Å; E220-K223 PolarHBondContact O-N 3.44Å; R221-K223 VanDerWaalsContact C-N 3.32Å
224	T	60.6	Low	58.8	Low	80 Å²	80	136.1 Å²	136.1	49%	0.491	66%	0.662	S	S	.	*	H	α-helix	trans	-80.6	-43.5	175.9	54.2	0	0	0	0	112.3	E220 R221 G226 R227	E220-T224 PolarHBondContact O-N 2.87Å; E220-T224 PolarHBondContact O-OG1 3.25Å; R221-T224 PolarHBondContact O-OG1 2.95Å; T224-G226 PolarHBondContact O-N 3.42Å; T224-G226 VanDerWaalsContact O-N 3.15Å; T224-R227 PolarHBondContact O-N 3Å
225	K	57.2	Low	56.8	Low	170 Å²	170	141.1 Å²	141.1	74%	0.739	68%	0.684	S	S	*	*	H	α-helix	trans	-58.6	-29.4	176.5	-163.9	170.2	-175.5	178.4	0	112.2	R221 R227	R221-K225 VanDerWaalsContact O-CB 3.3Å; R221-K225 WeakPolarHBondContact O-CB 3.44Å; R221-K225 PolarHBondContact O-N 3.14Å; R221-K225 VanDerWaalsContact O-N 3.15Å; K225-R227 VanDerWaalsContact C-N 3.28Å; K225-R227 PolarHBondContact O-N 3.29Å
226	G	48	Very low	54.9	Low	67 Å²	67	141.1 Å²	141.1	69%	0.691	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-5.9	172.9	0	0	0	0	0	116.8	T224	T224-G226 PolarHBondContact O-N 3.42Å; T224-G226 VanDerWaalsContact O-N 3.15Å
227	R	50	Low	52.6	Low	217 Å²	217	144 Å²	144	82%	0.819	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-17.5	175	-70.2	-157.6	-169.7	-139.8	11.8	114.9	T224 K225	T224-R227 PolarHBondContact O-N 3Å; K225-R227 VanDerWaalsContact C-N 3.28Å; K225-R227 PolarHBondContact O-N 3.29Å
228	L	43.8	Very low	50.9	Low	146 Å²	146	145.3 Å²	145.3	76%	0.764	74%	0.735	S	S	*	*	S	Bend	trans	-87.4	-8.8	-170.4	-77.6	157.5	0	0	0	114.5	R230	L228-R230 VanDerWaalsContact C-N 3.26Å; L228-R230 PolarHBondContact O-N 3.24Å; L228-R230 VanDerWaalsContact O-N 3.1Å
229	S	39.1	Very low	49.4	Very low	119 Å²	119	145.1 Å²	145.1	83%	0.832	75%	0.746	S	S	*	*	S	Bend	trans	-86.3	57.8	174.3	-169.4	0	0	0	0	111.6
230	R	37	Very low	47.5	Very low	222 Å²	222	144.2 Å²	144.2	84%	0.838	76%	0.759	S	S	*	*			trans	-160.7	52.5	174.9	-157.1	-171.7	-64.8	-166.7	-1.7	114.4	L228	L228-R230 VanDerWaalsContact C-N 3.26Å; L228-R230 PolarHBondContact O-N 3.24Å; L228-R230 VanDerWaalsContact O-N 3.1Å
231	F	37.2	Very low	45.8	Very low	212 Å²	212	146.3 Å²	146.3	93%	0.93	77%	0.769	S	S	*	*			trans	-150.4	121	159.4	-112.8	-80.9	0	0	0	109
232	E	34.1	Very low	44.3	Very low	176 Å²	176	150.8 Å²	150.8	82%	0.822	79%	0.786	S	S	*	*			trans	-144.2	120	-179.6	-179.7	174.4	-145.1	0	0	107.3
233	P	41	Very low	42.7	Very low	122 Å²	122	154.8 Å²	154.8	79%	0.792	79%	0.794	S	S	*	*			trans	-91.6	126.5	179.2	32.9	-30	0	0	0	111.4
234	P	34.6	Very low	41.2	Very low	115 Å²	115	152.6 Å²	152.6	75%	0.747	80%	0.799	S	S	*	*			trans	-100.7	134.1	-174.2	35.8	-32.9	0	0	0	114.6
235	Q	37.9	Very low	40.2	Very low	194 Å²	194	157.2 Å²	157.2	91%	0.907	82%	0.817	S	S	*	*			trans	179.6	149.2	156.3	-101.6	156.1	4.9	0	0	108.2
236	S	37.2	Very low	39.3	Very low	109 Å²	109	156.5 Å²	156.5	76%	0.762	82%	0.822	S	S	*	*			cis	-154.6	155.9	-1.9	51.1	0	0	0	0	110.9
237	D	33.1	Very low	38.8	Very low	163 Å²	163	158 Å²	158	87%	0.872	83%	0.828	S	S	*	*			trans	-74.7	159.1	-172.6	-44.1	-99.2	0	0	0	115.9
238	S	41.8	Very low	38.3	Very low	127 Å²	127	153.4 Å²	153.4	89%	0.888	83%	0.826	S	S	*	*			trans	-154.9	144.3	150	-160.8	0	0	0	0	111.1
239	D	36.8	Very low	38.1	Very low	159 Å²	159	152 Å²	152	85%	0.85	83%	0.828	S	S	*	*			trans	-89.5	155.9	-165.6	-98	-62.8	0	0	0	115.4
240	G	38.6	Very low	38.1	Very low	75 Å²	75	157.7 Å²	157.7	77%	0.773	83%	0.832	S	S	*	*			trans	-168.6	79.9	178.5	0	0	0	0	0	116.4
241	Q	39.8	Very low	38.2	Very low	159 Å²	159	158.1 Å²	158.1	74%	0.743	83%	0.833	S	S	*	*			trans	-63.3	154.1	176.3	-57.2	152.7	-84.7	0	0	111.9
242	R	37.8	Very low	38.2	Very low	223 Å²	223	155.1 Å²	155.1	84%	0.842	83%	0.827	S	S	*	*				-165.3	135.4	55.5	-72.5	178.4	-176.1	-143.1	-2	108.8
243	R	37.8	Very low	38.3	Very low	236 Å²	236	157.9 Å²	157.9	89%	0.891	83%	0.83	S	S	*	*				81.4	146.9	72.1	-83.1	-159.8	177.8	-145.8	1.8	117.5
244	S	41.8	Very low	38.2	Very low	114 Å²	114	157.2 Å²	157.2	80%	0.797	83%	0.828	S	S	*	*			trans	82.6	139	175.2	-86.9	0	0	0	0	117.7
245	M	40.9	Very low	38.3	Very low	176 Å²	176	157.5 Å²	157.5	87%	0.867	83%	0.832	S	S	*	*			cis	-156.4	155.8	-7.5	-151.1	165.9	-176.2	0	0	113.5
246	D	36.9	Very low	38	Very low	155 Å²	155	151.6 Å²	151.6	83%	0.829	82%	0.824	S	S	*	*			trans	-85.8	149.3	177.6	-50.1	-101.2	0	0	0	115
247	A	37.7	Very low	38	Very low	100 Å²	100	153.1 Å²	153.1	83%	0.826	83%	0.828	S	S	*	*			trans	-173.3	124.3	146.5	0	0	0	0	0	114.1
248	P	40.5	Very low	38.3	Very low	120 Å²	120	153.2 Å²	153.2	78%	0.779	83%	0.828	S	S	*	*			trans	-126.9	142.7	173.2	38	-26.3	0	0	0	115.6
249	S	38.9	Very low	37.9	Very low	115 Å²	115	153.4 Å²	153.4	80%	0.804	82%	0.819	S	S	*	*			trans	175.9	145.4	149	-91	0	0	0	0	117.2
250	R	39.4	Very low	38	Very low	240 Å²	240	150.9 Å²	150.9	91%	0.906	81%	0.806	S	S	*	*			trans	125.3	90.6	158.2	-71.2	167.1	-165.1	-131.6	4.9	111.3
251	R	38.9	Very low	38.1	Very low	230 Å²	230	157.2 Å²	157.2	87%	0.868	81%	0.807	S	S	*	*				77.6	126.8	69	-74.8	-164.8	-176.2	-178.8	4	116.1
252	N	37.1	Very low	38.3	Very low	149 Å²	149	152.7 Å²	152.7	80%	0.797	80%	0.798	S	S	*	*			trans	71.2	131.9	164.3	-56.9	-1.5	0	0	0	115.7
253	R	36.6	Very low	38.6	Very low	235 Å²	235	147.6 Å²	147.6	89%	0.887	79%	0.793	S	S	*	*			cis	-147.1	166.7	38	-75.6	-175.2	173.1	-149.9	-0.9	115.6
254	S	38	Very low	38.9	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	77%	0.765	S	S	*	*			trans	-12.6	155.7	153.7	54.3	0	0	0	0	120.4
255	S	37.4	Very low	39	Very low	120 Å²	120	136.9 Å²	136.9	84%	0.839	76%	0.759	S	S	*	*			cis	-174.6	140.4	-0.6	157.8	0	0	0	0	112.1
256	G	30.8	Very low	39.7	Very low	70 Å²	70	133.7 Å²	133.7	72%	0.722	74%	0.742	S	S	*	*			trans	78.7	158.8	172.6	0	0	0	0	0	114.4
257	V	37.1	Very low	40.6	Very low	142 Å²	142	130.9 Å²	130.9	86%	0.861	73%	0.727	S	S	*	*			cis	-142	142.7	4	171.4	0	0	0	0	110.2
258	L	39.1	Very low	41.6	Very low	164 Å²	164	129.7 Å²	129.7	86%	0.859	71%	0.709	S	S	*	*			trans	16.3	126.1	162.5	-160.9	70.3	0	0	0	121.5
259	D	34.2	Very low	42.6	Very low	131 Å²	131	127 Å²	127	70%	0.701	70%	0.704	S	S	*	*			trans	-54.2	139.9	169.1	-78	-69.5	0	0	0	115.9	Y261	D259-Y261 HydrophobicContact CB-CD2 4.48Å; D259-Y261 VanDerWaalsContact OD1-CD2 3.32Å; D259-Y261 WeakPolarHBondContact OD1-CD2 3.36Å; D259-Y261 WeakPolarHBondContact OD1-CE2 3.25Å
260	D	39.3	Very low	44.2	Very low	107 Å²	107	124.3 Å²	124.3	57%	0.572	68%	0.68	S	S	*	*			trans	-133.3	65.6	160.5	-169.4	4.9	0	0	0	111.2	A262 R318	D260-A262 VanDerWaalsContact C-N 3.25Å; D260-A262 PolarHBondContact O-N 2.95Å; D260-R318 IonicContact OD1-NH2 2.67Å; D260-R318 IonicContact OD2-CZ 2.65Å; D260-R318 IonicContact OD2-NH1 2.74Å; D260-R318 PolarHBondContact OD2-NH1 3.42Å; D260-R318 IonicContact OD2-NH2 2.67Å; D260-R318 PolarHBondContact OD2-NH2 3.42Å
261	Y	39.9	Very low	45.9	Very low	207 Å²	207	117.7 Å²	117.7	81%	0.812	67%	0.668	S	S	*	*			trans	-69.2	76.3	174.3	-95.7	-84.1	0	0	0	112	D259 P263	D259-Y261 HydrophobicContact CB-CD2 4.48Å; D259-Y261 VanDerWaalsContact OD1-CD2 3.32Å; D259-Y261 WeakPolarHBondContact OD1-CD2 3.36Å; D259-Y261 WeakPolarHBondContact OD1-CE2 3.25Å; Y261-P263 WeakPolarHBondContact O-CD 3.3Å
262	A	45.6	Very low	47.9	Very low	65 Å²	65	110.5 Å²	110.5	54%	0.537	65%	0.653	S	S	.	*			trans	-65.6	120.4	167.2	0	0	0	0	0	110.1	D260 G264	D260-A262 VanDerWaalsContact C-N 3.25Å; D260-A262 PolarHBondContact O-N 2.95Å; A262-G264 PolarHBondContact O-N 3.2Å
263	P	42.7	Very low	50.4	Low	115 Å²	115	103.5 Å²	103.5	75%	0.747	62%	0.616	S	S	*	*			trans	-77.7	75.6	-179.6	32.7	-35.1	0	0	0	110.4	Y261	Y261-P263 WeakPolarHBondContact O-CD 3.3Å
264	G	43.5	Very low	53	Low	29 Å²	29	92.8 Å²	92.8	30%	0.299	58%	0.577	S	S	.	*			trans	-116.4	-12.5	-172.3	0	0	0	0	0	116.1	A262 H266	A262-G264 PolarHBondContact O-N 3.2Å; G264-H266 PolarHBondContact O-N 2.88Å
265	S	45.7	Very low	55.7	Low	97 Å²	97	88 Å²	88	68%	0.678	54%	0.543	S	S	*	.			trans	-66.7	103.9	172.6	-174.3	0	0	0	0	108.7	D267	S265-D267 VanDerWaalsContact C-N 3.28Å; S265-D267 PolarHBondContact O-N 3.5Å
266	H	53.7	Low	58.5	Low	108 Å²	108	82.3 Å²	82.3	50%	0.5	50%	0.503	S	S	.	.			trans	-101.3	41.8	-178.2	-144.9	-29.1	0	0	0	109.9	G264 V268 W352 K354	G264-H266 PolarHBondContact O-N 2.88Å; H266-V268 VanDerWaalsContact O-CG2 3.23Å; H266-V268 WeakPolarHBondContact O-CG2 3.49Å; H266-V268 PolarHBondContact O-N 2.84Å; H266-V268 VanDerWaalsContact O-N 3.11Å; H266-W352 CarbonylContact C-O 3.49Å; H266-K354 WeakPolarHBondContact NE2-CE 3.43Å; H266-K354 PolarHBondContact NE2-NZ 3.43Å
267	D	56.6	Low	61.5	Low	96 Å²	96	81.7 Å²	81.7	51%	0.513	48%	0.479	S	S	.	.			trans	-51.2	119.1	171	-169.4	-10	0	0	0	109	S265 G269	S265-D267 VanDerWaalsContact C-N 3.28Å; S265-D267 PolarHBondContact O-N 3.5Å; D267-G269 PolarHBondContact OD1-N 3.35Å
268	V	58.6	Low	64.3	Low	75 Å²	75	74.9 Å²	74.9	46%	0.455	44%	0.438	S	S	.	.			trans	-89.6	-12.4	-175.3	-174	0	0	0	0	110.5	H266 D270 K354	H266-V268 VanDerWaalsContact O-CG2 3.23Å; H266-V268 WeakPolarHBondContact O-CG2 3.49Å; H266-V268 PolarHBondContact O-N 2.84Å; H266-V268 VanDerWaalsContact O-N 3.11Å; V268-D270 HydrophobicContact CB-CB 4.3Å; V268-D270 HydrophobicContact CG1-CB 4.2Å; V268-D270 PolarHBondContact O-N 2.87Å; V268-K354 HydrophobicContact CG2-CG 3.92Å
269	G	61	Low	66.8	Low	65 Å²	65	67.5 Å²	67.5	67%	0.67	40%	0.401	S	S	*	.			trans	67.2	17.4	-169.5	0	0	0	0	0	113.2	D267 P271	D267-G269 PolarHBondContact OD1-N 3.35Å; G269-P271 WeakPolarHBondContact O-CD 3.48Å
270	D	73.3	Confident	69.6	Low	57 Å²	57	63.1 Å²	63.1	31%	0.305	38%	0.378	S	S	.	.			trans	-94.2	106.9	176	-175.2	-16	0	0	0	109	V268 S272 T273	V268-D270 HydrophobicContact CB-CB 4.3Å; V268-D270 HydrophobicContact CG1-CB 4.2Å; V268-D270 PolarHBondContact O-N 2.87Å; D270-S272 PolarHBondContact O-N 3.13Å; D270-S272 WeakPolarHBondContact OD1-CB 3.47Å; D270-S272 PolarHBondContact OD1-N 3.25Å; D270-S272 PolarHBondContact OD1-OG 2.74Å; D270-T273 WeakPolarHBondContact O-CG2 3.47Å; D270-T273 PolarHBondContact O-N 3.33Å
271	P	76	Confident	72.1	Confident	102 Å²	102	58.1 Å²	58.1	66%	0.662	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-9.6	-178.8	30.2	-35.9	0	0	0	113.2	G269 R328	G269-P271 WeakPolarHBondContact O-CD 3.48Å; P271-R328 WeakPolarHBondContact O-CD 3.29Å; P271-R328 PolarHBondContact O-NE 2.82Å; P271-R328 VanDerWaalsContact O-NE 3.15Å
272	S	80.2	Confident	74.6	Confident	78 Å²	78	48.9 Å²	48.9	55%	0.545	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-8.9	-179.4	74.1	0	0	0	0	114.5	D270 T274	D270-S272 PolarHBondContact O-N 3.13Å; D270-S272 WeakPolarHBondContact OD1-CB 3.47Å; D270-S272 PolarHBondContact OD1-N 3.25Å; D270-S272 PolarHBondContact OD1-OG 2.74Å; S272-T274 PolarHBondContact O-N 2.98Å
273	T	88.5	Confident	76.6	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.012	31%	0.306	C	S	.	.			trans	-68	124.1	-176.2	-171.3	0	0	0	0	111.9	D270 N275 R328 W352 G353 A355	D270-T273 WeakPolarHBondContact O-CG2 3.47Å; D270-T273 PolarHBondContact O-N 3.33Å; T273-N275 VanDerWaalsContact C-N 3.33Å; T273-N275 PolarHBondContact OG1-N 3.12Å; T273-R328 VanDerWaalsContact O-CD 3.26Å; T273-R328 WeakPolarHBondContact O-CD 3.3Å; T273-R328 PolarHBondContact O-NH1 2.97Å; T273-W352 HydrophobicContact CG2-CB 4.26Å; T273-W352 HydrophobicContact CG2-CD2 4.2Å; T273-W352 HydrophobicContact CG2-CE3 3.76Å; T273-W352 HydrophobicContact CG2-CG 4.41Å; T273-W352 WeakPolarHBondContact O-CZ3 3.49Å; T273-G353 WeakPolarHBondContact CG2-O 3.07Å; T273-G353 PolarHBondContact OG1-O 3.14Å; T273-A355 WeakPolarHBondContact OG1-CA 3.46Å; T273-A355 PolarHBondContact OG1-N 3.28Å
274	T	91.7	Very high	78.9	Confident	11 Å²	11	49.4 Å²	49.4	7%	0.067	30%	0.302	C	S	.	.			trans	-90	1.8	174	68.6	0	0	0	0	113.1	S272 A324 F325 R328 I358	S272-T274 PolarHBondContact O-N 2.98Å; T274-A324 WeakPolarHBondContact O-CA 3.4Å; T274-F325 WeakPolarHBondContact CB-O 3.48Å; T274-F325 PolarHBondContact O-N 3.24Å; T274-F325 PolarHBondContact OG1-O 2.99Å; T274-R328 HydrophobicContact CG2-CB 4.33Å; T274-I358 HydrophobicContact CG2-CD1 3.95Å
275	N	95.1	Very high	81.1	Confident	8 Å²	8	48.3 Å²	48.3	4%	0.043	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126	-173.9	-173.6	23.8	0	0	0	112.1	T273 V323 A324 G353 K354 V356	T273-N275 VanDerWaalsContact C-N 3.33Å; T273-N275 PolarHBondContact OG1-N 3.12Å; N275-V323 PolarHBondContact OD1-O 3.38Å; N275-A324 HydrophobicContact CB-CB 4.11Å; N275-G353 WeakPolarHBondContact O-CA 3.24Å; N275-G353 PolarHBondContact O-N 2.97Å; N275-K354 WeakPolarHBondContact CB-O 3.34Å; N275-K354 PolarHBondContact ND2-O 3.5Å; N275-V356 HydrophobicContact CB-CG2 4.43Å; N275-V356 WeakPolarHBondContact ND2-CG2 3.47Å
276	L	95.1	Very high	83.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132	174.1	-59.3	178.2	0	0	0	110.5	L278 F294 F322 V323 F325 A331 A334 L335 L350 G351 W352	L276-L278 HydrophobicContact CB-CD2 4.22Å; L276-F294 HydrophobicContact CD1-CE1 4.16Å; L276-F322 VanDerWaalsContact O-CA 3.26Å; L276-F322 WeakPolarHBondContact O-CA 3.23Å; L276-V323 PolarHBondContact N-O 2.91Å; L276-V323 PolarHBondContact O-N 2.95Å; L276-F325 HydrophobicContact CD1-CD2 4.42Å; L276-F325 HydrophobicContact CD1-CE2 3.9Å; L276-A331 HydrophobicContact CD2-CB 4.43Å; L276-A331 HydrophobicContact CG-CB 4.36Å; L276-A334 HydrophobicContact CD1-CB 3.92Å; L276-L335 HydrophobicContact CD1-CB 4.47Å; L276-L335 HydrophobicContact CD2-CB 3.97Å; L276-L335 HydrophobicContact CD2-CD1 4.44Å; L276-L335 HydrophobicContact CD2-CD2 4.36Å; L276-L335 HydrophobicContact CD2-CG 4.49Å; L276-L350 HydrophobicContact CD1-CD2 3.96Å; L276-G351 CarbonylContact C-O 3.36Å; L276-G351 WeakPolarHBondContact CA-O 3.35Å; L276-W352 HydrophobicContact CD2-CD2 4.29Å; L276-W352 HydrophobicContact CD2-CE3 3.58Å; L276-W352 HydrophobicContact CD2-CH2 3.84Å; L276-W352 HydrophobicContact CD2-CZ3 3.33Å; L276-W352 HydrophobicContact CG-CZ3 4.37Å
277	Y	95.3	Very high	85.2	Confident	56 Å²	56	46.2 Å²	46.2	22%	0.22	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	133.5	161.7	171.2	-105.9	0	0	0	109.9	C320 G321 F322 L350 G351	Y277-C320 HydrophobicContact CE2-CB 3.91Å; Y277-C320 WeakPolarHBondContact OH-CB 3.28Å; Y277-G321 WeakPolarHBondContact CD2-O 3.45Å; Y277-F322 HydrophobicContact CD2-CD1 4.31Å; Y277-F322 AromaticContact CD2-CE1 3.71Å; Y277-F322 HydrophobicContact CD2-CE1 3.71Å; Y277-F322 HydrophobicContact CD2-CE2 4.3Å; Y277-F322 AromaticContact CD2-CZ 3.7Å; Y277-F322 HydrophobicContact CD2-CZ 3.7Å; Y277-F322 HydrophobicContact CE2-CZ 4.42Å; Y277-F322 HydrophobicContact CG-CE1 4.27Å; Y277-L350 WeakPolarHBondContact O-CA 3.37Å; Y277-G351 PolarHBondContact N-O 3.27Å; Y277-G351 PolarHBondContact O-N 3.36Å; Y277-G351 VanDerWaalsContact O-N 3.14Å
278	L	95	Very high	86.9	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	119.4	177.5	-52.8	-168	0	0	0	110.4	L276 I281 L290 F294 C320 G321 V323 M348 L350	L276-L278 HydrophobicContact CB-CD2 4.22Å; L278-I281 HydrophobicContact CB-CD1 3.57Å; L278-I281 HydrophobicContact CB-CG1 4.06Å; L278-I281 HydrophobicContact CD1-CD1 4.03Å; L278-I281 HydrophobicContact CG-CD1 4.46Å; L278-L290 HydrophobicContact CD1-CD1 4.37Å; L278-L290 HydrophobicContact CD1-CD2 3.82Å; L278-F294 HydrophobicContact CD1-CE1 4.22Å; L278-F294 HydrophobicContact CD1-CE2 3.67Å; L278-F294 HydrophobicContact CD1-CZ 3.48Å; L278-F294 VanDerWaalsContact CD1-CZ 3.48Å; L278-F294 HydrophobicContact CD2-CE1 3.64Å; L278-F294 HydrophobicContact CD2-CE2 4.36Å; L278-F294 HydrophobicContact CD2-CZ 3.35Å; L278-F294 HydrophobicContact CG-CZ 4.08Å; L278-C320 CarbonylContact O-C 3.58Å; L278-C320 WeakPolarHBondContact O-CA 3.45Å; L278-C320 WeakPolarHBondContact O-CB 3.29Å; L278-G321 PolarHBondContact N-O 2.87Å; L278-G321 PolarHBondContact O-N 3.37Å; L278-V323 HydrophobicContact CD1-CB 4.4Å; L278-V323 HydrophobicContact CD1-CG2 3.6Å; L278-V323 HydrophobicContact CG-CG2 4.35Å; L278-M348 HydrophobicContact CD1-SD 4.46Å; L278-L350 HydrophobicContact CD2-CD2 3.57Å; L278-L350 HydrophobicContact CD2-CG 3.66Å
279	G	92.4	Very high	88.5	Confident	8 Å²	8	47.8 Å²	47.8	8%	0.082	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	153.6	172.4	0	0	0	0	0	112.5	K349	G279-K349 WeakPolarHBondContact CA-O 3.41Å; G279-K349 PolarHBondContact N-O 3.43Å; G279-K349 PolarHBondContact O-N 2.97Å
280	N	92.2	Very high	90.1	Very high	39 Å²	39	44.7 Å²	44.7	21%	0.209	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	62.1	38.5	176.7	-159	51.6	0	0	0	114.2	R318 N319 F346 E347 K349	N280-R318 WeakPolarHBondContact OD1-CD 3.38Å; N280-N319 PolarHBondContact N-O 3.48Å; N280-F346 WeakPolarHBondContact O-CB 3.45Å; N280-E347 WeakPolarHBondContact CB-O 3.35Å; N280-E347 PolarHBondContact ND2-O 3.18Å; N280-K349 HydrophobicContact CB-CG 4.46Å
281	I	92.7	Very high	91	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	138.7	172.9	-61.2	162.5	0	0	0	109.2	L278 M285 L290 N319 M348	L278-I281 HydrophobicContact CB-CD1 3.57Å; L278-I281 HydrophobicContact CB-CG1 4.06Å; L278-I281 HydrophobicContact CD1-CD1 4.03Å; L278-I281 HydrophobicContact CG-CD1 4.46Å; I281-M285 HydrophobicContact CG2-CB 3.74Å; I281-M285 HydrophobicContact CG2-CG 4.27Å; I281-M285 HydrophobicContact CG2-SD 3.85Å; I281-L290 HydrophobicContact CD1-CD1 4.29Å; I281-L290 HydrophobicContact CD1-CD2 4.49Å; I281-N319 HydrophobicContact CB-CB 4.04Å; I281-N319 HydrophobicContact CG2-CB 4.41Å; I281-N319 PolarHBondContact N-O 3.24Å; I281-N319 PolarHBondContact O-N 2.92Å; I281-M348 HydrophobicContact CG1-SD 4.12Å
282	N	90.9	Very high	91.7	Very high	13 Å²	13	42.9 Å²	42.9	7%	0.07	22%	0.222	C	C	.	.			trans	-57.9	132.1	173	-179.2	-43.9	0	0	0	110.5	Q284 M285 M344 F346	N282-Q284 PolarHBondContact O-N 2.84Å; N282-Q284 WeakPolarHBondContact OD1-CB 3.44Å; N282-Q284 PolarHBondContact OD1-N 2.96Å; N282-M285 WeakPolarHBondContact O-CB 3.24Å; N282-M285 PolarHBondContact O-N 3.46Å; N282-M344 HydrophobicContact CB-CB 4.11Å; N282-M344 VanDerWaalsContact ND2-CB 3.33Å; N282-M344 WeakPolarHBondContact ND2-CB 3.47Å; N282-M344 PolarHBondContact ND2-O 2.79Å; N282-F346 HydrophobicContact CB-CB 4.37Å; N282-F346 HydrophobicContact CB-CD2 3.55Å; N282-F346 HydrophobicContact CB-CE2 3.99Å; N282-F346 HydrophobicContact CB-CG 4.03Å; N282-F346 WeakPolarHBondContact ND2-CD2 3.28Å; N282-F346 WeakPolarHBondContact ND2-CE2 3.48Å
283	P	89.3	Confident	92.2	Very high	52 Å²	52	41.3 Å²	41.3	34%	0.338	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-19.9	179.6	-27.8	36.1	0	0	0	116.9	E317	P283-E317 VanDerWaalsContact CD-O 3.28Å; P283-E317 WeakPolarHBondContact CD-O 3.36Å; P283-E317 VanDerWaalsContact CG-C 3.45Å; P283-E317 WeakPolarHBondContact CG-O 3.25Å
284	Q	89.3	Confident	92.5	Very high	140 Å²	140	41.2 Å²	41.2	65%	0.654	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-11.7	177.6	-58.1	-178.1	-63.9	0	0	113.5	N282 N286 M344	N282-Q284 PolarHBondContact O-N 2.84Å; N282-Q284 WeakPolarHBondContact OD1-CB 3.44Å; N282-Q284 PolarHBondContact OD1-N 2.96Å; Q284-N286 PolarHBondContact O-N 2.65Å; Q284-M344 HydrophobicContact CB-CE 4.04Å
285	M	90.9	Very high	92.4	Very high	5 Å²	5	40.8 Å²	40.8	3%	0.025	20%	0.203	C	C	.	.			trans	-75.6	125.2	-176.6	-161.6	174.8	-167.2	0	0	110.3	I281 N282 M289 L290 E293 I305 I343 M344	I281-M285 HydrophobicContact CG2-CB 3.74Å; I281-M285 HydrophobicContact CG2-CG 4.27Å; I281-M285 HydrophobicContact CG2-SD 3.85Å; N282-M285 WeakPolarHBondContact O-CB 3.24Å; N282-M285 PolarHBondContact O-N 3.46Å; M285-M289 HydrophobicContact CE-CB 4.01Å; M285-M289 HydrophobicContact CG-CB 3.7Å; M285-M289 HydrophobicContact CG-SD 4.21Å; M285-L290 HydrophobicContact CE-CD2 3.75Å; M285-L290 HydrophobicContact CE-CG 4.23Å; M285-L290 HydrophobicContact CG-CD2 4.5Å; M285-L290 HydrophobicContact CG-CG 4.37Å; M285-L290 HydrophobicContact SD-CD2 3.68Å; M285-L290 HydrophobicContact SD-CG 4.18Å; M285-E293 HydrophobicContact CE-CB 4.34Å; M285-E293 HydrophobicContact CE-CG 3.99Å; M285-I305 WeakPolarHBondContact O-CD1 3.31Å; M285-I343 HydrophobicContact CE-CG2 4.11Å; M285-I343 HydrophobicContact SD-CG2 4.42Å; M285-M344 HydrophobicContact CB-SD 4.45Å
286	N	92.9	Very high	92.1	Very high	79 Å²	79	47.2 Å²	47.2	42%	0.422	23%	0.226	S	C	.	.			trans	-93.2	166.7	178.4	-71.9	-29.2	0	0	0	112	Q284 E288 M289 L290	Q284-N286 PolarHBondContact O-N 2.65Å; N286-E288 PolarHBondContact O-N 3.23Å; N286-M289 HydrophobicContact CB-SD 4.48Å; N286-M289 PolarHBondContact O-N 2.81Å; N286-M289 VanDerWaalsContact O-N 3.07Å; N286-L290 PolarHBondContact O-N 2.66Å; N286-L290 VanDerWaalsContact O-N 3.1Å
287	E	92.9	Very high	91.9	Very high	83 Å²	83	47.5 Å²	47.5	39%	0.388	23%	0.228	S	C	.	.	H	α-helix	trans	-60	-32.9	177.1	-71	174.5	168.3	0	0	111.9	L290 C291 V303 K304 I305	E287-L290 PolarHBondContact O-N 2.69Å; E287-C291 PolarHBondContact O-N 2.87Å; E287-C291 PolarHBondContact O-SG 3.47Å; E287-V303 HydrophobicContact CB-CG1 4.15Å; E287-V303 HydrophobicContact CG-CG1 4.32Å; E287-K304 WeakPolarHBondContact OE1-CA 3.49Å; E287-I305 HydrophobicContact CG-CB 4.26Å; E287-I305 HydrophobicContact CG-CD1 3.87Å; E287-I305 HydrophobicContact CG-CG1 3.74Å; E287-I305 PolarHBondContact OE1-N 3.08Å
288	E	92.2	Very high	91.6	Very high	133 Å²	133	44.9 Å²	44.9	62%	0.621	22%	0.217	S	C	*	.	H	α-helix	trans	-63	-41.7	171.9	-175.7	-177.8	-175.9	0	0	113.5	N286 L290 C291 Q292	N286-E288 PolarHBondContact O-N 3.23Å; E288-L290 VanDerWaalsContact C-N 3.31Å; E288-L290 PolarHBondContact O-N 3.25Å; E288-C291 WeakPolarHBondContact O-CB 3.35Å; E288-C291 PolarHBondContact O-N 2.86Å; E288-C291 VanDerWaalsContact O-N 3.14Å; E288-Q292 WeakPolarHBondContact O-CG 3.48Å; E288-Q292 PolarHBondContact O-N 2.76Å
289	M	92.2	Very high	91.4	Very high	71 Å²	71	44.9 Å²	44.9	35%	0.35	22%	0.217	S	C	.	.	H	α-helix	trans	-68.1	-34.2	177	-65.9	168.5	171.3	0	0	111.3	M285 N286 Q292 E293	M285-M289 HydrophobicContact CE-CB 4.01Å; M285-M289 HydrophobicContact CG-CB 3.7Å; M285-M289 HydrophobicContact CG-SD 4.21Å; N286-M289 HydrophobicContact CB-SD 4.48Å; N286-M289 PolarHBondContact O-N 2.81Å; N286-M289 VanDerWaalsContact O-N 3.07Å; M289-Q292 PolarHBondContact O-N 2.75Å; M289-E293 PolarHBondContact O-N 3.15Å
290	L	93.9	Very high	91.4	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.8	-40.5	169.6	-69.8	172.5	0	0	0	111	L278 I281 M285 N286 E287 E288 Q292 E293 F294 V303 I305	L278-L290 HydrophobicContact CD1-CD1 4.37Å; L278-L290 HydrophobicContact CD1-CD2 3.82Å; I281-L290 HydrophobicContact CD1-CD1 4.29Å; I281-L290 HydrophobicContact CD1-CD2 4.49Å; M285-L290 HydrophobicContact CE-CD2 3.75Å; M285-L290 HydrophobicContact CE-CG 4.23Å; M285-L290 HydrophobicContact CG-CD2 4.5Å; M285-L290 HydrophobicContact CG-CG 4.37Å; M285-L290 HydrophobicContact SD-CD2 3.68Å; M285-L290 HydrophobicContact SD-CG 4.18Å; N286-L290 PolarHBondContact O-N 2.66Å; N286-L290 VanDerWaalsContact O-N 3.1Å; E287-L290 PolarHBondContact O-N 2.69Å; E288-L290 VanDerWaalsContact C-N 3.31Å; E288-L290 PolarHBondContact O-N 3.25Å; L290-Q292 VanDerWaalsContact C-N 3.29Å; L290-Q292 PolarHBondContact O-N 3.06Å; L290-E293 PolarHBondContact O-N 3.3Å; L290-F294 HydrophobicContact CB-CD2 4.46Å; L290-F294 HydrophobicContact CD2-CD2 4.16Å; L290-F294 HydrophobicContact CD2-CE2 3.76Å; L290-F294 VanDerWaalsContact O-CB 3.31Å; L290-F294 WeakPolarHBondContact O-CB 3.44Å; L290-F294 VanDerWaalsContact O-CD2 3.29Å; L290-F294 WeakPolarHBondContact O-CD2 3.47Å; L290-F294 PolarHBondContact O-N 2.98Å; L290-V303 HydrophobicContact CB-CG1 3.77Å; L290-V303 HydrophobicContact CD1-CG1 4.16Å; L290-I305 HydrophobicContact CD1-CD1 3.82Å; L290-I305 HydrophobicContact CD1-CG1 3.58Å
291	C	92.9	Very high	91.5	Very high	17 Å²	17	42.8 Å²	42.8	12%	0.115	21%	0.205	C	C	.	.	H	α-helix	trans	-58.3	-40.3	173.4	-70.7	0	0	0	0	112.3	E287 E288 G295 L300 Y364	E287-C291 PolarHBondContact O-N 2.87Å; E287-C291 PolarHBondContact O-SG 3.47Å; E288-C291 WeakPolarHBondContact O-CB 3.35Å; E288-C291 PolarHBondContact O-N 2.86Å; E288-C291 VanDerWaalsContact O-N 3.14Å; C291-G295 VanDerWaalsContact O-CA 3.23Å; C291-G295 WeakPolarHBondContact O-CA 3.37Å; C291-G295 PolarHBondContact O-N 3.09Å; C291-L300 HydrophobicContact CB-CD1 4.28Å; C291-Y364 HydrophobicContact CB-CD2 3.64Å; C291-Y364 HydrophobicContact CB-CE2 4.17Å; C291-Y364 HydrophobicContact CB-CG 3.86Å; C291-Y364 WeakPolarHBondContact O-CE1 3.15Å
292	Q	90.5	Very high	91.5	Very high	103 Å²	103	44.8 Å²	44.8	48%	0.481	22%	0.219	S	C	.	.	H	α-helix	trans	-67.9	-50.3	177.5	-68.4	170.3	8.6	0	0	112.5	E288 M289 L290	E288-Q292 WeakPolarHBondContact O-CG 3.48Å; E288-Q292 PolarHBondContact O-N 2.76Å; M289-Q292 PolarHBondContact O-N 2.75Å; L290-Q292 VanDerWaalsContact C-N 3.29Å; L290-Q292 PolarHBondContact O-N 3.06Å
293	E	91.4	Very high	91.7	Very high	46 Å²	46	45 Å²	45	22%	0.215	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-39.7	-179.5	-80.8	-74.6	145.4	0	0	113.1	M285 M289 L290 F297 K341 I343	M285-E293 HydrophobicContact CE-CB 4.34Å; M285-E293 HydrophobicContact CE-CG 3.99Å; M289-E293 PolarHBondContact O-N 3.15Å; L290-E293 PolarHBondContact O-N 3.3Å; E293-F297 WeakPolarHBondContact O-CE2 3.34Å; E293-K341 IonicContact OE1-NZ 3.69Å; E293-K341 IonicContact OE2-NZ 2.85Å; E293-K341 PolarHBondContact OE2-NZ 2.94Å; E293-I343 HydrophobicContact CG-CD1 4.09Å; E293-I343 WeakPolarHBondContact OE2-CD1 3.14Å
294	F	93.5	Very high	91.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-84.8	-27.1	-179.7	-74.9	-100.8	0	0	0	113.2	L276 L278 L290 R296 F297 L300 V323 F325 A334 L338 M348 L350	L276-F294 HydrophobicContact CD1-CE1 4.16Å; L278-F294 HydrophobicContact CD1-CE1 4.22Å; L278-F294 HydrophobicContact CD1-CE2 3.67Å; L278-F294 HydrophobicContact CD1-CZ 3.48Å; L278-F294 VanDerWaalsContact CD1-CZ 3.48Å; L278-F294 HydrophobicContact CD2-CE1 3.64Å; L278-F294 HydrophobicContact CD2-CE2 4.36Å; L278-F294 HydrophobicContact CD2-CZ 3.35Å; L278-F294 HydrophobicContact CG-CZ 4.08Å; L290-F294 HydrophobicContact CB-CD2 4.46Å; L290-F294 HydrophobicContact CD2-CD2 4.16Å; L290-F294 HydrophobicContact CD2-CE2 3.76Å; L290-F294 VanDerWaalsContact O-CB 3.31Å; L290-F294 WeakPolarHBondContact O-CB 3.44Å; L290-F294 VanDerWaalsContact O-CD2 3.29Å; L290-F294 WeakPolarHBondContact O-CD2 3.47Å; L290-F294 PolarHBondContact O-N 2.98Å; F294-R296 PolarHBondContact O-N 3.01Å; F294-F297 WeakPolarHBondContact O-CB 3.47Å; F294-F297 WeakPolarHBondContact O-CD2 3.3Å; F294-F297 PolarHBondContact O-N 3.21Å; F294-F297 VanDerWaalsContact O-N 3.16Å; F294-L300 HydrophobicContact CB-CD1 4.02Å; F294-L300 HydrophobicContact CB-CD2 4.11Å; F294-V323 HydrophobicContact CB-CG1 4.01Å; F294-V323 HydrophobicContact CD1-CB 4.05Å; F294-V323 HydrophobicContact CD1-CG1 3.77Å; F294-V323 HydrophobicContact CD1-CG2 4.22Å; F294-V323 HydrophobicContact CD2-CG2 4.29Å; F294-V323 HydrophobicContact CE1-CB 4.34Å; F294-V323 HydrophobicContact CE1-CG2 4.46Å; F294-V323 HydrophobicContact CG-CB 4.38Å; F294-V323 HydrophobicContact CG-CG1 3.97Å; F294-V323 HydrophobicContact CG-CG2 4.14Å; F294-F325 HydrophobicContact CB-CZ 4.07Å; F294-F325 HydrophobicContact CD1-CE2 4.03Å; F294-F325 HydrophobicContact CD1-CZ 4.06Å; F294-F325 WeakPolarHBondContact O-CE1 3.39Å; F294-F325 WeakPolarHBondContact O-CZ 3.23Å; F294-A334 HydrophobicContact CD1-CB 4.38Å; F294-L338 HydrophobicContact CD1-CD1 3.72Å; F294-L338 HydrophobicContact CD2-CD1 4Å; F294-L338 HydrophobicContact CE1-CD1 3.52Å; F294-L338 HydrophobicContact CE2-CD1 3.81Å; F294-L338 HydrophobicContact CG-CD1 3.95Å; F294-L338 HydrophobicContact CZ-CD1 3.54Å; F294-M348 HydrophobicContact CE2-CE 3.55Å; F294-M348 HydrophobicContact CE2-SD 4.14Å; F294-M348 HydrophobicContact CZ-CE 3.59Å; F294-M348 HydrophobicContact CZ-SD 4.18Å; F294-L350 HydrophobicContact CE1-CD2 3.57Å; F294-L350 HydrophobicContact CZ-CD2 3.77Å
295	G	90.6	Very high	92.1	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-29.6	178.4	0	0	0	0	0	113.3	C291 F297 G298 P366	C291-G295 VanDerWaalsContact O-CA 3.23Å; C291-G295 WeakPolarHBondContact O-CA 3.37Å; C291-G295 PolarHBondContact O-N 3.09Å; G295-F297 PolarHBondContact O-N 3.03Å; G295-G298 PolarHBondContact O-N 3.31Å; G295-G298 VanDerWaalsContact O-N 3.1Å; G295-P366 VanDerWaalsContact O-CB 3.31Å; G295-P366 WeakPolarHBondContact O-CB 3.44Å; G295-P366 WeakPolarHBondContact O-CG 3.35Å
296	R	88.3	Confident	92.2	Very high	144 Å²	144	44.8 Å²	44.8	54%	0.543	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-15.7	173.7	-66.7	180	67	162.3	2	114.5	F294	F294-R296 PolarHBondContact O-N 3.01Å
297	F	90.8	Very high	92.1	Very high	6 Å²	6	47.1 Å²	47.1	3%	0.026	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-16.3	-177.7	-62.7	-89.1	0	0	0	115	E293 F294 G295 F325 D330 R333 A334 N337 L338 F524	E293-F297 WeakPolarHBondContact O-CE2 3.34Å; F294-F297 WeakPolarHBondContact O-CB 3.47Å; F294-F297 WeakPolarHBondContact O-CD2 3.3Å; F294-F297 PolarHBondContact O-N 3.21Å; F294-F297 VanDerWaalsContact O-N 3.16Å; G295-F297 PolarHBondContact O-N 3.03Å; F297-F325 HydrophobicContact CB-CE1 3.8Å; F297-F325 HydrophobicContact CB-CZ 3.97Å; F297-D330 WeakPolarHBondContact O-CB 3.47Å; F297-R333 HydrophobicContact CD1-CB 3.87Å; F297-R333 VanDerWaalsContact CE1-O 3.24Å; F297-R333 WeakPolarHBondContact CE1-O 3.29Å; F297-R333 PolarHBondContact O-NH2 2.92Å; F297-A334 HydrophobicContact CB-CB 3.91Å; F297-A334 HydrophobicContact CD1-CB 3.98Å; F297-A334 VanDerWaalsContact CD1-N 3.31Å; F297-A334 HydrophobicContact CD2-CB 3.96Å; F297-A334 HydrophobicContact CE1-CB 4.46Å; F297-A334 HydrophobicContact CG-CB 3.66Å; F297-N337 HydrophobicContact CE1-CB 3.75Å; F297-N337 HydrophobicContact CZ-CB 3.91Å; F297-L338 HydrophobicContact CD2-CD1 4.23Å; F297-L338 HydrophobicContact CE2-CD1 3.61Å; F297-L338 HydrophobicContact CE2-CD2 3.78Å; F297-L338 HydrophobicContact CE2-CG 3.56Å; F297-L338 HydrophobicContact CZ-CD1 4.21Å; F297-L338 HydrophobicContact CZ-CD2 3.92Å; F297-L338 HydrophobicContact CZ-CG 3.67Å; F297-F524 HydrophobicContact CD1-CD2 4.27Å; F297-F524 AromaticContact CD1-CE2 3.51Å; F297-F524 HydrophobicContact CD1-CE2 3.51Å; F297-F524 HydrophobicContact CD1-CZ 4.05Å; F297-F524 HydrophobicContact CE1-CD2 4.12Å; F297-F524 HydrophobicContact CE1-CE1 4.21Å; F297-F524 AromaticContact CE1-CE2 3.05Å; F297-F524 HydrophobicContact CE1-CE2 3.05Å; F297-F524 AromaticContact CE1-CZ 3.13Å; F297-F524 HydrophobicContact CE1-CZ 3.13Å; F297-F524 HydrophobicContact CE2-CE2 4.3Å; F297-F524 HydrophobicContact CG-CE2 4.34Å; F297-F524 AromaticContact CZ-CE2 3.51Å; F297-F524 HydrophobicContact CZ-CE2 3.51Å; F297-F524 AromaticContact CZ-CZ 3.43Å; F297-F524 HydrophobicContact CZ-CZ 3.43Å; F297-F524 VanDerWaalsContact CZ-CZ 3.43Å
298	G	88.8	Confident	91.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	155.2	178.8	-171.7	0	0	0	0	0	114.2	G295 P366	G295-G298 PolarHBondContact O-N 3.31Å; G295-G298 VanDerWaalsContact O-N 3.1Å; G298-P366 WeakPolarHBondContact O-CG 3.49Å
299	P	91.2	Very high	91.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	22%	0.217	C	C	.	.			trans	-81.2	135.4	-175.7	12.3	4.4	0	0	0	111.1	M326 D330 P362 M369 Y511	P299-M326 HydrophobicContact CB-CB 4.33Å; P299-M326 HydrophobicContact CB-CG 4.01Å; P299-M326 HydrophobicContact CG-CB 4.06Å; P299-M326 HydrophobicContact CG-CG 4.25Å; P299-M326 PolarHBondContact O-N 3.29Å; P299-D330 WeakPolarHBondContact CD-OD2 3.44Å; P299-P362 HydrophobicContact CB-CB 4.03Å; P299-P362 HydrophobicContact CB-CG 4.24Å; P299-M369 HydrophobicContact CB-CE 4.12Å; P299-M369 HydrophobicContact CG-CE 3.58Å; P299-M369 HydrophobicContact CG-SD 4.35Å; P299-Y511 HydrophobicContact CB-CD1 4.02Å; P299-Y511 HydrophobicContact CB-CG 4.34Å; P299-Y511 HydrophobicContact CG-CD1 4.08Å; P299-Y511 HydrophobicContact CG-CG 4.35Å
300	L	93.2	Very high	91.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	120.5	-172.3	-50.4	-176.2	0	0	0	111.6	C291 F294 V303 V323 A324 F325 P362 I363 Y364	C291-L300 HydrophobicContact CB-CD1 4.28Å; F294-L300 HydrophobicContact CB-CD1 4.02Å; F294-L300 HydrophobicContact CB-CD2 4.11Å; L300-V303 HydrophobicContact CB-CG2 4.19Å; L300-V303 HydrophobicContact CD1-CG2 3.63Å; L300-V323 HydrophobicContact CD1-CG1 4.44Å; L300-V323 HydrophobicContact CD2-CG1 3.96Å; L300-A324 CarbonylContact C-O 3.46Å; L300-F325 HydrophobicContact CD2-CD1 3.59Å; L300-F325 HydrophobicContact CD2-CD2 4.41Å; L300-F325 HydrophobicContact CD2-CE1 3.31Å; L300-F325 HydrophobicContact CD2-CE2 4.19Å; L300-F325 HydrophobicContact CD2-CG 4.14Å; L300-F325 HydrophobicContact CD2-CZ 3.64Å; L300-P362 CarbonylContact O-C 3.59Å; L300-P362 WeakPolarHBondContact O-CA 3.43Å; L300-P362 WeakPolarHBondContact O-CB 3.33Å; L300-I363 PolarHBondContact O-N 2.89Å; L300-Y364 HydrophobicContact CD1-CD1 4.32Å; L300-Y364 HydrophobicContact CD1-CG 4.46Å; L300-Y364 HydrophobicContact CG-CD1 4.37Å; L300-Y364 PolarHBondContact N-O 3.44Å
301	A	92.4	Very high	90.6	Very high	4 Å²	4	50.8 Å²	50.8	3%	0.033	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-34.7	174.8	0	0	0	0	0	112.6	A324 F325 M326 I358 P359	A301-A324 WeakPolarHBondContact CA-O 3.21Å; A301-A324 HydrophobicContact CB-CB 4.23Å; A301-A324 WeakPolarHBondContact CB-O 3.5Å; A301-A324 PolarHBondContact N-O 3.14Å; A301-F325 WeakPolarHBondContact CB-O 3.36Å; A301-M326 HydrophobicContact CB-CE 4.18Å; A301-M326 HydrophobicContact CB-CG 4.43Å; A301-M326 HydrophobicContact CB-SD 4.17Å; A301-I358 HydrophobicContact CB-CG2 4.11Å; A301-P359 HydrophobicContact CB-CG 4.44Å; A301-P359 WeakPolarHBondContact O-CG 3.36Å
302	S	93.3	Very high	90.1	Very high	43 Å²	43	53.5 Å²	53.5	30%	0.301	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	141.6	174.9	-160.9	0	0	0	0	111.7	V323 A324	S302-V323 CarbonylContact O-C 3.58Å; S302-V323 WeakPolarHBondContact O-CA 3.26Å; S302-A324 PolarHBondContact N-O 2.93Å; S302-A324 VanDerWaalsContact N-O 3.11Å; S302-A324 PolarHBondContact O-N 2.92Å
303	V	94.9	Very high	89.6	Confident	18 Å²	18	51.7 Å²	51.7	11%	0.109	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	136.8	170.3	178.7	0	0	0	0	107.9	E287 L290 L300 V323	E287-V303 HydrophobicContact CB-CG1 4.15Å; E287-V303 HydrophobicContact CG-CG1 4.32Å; L290-V303 HydrophobicContact CB-CG1 3.77Å; L290-V303 HydrophobicContact CD1-CG1 4.16Å; L300-V303 HydrophobicContact CB-CG2 4.19Å; L300-V303 HydrophobicContact CD1-CG2 3.63Å; V303-V323 HydrophobicContact CB-CG2 4.48Å; V303-V323 HydrophobicContact CG1-CG2 4.1Å; V303-V323 HydrophobicContact CG2-CG1 4.33Å; V303-V323 HydrophobicContact CG2-CG2 4.14Å
304	K	94.1	Very high	89.3	Confident	118 Å²	118	55.6 Å²	55.6	51%	0.513	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	124.2	-176.2	-172.5	168.5	-171	160.4	0	113.9	E287 G321 F322	E287-K304 WeakPolarHBondContact OE1-CA 3.49Å; K304-G321 CarbonylContact O-C 3.44Å; K304-G321 WeakPolarHBondContact O-CA 3.45Å; K304-F322 PolarHBondContact N-O 3.01Å; K304-F322 PolarHBondContact O-N 3.11Å
305	I	94.1	Very high	88.8	Confident	6 Å²	6	59.4 Å²	59.4	3%	0.031	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	130.3	172.6	-64.6	175.6	0	0	0	110.9	M285 E287 L290 W307 N319	M285-I305 WeakPolarHBondContact O-CD1 3.31Å; E287-I305 HydrophobicContact CG-CB 4.26Å; E287-I305 HydrophobicContact CG-CD1 3.87Å; E287-I305 HydrophobicContact CG-CG1 3.74Å; E287-I305 PolarHBondContact OE1-N 3.08Å; L290-I305 HydrophobicContact CD1-CD1 3.82Å; L290-I305 HydrophobicContact CD1-CG1 3.58Å; I305-W307 HydrophobicContact CB-CZ2 4.17Å; I305-W307 HydrophobicContact CD1-CZ2 4.06Å; I305-W307 HydrophobicContact CG2-CD2 3.74Å; I305-W307 VanDerWaalsContact CG2-CE2 3.5Å; I305-W307 HydrophobicContact CG2-CE3 4.26Å; I305-W307 HydrophobicContact CG2-CG 4.08Å; I305-W307 HydrophobicContact CG2-CH2 4.35Å; I305-W307 HydrophobicContact CG2-CZ2 3.84Å; I305-W307 PolarHBondContact O-N 3.36Å; I305-N319 HydrophobicContact CG2-CB 4.29Å
306	M	92.6	Very high	88.5	Confident	69 Å²	69	64.2 Å²	64.2	34%	0.34	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	77.4	176	-72.3	-64.6	-62.2	0	0	110.3	C320 F322	M306-C320 WeakPolarHBondContact CA-O 3.48Å; M306-C320 WeakPolarHBondContact CB-O 3.5Å; M306-C320 PolarHBondContact N-O 2.69Å; M306-F322 HydrophobicContact CG-CD2 4.14Å; M306-F322 HydrophobicContact CG-CE2 4.11Å
307	W	89.5	Confident	88.4	Confident	127 Å²	127	64.3 Å²	64.3	48%	0.481	31%	0.305	S	S	.	.			trans	-56.6	140.1	-179.3	-61.1	96.4	0	0	0	113.6	I305 R309 N319	I305-W307 HydrophobicContact CB-CZ2 4.17Å; I305-W307 HydrophobicContact CD1-CZ2 4.06Å; I305-W307 HydrophobicContact CG2-CD2 3.74Å; I305-W307 VanDerWaalsContact CG2-CE2 3.5Å; I305-W307 HydrophobicContact CG2-CE3 4.26Å; I305-W307 HydrophobicContact CG2-CG 4.08Å; I305-W307 HydrophobicContact CG2-CH2 4.35Å; I305-W307 HydrophobicContact CG2-CZ2 3.84Å; I305-W307 PolarHBondContact O-N 3.36Å; W307-R309 PolarHBondContact O-N 2.83Å; W307-N319 VanDerWaalsContact CZ3-ND2 3.33Å; W307-N319 WeakPolarHBondContact CZ3-ND2 3.44Å
308	P	85.5	Confident	88.3	Confident	33 Å²	33	67.4 Å²	67.4	21%	0.214	32%	0.316	C	S	.	.			trans	-66.7	115.7	-172.4	25	-34.8	0	0	0	112.8	E313 R314 N319	P308-E313 HydrophobicContact CB-CB 3.59Å; P308-R314 HydrophobicContact CB-CB 4.25Å; P308-R314 HydrophobicContact CG-CB 4.36Å; P308-R314 HydrophobicContact CG-CG 4.47Å; P308-R314 PolarHBondContact O-NH2 2.79Å; P308-R314 VanDerWaalsContact O-NH2 3.11Å; P308-N319 WeakPolarHBondContact CD-OD1 3.43Å
309	R	85.3	Confident	88.4	Confident	208 Å²	208	67.8 Å²	67.8	79%	0.785	32%	0.319	S	S	*	.			trans	-86	-24.3	-174.7	-63	-173.8	176.5	-163.3	-3.1	113	W307 E313	W307-R309 PolarHBondContact O-N 2.83Å; R309-E313 PolarHBondContact N-OE2 3.39Å
310	T	86.1	Confident	88.5	Confident	57 Å²	57	69.7 Å²	69.7	35%	0.35	33%	0.331	S	S	.	.	S	Bend	trans	-113.2	156	-179	64.8	0	0	0	0	112	E312 E313 R314	T310-E312 PolarHBondContact O-N 3.29Å; T310-E313 WeakPolarHBondContact CB-OE2 3.33Å; T310-E313 PolarHBondContact N-OE2 3.29Å; T310-E313 PolarHBondContact O-N 3.41Å; T310-E313 VanDerWaalsContact OG1-CG 3.26Å; T310-E313 WeakPolarHBondContact OG1-CG 3.38Å; T310-E313 PolarHBondContact OG1-N 3.09Å; T310-E313 PolarHBondContact OG1-OE2 3.3Å; T310-R314 PolarHBondContact O-N 2.89Å; T310-R314 VanDerWaalsContact O-N 3.1Å
311	D	83	Confident	88.5	Confident	66 Å²	66	69.7 Å²	69.7	35%	0.353	33%	0.331	S	S	.	.	H	α-helix	trans	-60.6	-30	174.2	-60.9	-18.6	0	0	0	111.6	R314 A315 R996	D311-R314 IonicContact OD1-NH1 3.8Å; D311-R314 PolarHBondContact OD1-NH1 3.2Å; D311-A315 WeakPolarHBondContact O-CB 3.44Å; D311-A315 PolarHBondContact O-N 2.96Å; D311-R996 IonicContact OD2-CZ 3.18Å; D311-R996 VanDerWaalsContact OD2-CZ 3.24Å; D311-R996 IonicContact OD2-NE 3.07Å; D311-R996 PolarHBondContact OD2-NE 2.97Å; D311-R996 IonicContact OD2-NH2 3.58Å; D311-R996 PolarHBondContact OD2-NH2 3.4Å
312	E	82.5	Confident	88.7	Confident	74 Å²	74	72.7 Å²	72.7	35%	0.346	34%	0.344	S	S	.	.	H	α-helix	trans	-69.5	-41.3	176.7	-175.1	-169.5	151.4	0	0	112.7	T310 R316 R999	T310-E312 PolarHBondContact O-N 3.29Å; E312-R316 IonicContact OE1-NH2 2.68Å; E312-R316 PolarHBondContact OE1-NH2 2.83Å; E312-R316 VanDerWaalsContact OE1-NH2 3.09Å; E312-R999 IonicContact OE1-CZ 3.99Å; E312-R999 IonicContact OE1-NE 4Å; E312-R999 IonicContact OE1-NH2 2.81Å; E312-R999 PolarHBondContact OE1-NH2 2.95Å; E312-R999 IonicContact OE2-CZ 2.68Å; E312-R999 IonicContact OE2-NE 2.79Å; E312-R999 PolarHBondContact OE2-NE 3.06Å; E312-R999 IonicContact OE2-NH2 3.21Å; E312-R999 PolarHBondContact OE2-NH2 2.86Å
313	E	81	Confident	88.8	Confident	65 Å²	65	70.6 Å²	70.6	30%	0.304	33%	0.329	S	S	.	.	H	α-helix	trans	-68.7	-39.6	175.7	-69.7	154.1	153.1	0	0	110.9	P308 R309 T310 A315 R316	P308-E313 HydrophobicContact CB-CB 3.59Å; R309-E313 PolarHBondContact N-OE2 3.39Å; T310-E313 WeakPolarHBondContact CB-OE2 3.33Å; T310-E313 PolarHBondContact N-OE2 3.29Å; T310-E313 PolarHBondContact O-N 3.41Å; T310-E313 VanDerWaalsContact OG1-CG 3.26Å; T310-E313 WeakPolarHBondContact OG1-CG 3.38Å; T310-E313 PolarHBondContact OG1-N 3.09Å; T310-E313 PolarHBondContact OG1-OE2 3.3Å; E313-A315 VanDerWaalsContact C-N 3.29Å; E313-A315 PolarHBondContact O-N 2.74Å; E313-R316 WeakPolarHBondContact O-CB 3.49Å; E313-R316 PolarHBondContact O-N 2.79Å; E313-R316 VanDerWaalsContact O-N 3.12Å
314	R	84.1	Confident	88.8	Confident	128 Å²	128	69.9 Å²	69.9	48%	0.483	33%	0.325	S	S	.	.	H	α-helix	trans	-64.6	-34.7	177.8	-162.9	174.9	-57.4	105	14.8	112.2	P308 T310 D311 R316 E317	P308-R314 HydrophobicContact CB-CB 4.25Å; P308-R314 HydrophobicContact CG-CB 4.36Å; P308-R314 HydrophobicContact CG-CG 4.47Å; P308-R314 PolarHBondContact O-NH2 2.79Å; P308-R314 VanDerWaalsContact O-NH2 3.11Å; T310-R314 PolarHBondContact O-N 2.89Å; T310-R314 VanDerWaalsContact O-N 3.1Å; D311-R314 IonicContact OD1-NH1 3.8Å; D311-R314 PolarHBondContact OD1-NH1 3.2Å; R314-R316 PolarHBondContact O-N 2.74Å; R314-E317 PolarHBondContact O-N 2.72Å
315	A	83.7	Confident	88.8	Confident	81 Å²	81	64.3 Å²	64.3	67%	0.669	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	1.6	175	0	0	0	0	0	114.8	D311 E313	D311-A315 WeakPolarHBondContact O-CB 3.44Å; D311-A315 PolarHBondContact O-N 2.96Å; E313-A315 VanDerWaalsContact C-N 3.29Å; E313-A315 PolarHBondContact O-N 2.74Å
316	R	83.8	Confident	88.6	Confident	102 Å²	102	64.3 Å²	64.3	39%	0.385	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-7.1	171.1	-60.6	177.8	-163.3	145.4	5.6	113.3	E312 E313 R314 R318	E312-R316 IonicContact OE1-NH2 2.68Å; E312-R316 PolarHBondContact OE1-NH2 2.83Å; E312-R316 VanDerWaalsContact OE1-NH2 3.09Å; E313-R316 WeakPolarHBondContact O-CB 3.49Å; E313-R316 PolarHBondContact O-N 2.79Å; E313-R316 VanDerWaalsContact O-N 3.12Å; R314-R316 PolarHBondContact O-N 2.74Å; R316-R318 HydrophobicContact CB-CG 4.03Å; R316-R318 WeakPolarHBondContact O-CG 3.43Å; R316-R318 PolarHBondContact O-N 3.48Å
317	E	85.7	Confident	88.4	Confident	146 Å²	146	62.5 Å²	62.5	68%	0.682	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	30.5	178.4	-58.7	-173.7	165.6	0	0	114.2	P283 R314 F346	P283-E317 VanDerWaalsContact CD-O 3.28Å; P283-E317 WeakPolarHBondContact CD-O 3.36Å; P283-E317 VanDerWaalsContact CG-C 3.45Å; P283-E317 WeakPolarHBondContact CG-O 3.25Å; R314-E317 PolarHBondContact O-N 2.72Å; E317-F346 WeakPolarHBondContact O-CE1 3.25Å; E317-F346 VanDerWaalsContact O-CZ 3.3Å; E317-F346 WeakPolarHBondContact O-CZ 3.45Å
318	R	88.7	Confident	88.4	Confident	70 Å²	70	58.5 Å²	58.5	26%	0.264	28%	0.278	S	S	.	.			trans	-147	141.9	179.4	68.2	-169.6	-176	-112.1	11.8	111.4	D260 N280 R316 F346	D260-R318 IonicContact OD1-NH2 2.67Å; D260-R318 IonicContact OD2-CZ 2.65Å; D260-R318 IonicContact OD2-NH1 2.74Å; D260-R318 PolarHBondContact OD2-NH1 3.42Å; D260-R318 IonicContact OD2-NH2 2.67Å; D260-R318 PolarHBondContact OD2-NH2 3.42Å; N280-R318 WeakPolarHBondContact OD1-CD 3.38Å; R316-R318 HydrophobicContact CB-CG 4.03Å; R316-R318 WeakPolarHBondContact O-CG 3.43Å; R316-R318 PolarHBondContact O-N 3.48Å; R318-F346 HydrophobicContact CB-CD1 4.42Å; R318-F346 HydrophobicContact CB-CE1 4.09Å
319	N	91	Very high	88.6	Confident	9 Å²	9	63.5 Å²	63.5	5%	0.048	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	167.9	173.1	-78	-15.7	0	0	0	111.2	N280 I281 I305 W307 P308	N280-N319 PolarHBondContact N-O 3.48Å; I281-N319 HydrophobicContact CB-CB 4.04Å; I281-N319 HydrophobicContact CG2-CB 4.41Å; I281-N319 PolarHBondContact N-O 3.24Å; I281-N319 PolarHBondContact O-N 2.92Å; I305-N319 HydrophobicContact CG2-CB 4.29Å; W307-N319 VanDerWaalsContact CZ3-ND2 3.33Å; W307-N319 WeakPolarHBondContact CZ3-ND2 3.44Å; P308-N319 WeakPolarHBondContact CD-OD1 3.43Å
320	C	93	Very high	88.8	Confident	39 Å²	39	53.6 Å²	53.6	26%	0.264	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	170.4	161.6	59.4	0	0	0	0	109.5	Y277 L278 M306	Y277-C320 HydrophobicContact CE2-CB 3.91Å; Y277-C320 WeakPolarHBondContact OH-CB 3.28Å; L278-C320 CarbonylContact O-C 3.58Å; L278-C320 WeakPolarHBondContact O-CA 3.45Å; L278-C320 WeakPolarHBondContact O-CB 3.29Å; M306-C320 WeakPolarHBondContact CA-O 3.48Å; M306-C320 WeakPolarHBondContact CB-O 3.5Å; M306-C320 PolarHBondContact N-O 2.69Å
321	G	94.4	Very high	89.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.3	-173.2	-174	0	0	0	0	0	113	Y277 L278 K304	Y277-G321 WeakPolarHBondContact CD2-O 3.45Å; L278-G321 PolarHBondContact N-O 2.87Å; L278-G321 PolarHBondContact O-N 3.37Å; K304-G321 CarbonylContact O-C 3.44Å; K304-G321 WeakPolarHBondContact O-CA 3.45Å
322	F	95.9	Very high	89.6	Confident	67 Å²	67	51.7 Å²	51.7	29%	0.294	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	142.1	175.1	-67.8	-85.8	0	0	0	110.3	L276 Y277 K304 M306	L276-F322 VanDerWaalsContact O-CA 3.26Å; L276-F322 WeakPolarHBondContact O-CA 3.23Å; Y277-F322 HydrophobicContact CD2-CD1 4.31Å; Y277-F322 AromaticContact CD2-CE1 3.71Å; Y277-F322 HydrophobicContact CD2-CE1 3.71Å; Y277-F322 HydrophobicContact CD2-CE2 4.3Å; Y277-F322 AromaticContact CD2-CZ 3.7Å; Y277-F322 HydrophobicContact CD2-CZ 3.7Å; Y277-F322 HydrophobicContact CE2-CZ 4.42Å; Y277-F322 HydrophobicContact CG-CE1 4.27Å; K304-F322 PolarHBondContact N-O 3.01Å; K304-F322 PolarHBondContact O-N 3.11Å; M306-F322 HydrophobicContact CG-CD2 4.14Å; M306-F322 HydrophobicContact CG-CE2 4.11Å
323	V	95.9	Very high	90	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	118.5	171.1	172.5	0	0	0	0	108.5	N275 L276 L278 F294 L300 S302 V303 F325	N275-V323 PolarHBondContact OD1-O 3.38Å; L276-V323 PolarHBondContact N-O 2.91Å; L276-V323 PolarHBondContact O-N 2.95Å; L278-V323 HydrophobicContact CD1-CB 4.4Å; L278-V323 HydrophobicContact CD1-CG2 3.6Å; L278-V323 HydrophobicContact CG-CG2 4.35Å; F294-V323 HydrophobicContact CB-CG1 4.01Å; F294-V323 HydrophobicContact CD1-CB 4.05Å; F294-V323 HydrophobicContact CD1-CG1 3.77Å; F294-V323 HydrophobicContact CD1-CG2 4.22Å; F294-V323 HydrophobicContact CD2-CG2 4.29Å; F294-V323 HydrophobicContact CE1-CB 4.34Å; F294-V323 HydrophobicContact CE1-CG2 4.46Å; F294-V323 HydrophobicContact CG-CB 4.38Å; F294-V323 HydrophobicContact CG-CG1 3.97Å; F294-V323 HydrophobicContact CG-CG2 4.14Å; L300-V323 HydrophobicContact CD1-CG1 4.44Å; L300-V323 HydrophobicContact CD2-CG1 3.96Å; S302-V323 CarbonylContact O-C 3.58Å; S302-V323 WeakPolarHBondContact O-CA 3.26Å; V303-V323 HydrophobicContact CB-CG2 4.48Å; V303-V323 HydrophobicContact CG1-CG2 4.1Å; V303-V323 HydrophobicContact CG2-CG1 4.33Å; V303-V323 HydrophobicContact CG2-CG2 4.14Å; V323-F325 HydrophobicContact CG1-CD2 4.34Å; V323-F325 HydrophobicContact CG1-CE2 3.95Å; V323-F325 HydrophobicContact CG1-CZ 4.49Å
324	A	94.9	Very high	90.6	Very high	3 Å²	3	46.7 Å²	46.7	3%	0.025	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.7	172.6	0	0	0	0	0	110.2	T274 N275 L300 A301 S302	T274-A324 WeakPolarHBondContact O-CA 3.4Å; N275-A324 HydrophobicContact CB-CB 4.11Å; L300-A324 CarbonylContact C-O 3.46Å; A301-A324 WeakPolarHBondContact CA-O 3.21Å; A301-A324 HydrophobicContact CB-CB 4.23Å; A301-A324 WeakPolarHBondContact CB-O 3.5Å; A301-A324 PolarHBondContact N-O 3.14Å; S302-A324 PolarHBondContact N-O 2.93Å; S302-A324 VanDerWaalsContact N-O 3.11Å; S302-A324 PolarHBondContact O-N 2.92Å
325	F	94.3	Very high	91	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	163.3	170.6	-73.9	-96.3	0	0	0	111.1	T274 L276 F294 F297 L300 A301 V323 N327 D330 A331 A334	T274-F325 WeakPolarHBondContact CB-O 3.48Å; T274-F325 PolarHBondContact O-N 3.24Å; T274-F325 PolarHBondContact OG1-O 2.99Å; L276-F325 HydrophobicContact CD1-CD2 4.42Å; L276-F325 HydrophobicContact CD1-CE2 3.9Å; F294-F325 HydrophobicContact CB-CZ 4.07Å; F294-F325 HydrophobicContact CD1-CE2 4.03Å; F294-F325 HydrophobicContact CD1-CZ 4.06Å; F294-F325 WeakPolarHBondContact O-CE1 3.39Å; F294-F325 WeakPolarHBondContact O-CZ 3.23Å; F297-F325 HydrophobicContact CB-CE1 3.8Å; F297-F325 HydrophobicContact CB-CZ 3.97Å; L300-F325 HydrophobicContact CD2-CD1 3.59Å; L300-F325 HydrophobicContact CD2-CD2 4.41Å; L300-F325 HydrophobicContact CD2-CE1 3.31Å; L300-F325 HydrophobicContact CD2-CE2 4.19Å; L300-F325 HydrophobicContact CD2-CG 4.14Å; L300-F325 HydrophobicContact CD2-CZ 3.64Å; A301-F325 WeakPolarHBondContact CB-O 3.36Å; V323-F325 HydrophobicContact CG1-CD2 4.34Å; V323-F325 HydrophobicContact CG1-CE2 3.95Å; V323-F325 HydrophobicContact CG1-CZ 4.49Å; F325-N327 WeakPolarHBondContact CB-O 3.43Å; F325-D330 HydrophobicContact CB-CB 4.21Å; F325-D330 HydrophobicContact CD1-CB 3.56Å; F325-D330 HydrophobicContact CE1-CB 4.2Å; F325-D330 HydrophobicContact CG-CB 4.05Å; F325-A331 HydrophobicContact CB-CB 4.13Å; F325-A331 HydrophobicContact CD2-CB 3.63Å; F325-A331 HydrophobicContact CE2-CB 4.4Å; F325-A331 HydrophobicContact CG-CB 4.09Å; F325-A334 HydrophobicContact CE1-CB 4.46Å; F325-A334 HydrophobicContact CE2-CB 3.6Å; F325-A334 HydrophobicContact CZ-CB 3.47Å; F325-A334 VanDerWaalsContact CZ-CB 3.47Å
326	M	90	Very high	91.4	Very high	6 Å²	6	46.3 Å²	46.3	3%	0.03	20%	0.203	C	C	.	.	S	Bend	trans	-68.5	-39.2	167.9	-77.3	-67.3	177.4	0	0	112.7	P299 A301 I358 P359 H361 P362 Y511 L512	P299-M326 HydrophobicContact CB-CB 4.33Å; P299-M326 HydrophobicContact CB-CG 4.01Å; P299-M326 HydrophobicContact CG-CB 4.06Å; P299-M326 HydrophobicContact CG-CG 4.25Å; P299-M326 PolarHBondContact O-N 3.29Å; A301-M326 HydrophobicContact CB-CE 4.18Å; A301-M326 HydrophobicContact CB-CG 4.43Å; A301-M326 HydrophobicContact CB-SD 4.17Å; M326-I358 HydrophobicContact CE-CG2 4.23Å; M326-I358 HydrophobicContact SD-CG2 3.28Å; M326-I358 WeakPolarHBondContact SD-CG2 3.45Å; M326-P359 HydrophobicContact CE-CG 4.06Å; M326-P359 WeakPolarHBondContact CE-O 3.22Å; M326-H361 WeakPolarHBondContact CE-O 3.3Å; M326-P362 HydrophobicContact CE-CB 3.67Å; M326-P362 HydrophobicContact CE-CG 4.37Å; M326-P362 HydrophobicContact CG-CB 4.28Å; M326-Y511 WeakPolarHBondContact CB-O 3.47Å; M326-L512 HydrophobicContact CB-CD2 4.38Å; M326-L512 WeakPolarHBondContact O-CD2 3.06Å; M326-L512 HydrophobicContact SD-CD2 4.33Å
327	N	88	Confident	91.8	Very high	32 Å²	32	44.6 Å²	44.6	17%	0.171	20%	0.201	C	C	.	.	S	Bend	trans	-117.3	153.2	-177.7	-178.7	25.3	0	0	0	111.5	F325 D330 G514	F325-N327 WeakPolarHBondContact CB-O 3.43Å; N327-D330 PolarHBondContact ND2-OD1 2.85Å; N327-G514 WeakPolarHBondContact ND2-CA 3.49Å; N327-G514 PolarHBondContact ND2-N 3.33Å
328	R	89.8	Confident	92.1	Very high	43 Å²	43	37.8 Å²	37.8	16%	0.162	17%	0.17	C	C	.	.	H	α-helix	trans	-71.4	-41.4	179.9	173.1	60.9	-168.3	-153.9	-5.3	112.3	P271 T273 T274 D330 A331 E332 W352	P271-R328 WeakPolarHBondContact O-CD 3.29Å; P271-R328 PolarHBondContact O-NE 2.82Å; P271-R328 VanDerWaalsContact O-NE 3.15Å; T273-R328 VanDerWaalsContact O-CD 3.26Å; T273-R328 WeakPolarHBondContact O-CD 3.3Å; T273-R328 PolarHBondContact O-NH1 2.97Å; T274-R328 HydrophobicContact CG2-CB 4.33Å; R328-D330 VanDerWaalsContact C-N 3.31Å; R328-D330 PolarHBondContact O-N 2.93Å; R328-A331 PolarHBondContact O-N 3.35Å; R328-E332 IonicContact CZ-OE1 2.74Å; R328-E332 VanDerWaalsContact NE-CD 3.31Å; R328-E332 IonicContact NE-OE1 3.04Å; R328-E332 PolarHBondContact NE-OE1 3.27Å; R328-E332 IonicContact NH2-OE1 3.35Å; R328-E332 PolarHBondContact NH2-OE1 3.11Å; R328-E332 PolarHBondContact O-N 2.71Å; R328-W352 VanDerWaalsContact CZ-CH2 3.44Å; R328-W352 VanDerWaalsContact NH1-CZ3 3.33Å; R328-W352 VanDerWaalsContact NH2-CZ2 3.27Å
329	R	88.7	Confident	92.3	Very high	137 Å²	137	38.3 Å²	38.3	52%	0.517	18%	0.177	S	C	.	.	H	α-helix	trans	-58.2	-45.3	178.7	-62	-172.4	-178.1	-164.3	0.3	111	A331 E332 R333 E517	R329-A331 VanDerWaalsContact C-N 3.32Å; R329-A331 PolarHBondContact O-N 3.39Å; R329-E332 CarbonylContact O-C 3.51Å; R329-E332 WeakPolarHBondContact O-CA 3.48Å; R329-E332 WeakPolarHBondContact O-CB 3.3Å; R329-E332 PolarHBondContact O-N 2.95Å; R329-R333 WeakPolarHBondContact O-CG 3.38Å; R329-R333 PolarHBondContact O-N 3.06Å; R329-E517 IonicContact NH1-OE1 3.63Å; R329-E517 PolarHBondContact NH1-OE1 2.81Å
330	D	91.3	Very high	92.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.6	-43	179.4	-53.2	6.4	0	0	0	111.8	F297 P299 F325 N327 R328 E332 R333 A334 G514	F297-D330 WeakPolarHBondContact O-CB 3.47Å; P299-D330 WeakPolarHBondContact CD-OD2 3.44Å; F325-D330 HydrophobicContact CB-CB 4.21Å; F325-D330 HydrophobicContact CD1-CB 3.56Å; F325-D330 HydrophobicContact CE1-CB 4.2Å; F325-D330 HydrophobicContact CG-CB 4.05Å; N327-D330 PolarHBondContact ND2-OD1 2.85Å; R328-D330 VanDerWaalsContact C-N 3.31Å; R328-D330 PolarHBondContact O-N 2.93Å; D330-E332 VanDerWaalsContact C-N 3.34Å; D330-E332 PolarHBondContact O-N 3.34Å; D330-R333 VanDerWaalsContact CG-NH2 3.25Å; D330-R333 PolarHBondContact O-N 3.31Å; D330-R333 IonicContact OD1-CZ 3.62Å; D330-R333 IonicContact OD1-NH1 2.66Å; D330-R333 IonicContact OD1-NH2 3.9Å; D330-R333 PolarHBondContact OD1-NH2 2.94Å; D330-R333 IonicContact OD2-NH2 3.4Å; D330-A334 WeakPolarHBondContact O-CB 3.49Å; D330-A334 PolarHBondContact O-N 3.39Å; D330-G514 WeakPolarHBondContact OD1-CA 3.46Å
331	A	92.8	Very high	92.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66	-34.3	174.4	0	0	0	0	0	112.7	L276 F325 R328 R329 L335 W352	L276-A331 HydrophobicContact CD2-CB 4.43Å; L276-A331 HydrophobicContact CG-CB 4.36Å; F325-A331 HydrophobicContact CB-CB 4.13Å; F325-A331 HydrophobicContact CD2-CB 3.63Å; F325-A331 HydrophobicContact CE2-CB 4.4Å; F325-A331 HydrophobicContact CG-CB 4.09Å; R328-A331 PolarHBondContact O-N 3.35Å; R329-A331 VanDerWaalsContact C-N 3.32Å; R329-A331 PolarHBondContact O-N 3.39Å; A331-L335 VanDerWaalsContact O-CB 3.26Å; A331-L335 WeakPolarHBondContact O-CB 3.44Å; A331-L335 PolarHBondContact O-N 3.29Å; A331-W352 HydrophobicContact CB-CH2 3.89Å; A331-W352 HydrophobicContact CB-CZ3 3.81Å
332	E	91.9	Very high	91.9	Very high	84 Å²	84	47.3 Å²	47.3	39%	0.393	23%	0.226	S	C	.	.	H	α-helix	trans	-68.9	-42.4	173.9	-74.4	171.6	161.3	0	0	111.8	R328 R329 D330 A334 L335 K336 W352	R328-E332 IonicContact CZ-OE1 2.74Å; R328-E332 VanDerWaalsContact NE-CD 3.31Å; R328-E332 IonicContact NE-OE1 3.04Å; R328-E332 PolarHBondContact NE-OE1 3.27Å; R328-E332 IonicContact NH2-OE1 3.35Å; R328-E332 PolarHBondContact NH2-OE1 3.11Å; R328-E332 PolarHBondContact O-N 2.71Å; R329-E332 CarbonylContact O-C 3.51Å; R329-E332 WeakPolarHBondContact O-CA 3.48Å; R329-E332 WeakPolarHBondContact O-CB 3.3Å; R329-E332 PolarHBondContact O-N 2.95Å; D330-E332 VanDerWaalsContact C-N 3.34Å; D330-E332 PolarHBondContact O-N 3.34Å; E332-A334 VanDerWaalsContact C-N 3.35Å; E332-A334 PolarHBondContact O-N 3.01Å; E332-L335 PolarHBondContact O-N 3.03Å; E332-K336 WeakPolarHBondContact O-CB 3.31Å; E332-K336 PolarHBondContact O-N 2.93Å; E332-W352 HydrophobicContact CG-CH2 3.69Å; E332-W352 HydrophobicContact CG-CZ2 3.65Å
333	R	90.2	Very high	91.6	Very high	34 Å²	34	44.9 Å²	44.9	13%	0.128	22%	0.216	C	C	.	.	H	α-helix	trans	-59.7	-44.7	172.1	-63.6	-169.7	-58.9	-117.3	-2.2	110.8	F297 R329 D330 K336 N337 M515 E520	F297-R333 HydrophobicContact CD1-CB 3.87Å; F297-R333 VanDerWaalsContact CE1-O 3.24Å; F297-R333 WeakPolarHBondContact CE1-O 3.29Å; F297-R333 PolarHBondContact O-NH2 2.92Å; R329-R333 WeakPolarHBondContact O-CG 3.38Å; R329-R333 PolarHBondContact O-N 3.06Å; D330-R333 VanDerWaalsContact CG-NH2 3.25Å; D330-R333 PolarHBondContact O-N 3.31Å; D330-R333 IonicContact OD1-CZ 3.62Å; D330-R333 IonicContact OD1-NH1 2.66Å; D330-R333 IonicContact OD1-NH2 3.9Å; D330-R333 PolarHBondContact OD1-NH2 2.94Å; D330-R333 IonicContact OD2-NH2 3.4Å; R333-K336 PolarHBondContact O-N 2.92Å; R333-N337 PolarHBondContact O-N 3.19Å; R333-N337 PolarHBondContact O-ND2 3.3Å; R333-M515 PolarHBondContact NH1-O 3.46Å; R333-E520 WeakPolarHBondContact CD-OE1 3.14Å; R333-E520 IonicContact CZ-OE1 3.17Å; R333-E520 IonicContact NE-OE1 3.04Å; R333-E520 IonicContact NH1-OE1 3.43Å; R333-E520 PolarHBondContact NH1-OE1 2.98Å
334	A	94	Very high	91.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.5	-45.3	177.3	0	0	0	0	0	112.7	L276 F294 F297 F325 D330 E332 K336 N337 L338	L276-A334 HydrophobicContact CD1-CB 3.92Å; F294-A334 HydrophobicContact CD1-CB 4.38Å; F297-A334 HydrophobicContact CB-CB 3.91Å; F297-A334 HydrophobicContact CD1-CB 3.98Å; F297-A334 VanDerWaalsContact CD1-N 3.31Å; F297-A334 HydrophobicContact CD2-CB 3.96Å; F297-A334 HydrophobicContact CE1-CB 4.46Å; F297-A334 HydrophobicContact CG-CB 3.66Å; F325-A334 HydrophobicContact CE1-CB 4.46Å; F325-A334 HydrophobicContact CE2-CB 3.6Å; F325-A334 HydrophobicContact CZ-CB 3.47Å; F325-A334 VanDerWaalsContact CZ-CB 3.47Å; D330-A334 WeakPolarHBondContact O-CB 3.49Å; D330-A334 PolarHBondContact O-N 3.39Å; E332-A334 VanDerWaalsContact C-N 3.35Å; E332-A334 PolarHBondContact O-N 3.01Å; A334-K336 VanDerWaalsContact C-N 3.34Å; A334-K336 PolarHBondContact O-N 3.44Å; A334-N337 PolarHBondContact O-N 3.41Å; A334-L338 WeakPolarHBondContact O-CB 3.21Å; A334-L338 PolarHBondContact O-N 3.3Å
335	L	93.2	Very high	90.9	Very high	29 Å²	29	53.6 Å²	53.6	15%	0.152	27%	0.269	C	S	.	.	H	α-helix	trans	-62.1	-39.4	177	179	59.8	0	0	0	112.3	L276 A331 E332 N339 L350 W352	L276-L335 HydrophobicContact CD1-CB 4.47Å; L276-L335 HydrophobicContact CD2-CB 3.97Å; L276-L335 HydrophobicContact CD2-CD1 4.44Å; L276-L335 HydrophobicContact CD2-CD2 4.36Å; L276-L335 HydrophobicContact CD2-CG 4.49Å; A331-L335 VanDerWaalsContact O-CB 3.26Å; A331-L335 WeakPolarHBondContact O-CB 3.44Å; A331-L335 PolarHBondContact O-N 3.29Å; E332-L335 PolarHBondContact O-N 3.03Å; L335-N339 HydrophobicContact CD1-CB 4.49Å; L335-N339 WeakPolarHBondContact O-CB 3.44Å; L335-L350 HydrophobicContact CD1-CB 3.48Å; L335-L350 VanDerWaalsContact CD1-CB 3.48Å; L335-W352 HydrophobicContact CD2-CD2 4.12Å; L335-W352 HydrophobicContact CD2-CH2 4.17Å; L335-W352 HydrophobicContact CD2-CZ2 3.39Å
336	K	91.9	Very high	90.7	Very high	172 Å²	172	56.2 Å²	56.2	75%	0.748	28%	0.281	S	S	*	.	H	α-helix	trans	-65.4	-38.9	-179.5	-174.2	-177.3	176.8	-171.6	0	112.8	E332 R333 A334	E332-K336 WeakPolarHBondContact O-CB 3.31Å; E332-K336 PolarHBondContact O-N 2.93Å; R333-K336 PolarHBondContact O-N 2.92Å; A334-K336 VanDerWaalsContact C-N 3.34Å; A334-K336 PolarHBondContact O-N 3.44Å
337	N	91.4	Very high	90.8	Very high	66 Å²	66	59.6 Å²	59.6	35%	0.353	30%	0.296	S	S	.	.	H	α-helix	trans	-106.7	-23.3	-167.3	-62.2	-71	0	0	0	114.9	F297 R333 A334 F524	F297-N337 HydrophobicContact CE1-CB 3.75Å; F297-N337 HydrophobicContact CZ-CB 3.91Å; R333-N337 PolarHBondContact O-N 3.19Å; R333-N337 PolarHBondContact O-ND2 3.3Å; A334-N337 PolarHBondContact O-N 3.41Å; N337-F524 HydrophobicContact CB-CE1 3.79Å; N337-F524 HydrophobicContact CB-CZ 3.71Å; N337-F524 WeakPolarHBondContact ND2-CE1 3.26Å
338	L	92.8	Very high	91	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-90	-16	175.7	-63.8	-179.8	0	0	0	113.3	F294 F297 A334 G340 K341 M348 L350	F294-L338 HydrophobicContact CD1-CD1 3.72Å; F294-L338 HydrophobicContact CD2-CD1 4Å; F294-L338 HydrophobicContact CE1-CD1 3.52Å; F294-L338 HydrophobicContact CE2-CD1 3.81Å; F294-L338 HydrophobicContact CG-CD1 3.95Å; F294-L338 HydrophobicContact CZ-CD1 3.54Å; F297-L338 HydrophobicContact CD2-CD1 4.23Å; F297-L338 HydrophobicContact CE2-CD1 3.61Å; F297-L338 HydrophobicContact CE2-CD2 3.78Å; F297-L338 HydrophobicContact CE2-CG 3.56Å; F297-L338 HydrophobicContact CZ-CD1 4.21Å; F297-L338 HydrophobicContact CZ-CD2 3.92Å; F297-L338 HydrophobicContact CZ-CG 3.67Å; A334-L338 WeakPolarHBondContact O-CB 3.21Å; A334-L338 PolarHBondContact O-N 3.3Å; L338-G340 PolarHBondContact O-N 3.37Å; L338-K341 HydrophobicContact CD2-CD 3.63Å; L338-K341 VanDerWaalsContact O-CB 3.26Å; L338-K341 WeakPolarHBondContact O-CB 3.21Å; L338-K341 PolarHBondContact O-N 3.49Å; L338-M348 HydrophobicContact CB-CE 4.23Å; L338-M348 HydrophobicContact CD1-CE 4.3Å; L338-L350 VanDerWaalsContact C-CD1 3.5Å; L338-L350 HydrophobicContact CB-CD1 3.86Å; L338-L350 HydrophobicContact CB-CD2 4.12Å; L338-L350 WeakPolarHBondContact O-CD1 3.45Å
339	N	92.1	Very high	91.1	Very high	80 Å²	80	60.7 Å²	60.7	43%	0.428	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	116.5	-174	-167.5	25.5	0	0	0	111.1	L335 K341 L350	L335-N339 HydrophobicContact CD1-CB 4.49Å; L335-N339 WeakPolarHBondContact O-CB 3.44Å; N339-K341 VanDerWaalsContact C-N 3.32Å; N339-L350 HydrophobicContact CB-CB 4.19Å; N339-L350 HydrophobicContact CB-CD1 4.09Å; N339-L350 PolarHBondContact OD1-N 3.19Å
340	G	90.3	Very high	91.4	Very high	39 Å²	39	55 Å²	55	40%	0.402	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	-3.2	-168.1	0	0	0	0	0	114	L338 M348	L338-G340 PolarHBondContact O-N 3.37Å; G340-M348 PolarHBondContact N-O 3.37Å
341	K	90.5	Very high	91.5	Very high	72 Å²	72	55.5 Å²	55.5	31%	0.313	29%	0.285	S	S	.	.			trans	-68.6	133.5	176.1	-171.8	-176.6	173.1	-167.5	0	109.9	E293 L338 N339 I343 M348	E293-K341 IonicContact OE1-NZ 3.69Å; E293-K341 IonicContact OE2-NZ 2.85Å; E293-K341 PolarHBondContact OE2-NZ 2.94Å; L338-K341 HydrophobicContact CD2-CD 3.63Å; L338-K341 VanDerWaalsContact O-CB 3.26Å; L338-K341 WeakPolarHBondContact O-CB 3.21Å; L338-K341 PolarHBondContact O-N 3.49Å; N339-K341 VanDerWaalsContact C-N 3.32Å; K341-I343 HydrophobicContact CD-CD1 4.15Å; K341-I343 HydrophobicContact CD-CG1 4.13Å; K341-I343 HydrophobicContact CG-CG1 4.1Å; K341-M348 PolarHBondContact O-N 3.29Å
342	M	90.6	Very high	91.5	Very high	127 Å²	127	57 Å²	57	63%	0.626	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	110.8	177.3	-154	70.6	150.7	0	0	109.6	F346 E347	M342-F346 VanDerWaalsContact SD-C 3.59Å; M342-E347 HydrophobicContact SD-CB 3.81Å; M342-E347 PolarHBondContact SD-N 2.87Å
343	I	88.3	Confident	91.4	Very high	16 Å²	16	53 Å²	53	8%	0.082	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	124.9	-179.9	-57.2	-175.6	0	0	0	108.9	M285 E293 K341 S345 F346 M348	M285-I343 HydrophobicContact CE-CG2 4.11Å; M285-I343 HydrophobicContact SD-CG2 4.42Å; E293-I343 HydrophobicContact CG-CD1 4.09Å; E293-I343 WeakPolarHBondContact OE2-CD1 3.14Å; K341-I343 HydrophobicContact CD-CD1 4.15Å; K341-I343 HydrophobicContact CD-CG1 4.13Å; K341-I343 HydrophobicContact CG-CG1 4.1Å; I343-S345 PolarHBondContact O-N 3.18Å; I343-S345 VanDerWaalsContact O-N 3.17Å; I343-F346 PolarHBondContact N-O 3.37Å; I343-F346 PolarHBondContact O-N 3.49Å; I343-M348 HydrophobicContact CD1-CE 3.57Å
344	M	87.4	Confident	91.4	Very high	81 Å²	81	57 Å²	57	40%	0.399	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	42.9	-175.3	-57.5	176.1	71.2	0	0	112.7	N282 Q284 M285 F346	N282-M344 HydrophobicContact CB-CB 4.11Å; N282-M344 VanDerWaalsContact ND2-CB 3.33Å; N282-M344 WeakPolarHBondContact ND2-CB 3.47Å; N282-M344 PolarHBondContact ND2-O 2.79Å; Q284-M344 HydrophobicContact CB-CE 4.04Å; M285-M344 HydrophobicContact CB-SD 4.45Å; M344-F346 VanDerWaalsContact C-N 3.3Å; M344-F346 WeakPolarHBondContact O-CD2 3.26Å; M344-F346 PolarHBondContact O-N 2.95Å
345	S	88.9	Confident	91.1	Very high	105 Å²	105	60 Å²	60	73%	0.734	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	11	-175.6	-51.6	0	0	0	0	117.2	I343	I343-S345 PolarHBondContact O-N 3.18Å; I343-S345 VanDerWaalsContact O-N 3.17Å
346	F	90	Very high	90.9	Very high	55 Å²	55	61.6 Å²	61.6	24%	0.241	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.9	172.7	-75	-107.6	0	0	0	111.3	N280 N282 E317 R318 M342 I343 M344 M348	N280-F346 WeakPolarHBondContact O-CB 3.45Å; N282-F346 HydrophobicContact CB-CB 4.37Å; N282-F346 HydrophobicContact CB-CD2 3.55Å; N282-F346 HydrophobicContact CB-CE2 3.99Å; N282-F346 HydrophobicContact CB-CG 4.03Å; N282-F346 WeakPolarHBondContact ND2-CD2 3.28Å; N282-F346 WeakPolarHBondContact ND2-CE2 3.48Å; E317-F346 WeakPolarHBondContact O-CE1 3.25Å; E317-F346 VanDerWaalsContact O-CZ 3.3Å; E317-F346 WeakPolarHBondContact O-CZ 3.45Å; R318-F346 HydrophobicContact CB-CD1 4.42Å; R318-F346 HydrophobicContact CB-CE1 4.09Å; M342-F346 VanDerWaalsContact SD-C 3.59Å; I343-F346 PolarHBondContact N-O 3.37Å; I343-F346 PolarHBondContact O-N 3.49Å; M344-F346 VanDerWaalsContact C-N 3.3Å; M344-F346 WeakPolarHBondContact O-CD2 3.26Å; M344-F346 PolarHBondContact O-N 2.95Å; F346-M348 PolarHBondContact O-N 3.11Å
347	E	92.5	Very high	90.6	Very high	77 Å²	77	59.3 Å²	59.3	36%	0.36	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	105.5	174	-175.4	-152	151	0	0	109.3	N280 M342 K349	N280-E347 WeakPolarHBondContact CB-O 3.35Å; N280-E347 PolarHBondContact ND2-O 3.18Å; M342-E347 HydrophobicContact SD-CB 3.81Å; M342-E347 PolarHBondContact SD-N 2.87Å; E347-K349 VanDerWaalsContact CD-CE 3.41Å; E347-K349 VanDerWaalsContact OE1-CE 3.31Å; E347-K349 WeakPolarHBondContact OE1-CE 3.43Å; E347-K349 IonicContact OE1-NZ 3.64Å; E347-K349 PolarHBondContact OE1-NZ 3.4Å; E347-K349 VanDerWaalsContact OE2-CE 3.23Å; E347-K349 WeakPolarHBondContact OE2-CE 3.37Å; E347-K349 IonicContact OE2-NZ 2.62Å; E347-K349 PolarHBondContact OE2-NZ 3.1Å
348	M	91.8	Very high	90.3	Very high	3 Å²	3	59.7 Å²	59.7	2%	0.015	33%	0.331	C	S	.	.			trans	-77	129.6	-176.3	-167.8	159.2	57.8	0	0	111	L278 I281 F294 L338 G340 K341 I343 F346 L350	L278-M348 HydrophobicContact CD1-SD 4.46Å; I281-M348 HydrophobicContact CG1-SD 4.12Å; F294-M348 HydrophobicContact CE2-CE 3.55Å; F294-M348 HydrophobicContact CE2-SD 4.14Å; F294-M348 HydrophobicContact CZ-CE 3.59Å; F294-M348 HydrophobicContact CZ-SD 4.18Å; L338-M348 HydrophobicContact CB-CE 4.23Å; L338-M348 HydrophobicContact CD1-CE 4.3Å; G340-M348 PolarHBondContact N-O 3.37Å; K341-M348 PolarHBondContact O-N 3.29Å; I343-M348 HydrophobicContact CD1-CE 3.57Å; F346-M348 PolarHBondContact O-N 3.11Å; M348-L350 HydrophobicContact CB-CD1 4.32Å; M348-L350 HydrophobicContact CE-CD1 4.26Å; M348-L350 HydrophobicContact CG-CD1 3.86Å
349	K	92.6	Very high	89.9	Confident	95 Å²	95	61.7 Å²	61.7	41%	0.413	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	110.4	-174.3	-52.5	-163.5	-171	-120.2	0	110	G279 N280 E347	G279-K349 WeakPolarHBondContact CA-O 3.41Å; G279-K349 PolarHBondContact N-O 3.43Å; G279-K349 PolarHBondContact O-N 2.97Å; N280-K349 HydrophobicContact CB-CG 4.46Å; E347-K349 VanDerWaalsContact CD-CE 3.41Å; E347-K349 VanDerWaalsContact OE1-CE 3.31Å; E347-K349 WeakPolarHBondContact OE1-CE 3.43Å; E347-K349 IonicContact OE1-NZ 3.64Å; E347-K349 PolarHBondContact OE1-NZ 3.4Å; E347-K349 VanDerWaalsContact OE2-CE 3.23Å; E347-K349 WeakPolarHBondContact OE2-CE 3.37Å; E347-K349 IonicContact OE2-NZ 2.62Å; E347-K349 PolarHBondContact OE2-NZ 3.1Å
350	L	94.4	Very high	89.1	Confident	17 Å²	17	62.7 Å²	62.7	9%	0.089	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	157.4	-175	-67.3	88.6	0	0	0	111.6	L276 Y277 L278 F294 L335 L338 N339 M348	L276-L350 HydrophobicContact CD1-CD2 3.96Å; Y277-L350 WeakPolarHBondContact O-CA 3.37Å; L278-L350 HydrophobicContact CD2-CD2 3.57Å; L278-L350 HydrophobicContact CD2-CG 3.66Å; F294-L350 HydrophobicContact CE1-CD2 3.57Å; F294-L350 HydrophobicContact CZ-CD2 3.77Å; L335-L350 HydrophobicContact CD1-CB 3.48Å; L335-L350 VanDerWaalsContact CD1-CB 3.48Å; L338-L350 VanDerWaalsContact C-CD1 3.5Å; L338-L350 HydrophobicContact CB-CD1 3.86Å; L338-L350 HydrophobicContact CB-CD2 4.12Å; L338-L350 WeakPolarHBondContact O-CD1 3.45Å; N339-L350 HydrophobicContact CB-CB 4.19Å; N339-L350 HydrophobicContact CB-CD1 4.09Å; N339-L350 PolarHBondContact OD1-N 3.19Å; M348-L350 HydrophobicContact CB-CD1 4.32Å; M348-L350 HydrophobicContact CE-CD1 4.26Å; M348-L350 HydrophobicContact CG-CD1 3.86Å
351	G	93.2	Very high	88.4	Confident	10 Å²	10	66.9 Å²	66.9	10%	0.103	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	174.7	169.9	0	0	0	0	0	110.9	L276 Y277	L276-G351 CarbonylContact C-O 3.36Å; L276-G351 WeakPolarHBondContact CA-O 3.35Å; Y277-G351 PolarHBondContact N-O 3.27Å; Y277-G351 PolarHBondContact O-N 3.36Å; Y277-G351 VanDerWaalsContact O-N 3.14Å
352	W	94.2	Very high	88.2	Confident	32 Å²	32	64.4 Å²	64.4	12%	0.121	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	139.3	179.2	-67.2	117.4	0	0	0	112.6	H266 T273 L276 R328 A331 E332 L335	H266-W352 CarbonylContact C-O 3.49Å; T273-W352 HydrophobicContact CG2-CB 4.26Å; T273-W352 HydrophobicContact CG2-CD2 4.2Å; T273-W352 HydrophobicContact CG2-CE3 3.76Å; T273-W352 HydrophobicContact CG2-CG 4.41Å; T273-W352 WeakPolarHBondContact O-CZ3 3.49Å; L276-W352 HydrophobicContact CD2-CD2 4.29Å; L276-W352 HydrophobicContact CD2-CE3 3.58Å; L276-W352 HydrophobicContact CD2-CH2 3.84Å; L276-W352 HydrophobicContact CD2-CZ3 3.33Å; L276-W352 HydrophobicContact CG-CZ3 4.37Å; R328-W352 VanDerWaalsContact CZ-CH2 3.44Å; R328-W352 VanDerWaalsContact NH1-CZ3 3.33Å; R328-W352 VanDerWaalsContact NH2-CZ2 3.27Å; A331-W352 HydrophobicContact CB-CH2 3.89Å; A331-W352 HydrophobicContact CB-CZ3 3.81Å; E332-W352 HydrophobicContact CG-CH2 3.69Å; E332-W352 HydrophobicContact CG-CZ2 3.65Å; L335-W352 HydrophobicContact CD2-CD2 4.12Å; L335-W352 HydrophobicContact CD2-CH2 4.17Å; L335-W352 HydrophobicContact CD2-CZ2 3.39Å
353	G	90.1	Very high	88	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.01	35%	0.354	C	S	.	.			trans	-109.3	169.4	173.3	0	0	0	0	0	111.9	T273 N275	T273-G353 WeakPolarHBondContact CG2-O 3.07Å; T273-G353 PolarHBondContact OG1-O 3.14Å; N275-G353 WeakPolarHBondContact O-CA 3.24Å; N275-G353 PolarHBondContact O-N 2.97Å
354	K	89.3	Confident	88	Confident	117 Å²	117	65.9 Å²	65.9	51%	0.509	36%	0.361	S	S	.	.			trans	-65.2	137.4	175.3	-62.6	177.1	-177.4	177.5	0	110	H266 V268 N275	H266-K354 WeakPolarHBondContact NE2-CE 3.43Å; H266-K354 PolarHBondContact NE2-NZ 3.43Å; V268-K354 HydrophobicContact CG2-CG 3.92Å; N275-K354 WeakPolarHBondContact CB-O 3.34Å; N275-K354 PolarHBondContact ND2-O 3.5Å
355	A	88.3	Confident	87.9	Confident	64 Å²	64	64 Å²	64	53%	0.529	35%	0.352	S	S	.	.			trans	-54.9	142	176.4	0	0	0	0	0	111.6	T273	T273-A355 WeakPolarHBondContact OG1-CA 3.46Å; T273-A355 PolarHBondContact OG1-N 3.28Å
356	V	87.5	Confident	87.6	Confident	61 Å²	61	59 Å²	59	37%	0.37	32%	0.317	S	S	.	.			trans	-125.7	141.4	-178.7	177.1	0	0	0	0	107.8	N275 I358	N275-V356 HydrophobicContact CB-CG2 4.43Å; N275-V356 WeakPolarHBondContact ND2-CG2 3.47Å; V356-I358 PolarHBondContact O-N 3.31Å
357	P	86.8	Confident	87	Confident	124 Å²	124	60.9 Å²	60.9	81%	0.805	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-56.7	122	173.5	-24.9	35.1	0	0	0	111.3
358	I	85.3	Confident	85.8	Confident	74 Å²	74	60.1 Å²	60.1	38%	0.379	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-79.1	127.4	-178.7	-59.4	179.3	0	0	0	108.4	T274 A301 M326 V356	T274-I358 HydrophobicContact CG2-CD1 3.95Å; A301-I358 HydrophobicContact CB-CG2 4.11Å; M326-I358 HydrophobicContact CE-CG2 4.23Å; M326-I358 HydrophobicContact SD-CG2 3.28Å; M326-I358 WeakPolarHBondContact SD-CG2 3.45Å; V356-I358 PolarHBondContact O-N 3.31Å
359	P	84.3	Confident	84.8	Confident	46 Å²	46	60.6 Å²	60.6	30%	0.299	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-72.1	158.6	174.7	30.7	-31.5	0	0	0	110.6	A301 M326 H361	A301-P359 HydrophobicContact CB-CG 4.44Å; A301-P359 WeakPolarHBondContact O-CG 3.36Å; M326-P359 HydrophobicContact CE-CG 4.06Å; M326-P359 WeakPolarHBondContact CE-O 3.22Å; P359-H361 WeakPolarHBondContact CG-O 3.43Å; P359-H361 PolarHBondContact O-N 2.91Å
360	P	74.7	Confident	83.8	Confident	100 Å²	100	60.4 Å²	60.4	65%	0.649	34%	0.342	S	S	*	.	S	Bend	trans	-69.9	-17.3	-179.4	28.7	-36	0	0	0	113.9
361	H	75.8	Confident	82.4	Confident	128 Å²	128	65.1 Å²	65.1	59%	0.593	36%	0.363	S	S	*	.	S	Bend	trans	-133.9	143.5	177.9	-60.9	-16.3	0	0	0	109.6	M326 P359	M326-H361 WeakPolarHBondContact CE-O 3.3Å; P359-H361 WeakPolarHBondContact CG-O 3.43Å; P359-H361 PolarHBondContact O-N 2.91Å
362	P	85.9	Confident	81	Confident	20 Å²	20	69.7 Å²	69.7	13%	0.13	38%	0.381	C	S	.	.			trans	-75.1	154.4	-177.2	30.2	-35.6	0	0	0	112.2	P299 L300 M326 I365 Y511	P299-P362 HydrophobicContact CB-CB 4.03Å; P299-P362 HydrophobicContact CB-CG 4.24Å; L300-P362 CarbonylContact O-C 3.59Å; L300-P362 WeakPolarHBondContact O-CA 3.43Å; L300-P362 WeakPolarHBondContact O-CB 3.33Å; M326-P362 HydrophobicContact CE-CB 3.67Å; M326-P362 HydrophobicContact CE-CG 4.37Å; M326-P362 HydrophobicContact CG-CB 4.28Å; P362-I365 HydrophobicContact CG-CD1 4.32Å; P362-I365 HydrophobicContact CG-CG1 3.56Å; P362-Y511 VanDerWaalsContact CD-CE2 3.43Å; P362-Y511 HydrophobicContact CG-CD1 4.04Å; P362-Y511 HydrophobicContact CG-CD2 3.88Å; P362-Y511 HydrophobicContact CG-CE1 4.07Å; P362-Y511 HydrophobicContact CG-CE2 3.9Å; P362-Y511 HydrophobicContact CG-CG 3.93Å
363	I	87.6	Confident	79.7	Confident	116 Å²	116	69.5 Å²	69.5	60%	0.595	38%	0.384	S	S	*	.	S	Bend	trans	-79.5	-27.9	172.2	-56.7	-172.8	0	0	0	110.3	L300	L300-I363 PolarHBondContact O-N 2.89Å
364	Y	87.2	Confident	78.9	Confident	58 Å²	58	74 Å²	74	23%	0.227	41%	0.407	C	S	.	.	B	Isolated β-bridge	trans	-134.7	125.9	173.9	-176.5	-91.8	0	0	0	110.9	C291 L300 P366	C291-Y364 HydrophobicContact CB-CD2 3.64Å; C291-Y364 HydrophobicContact CB-CE2 4.17Å; C291-Y364 HydrophobicContact CB-CG 3.86Å; C291-Y364 WeakPolarHBondContact O-CE1 3.15Å; L300-Y364 HydrophobicContact CD1-CD1 4.32Å; L300-Y364 HydrophobicContact CD1-CG 4.46Å; L300-Y364 HydrophobicContact CG-CD1 4.37Å; L300-Y364 PolarHBondContact N-O 3.44Å; Y364-P366 HydrophobicContact CD1-CG 4.35Å; Y364-P366 HydrophobicContact CE1-CB 4.27Å; Y364-P366 HydrophobicContact CE1-CG 4.15Å
365	I	85.9	Confident	78.3	Confident	41 Å²	41	71.3 Å²	71.3	21%	0.21	40%	0.402	C	S	.	.			trans	-104.1	123.2	171.4	-58	164.8	0	0	0	106.9	P362 M369 M370 Y511	P362-I365 HydrophobicContact CG-CD1 4.32Å; P362-I365 HydrophobicContact CG-CG1 3.56Å; I365-M369 HydrophobicContact CG2-CB 4.41Å; I365-M370 HydrophobicContact CG2-CB 4.04Å; I365-M370 HydrophobicContact CG2-CG 4.29Å; I365-Y511 HydrophobicContact CD1-CE1 4.23Å; I365-Y511 VanDerWaalsContact CD1-OH 3.26Å; I365-Y511 WeakPolarHBondContact CD1-OH 3.21Å; I365-Y511 HydrophobicContact CG1-CE1 4Å; I365-Y511 HydrophobicContact CG2-CE1 4.16Å
366	P	82.3	Confident	77.9	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.006	38%	0.383	C	S	.	.			trans	-66.4	142.6	174.1	-20.3	35.3	0	0	0	110.8	G295 G298 Y364 S368 M369 M370	G295-P366 VanDerWaalsContact O-CB 3.31Å; G295-P366 WeakPolarHBondContact O-CB 3.44Å; G295-P366 WeakPolarHBondContact O-CG 3.35Å; G298-P366 WeakPolarHBondContact O-CG 3.49Å; Y364-P366 HydrophobicContact CD1-CG 4.35Å; Y364-P366 HydrophobicContact CE1-CB 4.27Å; Y364-P366 HydrophobicContact CE1-CG 4.15Å; P366-S368 VanDerWaalsContact C-N 3.26Å; P366-S368 PolarHBondContact O-N 2.74Å; P366-S368 VanDerWaalsContact O-N 3.15Å; P366-M369 HydrophobicContact CB-CE 4.31Å; P366-M369 VanDerWaalsContact CD-CE 3.49Å; P366-M369 HydrophobicContact CG-CE 3.59Å; P366-M369 PolarHBondContact O-N 3.33Å; P366-M370 PolarHBondContact O-N 3.18Å; P366-M370 VanDerWaalsContact O-N 3.09Å
367	P	77.8	Confident	77.5	Confident	94 Å²	94	69.4 Å²	69.4	61%	0.61	39%	0.385	S	S	*	.	H	α-helix	trans	-51.9	-40.9	-176.9	-30.1	36.1	0	0	0	114.2	M369 M370	P367-M369 PolarHBondContact O-N 3.07Å; P367-M370 WeakPolarHBondContact O-CB 3.31Å; P367-M370 PolarHBondContact O-N 2.86Å
368	S	67.9	Low	77.2	Confident	61 Å²	61	68.2 Å²	68.2	43%	0.427	38%	0.377	S	S	.	.	H	α-helix	trans	-64	-20.7	177.6	48.8	0	0	0	0	115	P366 M515	P366-S368 VanDerWaalsContact C-N 3.26Å; P366-S368 PolarHBondContact O-N 2.74Å; P366-S368 VanDerWaalsContact O-N 3.15Å; S368-M515 WeakPolarHBondContact OG-CE 3.39Å
369	M	70.3	Confident	76.9	Confident	12 Å²	12	65.6 Å²	65.6	6%	0.059	37%	0.366	C	S	.	.	H	α-helix	trans	-98.6	-11.8	169.6	-74.6	-173.3	-60.6	0	0	113.3	P299 I365 P366 P367 M515	P299-M369 HydrophobicContact CB-CE 4.12Å; P299-M369 HydrophobicContact CG-CE 3.58Å; P299-M369 HydrophobicContact CG-SD 4.35Å; I365-M369 HydrophobicContact CG2-CB 4.41Å; P366-M369 HydrophobicContact CB-CE 4.31Å; P366-M369 VanDerWaalsContact CD-CE 3.49Å; P366-M369 HydrophobicContact CG-CE 3.59Å; P366-M369 PolarHBondContact O-N 3.33Å; P367-M369 PolarHBondContact O-N 3.07Å; M369-M515 HydrophobicContact CE-CE 4.1Å; M369-M515 HydrophobicContact CE-CG 4.33Å; M369-M515 HydrophobicContact CG-CE 4.32Å; M369-M515 HydrophobicContact CG-CG 4.3Å; M369-M515 HydrophobicContact SD-CE 4.46Å; M369-M515 HydrophobicContact SD-CG 3.79Å
370	M	70.5	Confident	76.6	Confident	92 Å²	92	66.3 Å²	66.3	45%	0.453	38%	0.381	S	S	.	.	H	α-helix	trans	-72	-34.6	-179.9	-155.4	165.2	-159.5	0	0	111.5	I365 P366 P367 H372 T373 L374	I365-M370 HydrophobicContact CG2-CB 4.04Å; I365-M370 HydrophobicContact CG2-CG 4.29Å; P366-M370 PolarHBondContact O-N 3.18Å; P366-M370 VanDerWaalsContact O-N 3.09Å; P367-M370 WeakPolarHBondContact O-CB 3.31Å; P367-M370 PolarHBondContact O-N 2.86Å; M370-H372 VanDerWaalsContact C-N 3.31Å; M370-H372 PolarHBondContact O-N 2.91Å; M370-T373 CarbonylContact O-C 3.56Å; M370-T373 WeakPolarHBondContact O-CA 3.35Å; M370-T373 WeakPolarHBondContact O-CB 3.12Å; M370-T373 PolarHBondContact O-N 3.42Å; M370-T373 PolarHBondContact O-OG1 3.19Å; M370-L374 PolarHBondContact O-N 2.83Å; M370-L374 VanDerWaalsContact O-N 3.12Å
371	E	66.1	Low	76.9	Confident	115 Å²	115	62.2 Å²	62.2	54%	0.537	35%	0.354	S	S	.	.	H	α-helix	trans	-57.6	-38.7	176.2	-173.9	171.1	-170.3	0	0	113.4	T373 L374 K418	E371-T373 PolarHBondContact O-N 3.1Å; E371-L374 PolarHBondContact O-N 3.32Å; E371-L374 VanDerWaalsContact O-N 3.08Å; E371-K418 PolarHBondContact O-NZ 3.02Å
372	H	63.1	Low	77.2	Confident	106 Å²	106	58.8 Å²	58.8	49%	0.491	34%	0.343	S	S	.	.	H	α-helix	trans	-59.2	-30.5	173.4	-66.1	-67.8	0	0	0	112.3	M370 K418 Q519	M370-H372 VanDerWaalsContact C-N 3.31Å; M370-H372 PolarHBondContact O-N 2.91Å; H372-K418 VanDerWaalsContact O-CE 3.22Å; H372-K418 WeakPolarHBondContact O-CE 3.34Å; H372-K418 PolarHBondContact O-NZ 3.48Å; H372-Q519 PolarHBondContact NE2-NE2 2.85Å
373	T	67.4	Low	77.1	Confident	29 Å²	29	60.2 Å²	60.2	18%	0.178	35%	0.347	C	S	.	.	H	α-helix	trans	-90.2	-8	178.4	72.3	0	0	0	0	114.6	M370 E371 V420 Y511	M370-T373 CarbonylContact O-C 3.56Å; M370-T373 WeakPolarHBondContact O-CA 3.35Å; M370-T373 WeakPolarHBondContact O-CB 3.12Å; M370-T373 PolarHBondContact O-N 3.42Å; M370-T373 PolarHBondContact O-OG1 3.19Å; E371-T373 PolarHBondContact O-N 3.1Å; T373-V420 WeakPolarHBondContact O-CG1 3.41Å; T373-Y511 HydrophobicContact CG2-CE1 4.44Å
374	L	73.3	Confident	77	Confident	95 Å²	95	55.5 Å²	55.5	50%	0.497	32%	0.323	S	S	.	.	S	Bend	trans	-81.3	147.4	174.7	-68.6	177.2	0	0	0	111.2	M370 E371 K418	M370-L374 PolarHBondContact O-N 2.83Å; M370-L374 VanDerWaalsContact O-N 3.12Å; E371-L374 PolarHBondContact O-N 3.32Å; E371-L374 VanDerWaalsContact O-N 3.08Å; L374-K418 PolarHBondContact O-NZ 3.44Å
375	P	76.3	Confident	76.9	Confident	60 Å²	60	52.7 Å²	52.7	39%	0.39	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-65.9	150.6	169	31.3	-35.7	0	0	0	110.7	P468	P375-P468 HydrophobicContact CB-CB 4.21Å; P375-P468 HydrophobicContact CB-CG 3.47Å; P375-P468 VanDerWaalsContact CB-CG 3.47Å; P375-P468 HydrophobicContact CG-CG 3.96Å
376	P	79.7	Confident	76.9	Confident	20 Å²	20	50.9 Å²	50.9	13%	0.13	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-69.6	155.9	174.7	32.1	-33.4	0	0	0	110.7	N384 Q386 K418	P376-N384 PolarHBondContact O-ND2 2.86Å; P376-Q386 HydrophobicContact CB-CG 3.67Å; P376-Q386 HydrophobicContact CG-CG 3.85Å; P376-K418 HydrophobicContact CG-CB 4.38Å
377	P	79.1	Confident	76.9	Confident	66 Å²	66	52 Å²	52	43%	0.429	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-59	152.3	175.8	26.9	-35.5	0	0	0	111.3	S379 N384 Q386	P377-S379 PolarHBondContact O-N 3.37Å; P377-N384 PolarHBondContact O-OD1 2.87Å; P377-Q386 PolarHBondContact O-NE2 2.76Å
378	P	80.6	Confident	76.7	Confident	98 Å²	98	53.7 Å²	53.7	64%	0.636	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-59.7	126.6	-179.6	24.7	-33.7	0	0	0	111.2	N384	P378-N384 WeakPolarHBondContact CA-OD1 3.32Å
379	S	78.6	Confident	76.8	Confident	19 Å²	19	56.8 Å²	56.8	13%	0.133	31%	0.312	C	S	.	.			trans	-98.1	-17.7	178.6	58.5	0	0	0	0	114.6	P377 L381 N384 A385	P377-S379 PolarHBondContact O-N 3.37Å; S379-L381 PolarHBondContact O-N 3.04Å; S379-L381 PolarHBondContact OG-N 3.21Å; S379-N384 PolarHBondContact N-OD1 3.33Å; S379-N384 PolarHBondContact OG-OD1 3.48Å; S379-A385 VanDerWaalsContact CB-O 3.22Å; S379-A385 WeakPolarHBondContact CB-O 3.46Å; S379-A385 PolarHBondContact OG-O 3.34Å
380	G	78.1	Confident	76.6	Confident	61 Å²	61	58.5 Å²	58.5	63%	0.629	32%	0.318	S	S	*	.	S	Bend	trans	79.3	-6.4	-166.9	0	0	0	0	0	114.4
381	L	81.6	Confident	76.4	Confident	15 Å²	15	56.4 Å²	56.4	8%	0.079	31%	0.308	C	S	.	.	S	Bend	trans	-84.8	150.6	175.6	-63.1	178.3	0	0	0	111.5	S379 N384 A385 F408 T411 L412 A415	S379-L381 PolarHBondContact O-N 3.04Å; S379-L381 PolarHBondContact OG-N 3.21Å; L381-N384 VanDerWaalsContact O-CA 3.31Å; L381-N384 WeakPolarHBondContact O-CA 3.41Å; L381-N384 PolarHBondContact O-N 3.38Å; L381-A385 HydrophobicContact CB-CB 4.09Å; L381-F408 HydrophobicContact CD2-CD2 4.47Å; L381-F408 HydrophobicContact CD2-CE2 4.1Å; L381-T411 HydrophobicContact CD1-CG2 4.22Å; L381-L412 HydrophobicContact CB-CD2 4.48Å; L381-L412 HydrophobicContact CD2-CD2 4.14Å; L381-A415 HydrophobicContact CD1-CB 4.11Å
382	P	82.5	Confident	76.4	Confident	55 Å²	55	60.1 Å²	60.1	36%	0.357	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-52.2	143.7	176.2	20.9	-34.6	0	0	0	112.5	N384 A385 L412	P382-N384 PolarHBondContact O-N 3.29Å; P382-N384 VanDerWaalsContact O-N 3.08Å; P382-A385 WeakPolarHBondContact O-CB 3.31Å; P382-A385 PolarHBondContact O-N 2.98Å; P382-A385 VanDerWaalsContact O-N 3.11Å; P382-L412 HydrophobicContact CG-CD1 4.48Å; P382-L412 HydrophobicContact CG-CD2 3.54Å
383	F	84.4	Confident	76.4	Confident	50 Å²	50	59 Å²	59	22%	0.219	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	53.9	21.2	-172.8	-53.7	-69.7	0	0	0	114.4	A385 V417 H470 V471 R474 F497 W503	F383-A385 PolarHBondContact O-N 2.86Å; F383-V417 HydrophobicContact CB-CG1 4.09Å; F383-V417 HydrophobicContact CB-CG2 3.88Å; F383-H470 AromaticContact CE1-CD2 3.88Å; F383-H470 AromaticContact CE1-NE2 3.83Å; F383-V471 HydrophobicContact CB-CG2 4.07Å; F383-V471 HydrophobicContact CD1-CG2 4.48Å; F383-V471 WeakPolarHBondContact O-CG2 3.4Å; F383-R474 HydrophobicContact CE1-CG 4.34Å; F383-F497 HydrophobicContact CE2-CE2 4.21Å; F383-W503 HydrophobicContact CB-CH2 4.22Å; F383-W503 HydrophobicContact CB-CZ2 4.19Å; F383-W503 AromaticContact CD1-CH2 3.9Å; F383-W503 HydrophobicContact CD1-CH2 3.9Å; F383-W503 HydrophobicContact CD1-CZ2 4.13Å; F383-W503 HydrophobicContact CD2-CH2 4.33Å; F383-W503 AromaticContact CD2-CZ2 3.74Å; F383-W503 HydrophobicContact CD2-CZ2 3.74Å; F383-W503 HydrophobicContact CE1-CH2 4.36Å; F383-W503 HydrophobicContact CE1-CZ2 4.49Å; F383-W503 HydrophobicContact CE2-CZ2 4.12Å; F383-W503 AromaticContact CG-CH2 3.87Å; F383-W503 HydrophobicContact CG-CH2 3.87Å; F383-W503 AromaticContact CG-CZ2 3.74Å; F383-W503 HydrophobicContact CG-CZ2 3.74Å; F383-W503 HydrophobicContact CZ-CZ2 4.48Å
384	N	83.9	Confident	76.2	Confident	17 Å²	17	60.8 Å²	60.8	9%	0.091	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	54.5	37	-173	-166.1	21.6	0	0	0	113.3	P376 P377 P378 S379 L381 P382 Q386	P376-N384 PolarHBondContact O-ND2 2.86Å; P377-N384 PolarHBondContact O-OD1 2.87Å; P378-N384 WeakPolarHBondContact CA-OD1 3.32Å; S379-N384 PolarHBondContact N-OD1 3.33Å; S379-N384 PolarHBondContact OG-OD1 3.48Å; L381-N384 VanDerWaalsContact O-CA 3.31Å; L381-N384 WeakPolarHBondContact O-CA 3.41Å; L381-N384 PolarHBondContact O-N 3.38Å; P382-N384 PolarHBondContact O-N 3.29Å; P382-N384 VanDerWaalsContact O-N 3.08Å; N384-Q386 PolarHBondContact O-NE2 3.17Å; N384-Q386 PolarHBondContact OD1-NE2 3.18Å
385	A	86.5	Confident	75.6	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.346	C	S	.	.			trans	-57.9	140.5	176.8	0	0	0	0	0	111.2	S379 L381 P382 F383 A415 V417	S379-A385 VanDerWaalsContact CB-O 3.22Å; S379-A385 WeakPolarHBondContact CB-O 3.46Å; S379-A385 PolarHBondContact OG-O 3.34Å; L381-A385 HydrophobicContact CB-CB 4.09Å; P382-A385 WeakPolarHBondContact O-CB 3.31Å; P382-A385 PolarHBondContact O-N 2.98Å; P382-A385 VanDerWaalsContact O-N 3.11Å; F383-A385 PolarHBondContact O-N 2.86Å; A385-A415 HydrophobicContact CB-CB 3.92Å; A385-V417 HydrophobicContact CB-CG2 3.71Å
386	Q	84.2	Confident	75	Confident	2 Å²	2	61 Å²	61	1%	0.009	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-113.6	140.2	-175.5	-59.2	-65.1	-50.2	0	0	111.2	P376 P377 N384 L391 A415 I416	P376-Q386 HydrophobicContact CB-CG 3.67Å; P376-Q386 HydrophobicContact CG-CG 3.85Å; P377-Q386 PolarHBondContact O-NE2 2.76Å; N384-Q386 PolarHBondContact O-NE2 3.17Å; N384-Q386 PolarHBondContact OD1-NE2 3.18Å; Q386-L391 HydrophobicContact CB-CD1 3.82Å; Q386-L391 HydrophobicContact CB-CD2 4.29Å; Q386-L391 HydrophobicContact CB-CG 3.67Å; Q386-L391 HydrophobicContact CG-CD2 4.26Å; Q386-L391 HydrophobicContact CG-CG 4.18Å; Q386-A415 CarbonylContact O-C 3.59Å; Q386-A415 VanDerWaalsContact O-CA 3.32Å; Q386-A415 WeakPolarHBondContact O-CA 3.47Å; Q386-I416 PolarHBondContact N-O 2.99Å; Q386-I416 PolarHBondContact O-N 3.35Å
387	P	82.4	Confident	74	Confident	25 Å²	25	65.5 Å²	65.5	16%	0.162	36%	0.362	C	S	.	.			trans	-54.4	145.6	162.7	-24.6	34.9	0	0	0	111.4	E389 R390 L391 L399	P387-E389 PolarHBondContact O-N 3.34Å; P387-R390 PolarHBondContact O-N 2.87Å; P387-R390 VanDerWaalsContact O-N 3.11Å; P387-L391 PolarHBondContact O-N 2.66Å; P387-L399 HydrophobicContact CB-CD1 4.24Å; P387-L399 HydrophobicContact CG-CD1 4.16Å
388	R	75	Confident	73.1	Confident	129 Å²	129	67.7 Å²	67.7	49%	0.487	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-31.5	-172.1	-61.5	-179.7	69.1	97.5	-6.2	113.1	Q414 I416	R388-Q414 VanDerWaalsContact CG-O 3.29Å; R388-Q414 WeakPolarHBondContact CG-O 3.23Å; R388-I416 HydrophobicContact CG-CD1 3.92Å; R388-I416 HydrophobicContact CG-CG1 4.39Å
389	E	68.9	Low	72.2	Confident	127 Å²	127	67.8 Å²	67.8	59%	0.593	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-43.8	175.3	-70	119.3	-132.2	0	0	113.1	P387 L391 K392 N393	P387-E389 PolarHBondContact O-N 3.34Å; E389-L391 PolarHBondContact O-N 2.78Å; E389-K392 WeakPolarHBondContact O-CA 3.42Å; E389-K392 WeakPolarHBondContact O-CB 3.26Å; E389-K392 PolarHBondContact O-N 3.38Å; E389-N393 PolarHBondContact O-N 3.34Å
390	R	67.1	Low	71.3	Confident	47 Å²	47	71.4 Å²	71.4	18%	0.177	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-25	-179	-89.1	-172.4	157.9	-135	-17.1	113.7	P387 K392 N393 A396 P397	P387-R390 PolarHBondContact O-N 2.87Å; P387-R390 VanDerWaalsContact O-N 3.11Å; R390-K392 VanDerWaalsContact C-N 3.27Å; R390-K392 PolarHBondContact O-N 2.69Å; R390-N393 CarbonylContact O-C 3.45Å; R390-A396 HydrophobicContact CG-CB 3.96Å; R390-A396 PolarHBondContact NE-O 3.07Å; R390-A396 PolarHBondContact NH2-O 3.29Å; R390-P397 PolarHBondContact NE-O 3.1Å
391	L	65.5	Low	70.6	Confident	48 Å²	48	73.8 Å²	73.8	25%	0.251	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-11.8	170.9	-80.2	164.8	0	0	0	114.6	Q386 P387 E389 I416 K418	Q386-L391 HydrophobicContact CB-CD1 3.82Å; Q386-L391 HydrophobicContact CB-CD2 4.29Å; Q386-L391 HydrophobicContact CB-CG 3.67Å; Q386-L391 HydrophobicContact CG-CD2 4.26Å; Q386-L391 HydrophobicContact CG-CG 4.18Å; P387-L391 PolarHBondContact O-N 2.66Å; E389-L391 PolarHBondContact O-N 2.78Å; L391-I416 HydrophobicContact CD1-CB 3.51Å; L391-I416 HydrophobicContact CD1-CD1 4.02Å; L391-I416 HydrophobicContact CD1-CG1 4.34Å; L391-I416 HydrophobicContact CD1-CG2 3.74Å; L391-K418 HydrophobicContact CD2-CB 4.19Å; L391-K418 HydrophobicContact CD2-CD 4.31Å
392	K	65.7	Low	69.6	Low	193 Å²	193	75.4 Å²	75.4	84%	0.839	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-34.4	171.4	-70.6	-175.4	170.5	-172.3	0	112.5	E389 R390	E389-K392 WeakPolarHBondContact O-CA 3.42Å; E389-K392 WeakPolarHBondContact O-CB 3.26Å; E389-K392 PolarHBondContact O-N 3.38Å; R390-K392 VanDerWaalsContact C-N 3.27Å; R390-K392 PolarHBondContact O-N 2.69Å
393	N	63.1	Low	68.9	Low	84 Å²	84	81.9 Å²	81.9	45%	0.449	42%	0.424	S	S	.	.			trans	-135.3	102.2	-179.8	-178	2.7	0	0	0	110	E389 R390 N395 A396	E389-N393 PolarHBondContact O-N 3.34Å; R390-N393 CarbonylContact O-C 3.45Å; N393-N395 PolarHBondContact O-N 3.1Å; N393-N395 VanDerWaalsContact O-N 3.12Å; N393-N395 WeakPolarHBondContact OD1-CB 3.22Å; N393-N395 PolarHBondContact OD1-N 2.82Å; N393-A396 HydrophobicContact CB-CB 4.45Å; N393-A396 WeakPolarHBondContact O-CB 3.37Å; N393-A396 PolarHBondContact O-N 2.87Å
394	P	63	Low	68.6	Low	65 Å²	65	84.4 Å²	84.4	42%	0.422	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.2	177.8	-26.4	35.6	0	0	0	114.2	A396	P394-A396 VanDerWaalsContact C-N 3.33Å
395	N	60.7	Low	68.3	Low	145 Å²	145	91.1 Å²	91.1	78%	0.775	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	1.5	179.7	-62.4	-30.6	0	0	0	113.6	N393	N393-N395 PolarHBondContact O-N 3.1Å; N393-N395 VanDerWaalsContact O-N 3.12Å; N393-N395 WeakPolarHBondContact OD1-CB 3.22Å; N393-N395 PolarHBondContact OD1-N 2.82Å
396	A	63.7	Low	68	Low	14 Å²	14	99 Å²	99	12%	0.116	51%	0.505	C	S	.	.	S	Bend	trans	-60.7	143.1	174	0	0	0	0	0	110.4	R390 N393 P394	R390-A396 HydrophobicContact CG-CB 3.96Å; R390-A396 PolarHBondContact NE-O 3.07Å; R390-A396 PolarHBondContact NH2-O 3.29Å; N393-A396 HydrophobicContact CB-CB 4.45Å; N393-A396 WeakPolarHBondContact O-CB 3.37Å; N393-A396 PolarHBondContact O-N 2.87Å; P394-A396 VanDerWaalsContact C-N 3.33Å
397	P	58.9	Low	67.7	Low	115 Å²	115	101.9 Å²	101.9	75%	0.747	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-50.4	154.6	177.4	-28.3	35.6	0	0	0	112.9	R390 L399	R390-P397 PolarHBondContact NE-O 3.1Å; P397-L399 PolarHBondContact O-N 2.66Å
398	M	59.9	Low	67.6	Low	113 Å²	113	104.5 Å²	104.5	56%	0.557	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-72.2	127	161	-71.2	-163.4	69	0	0	107.8
399	L	62.2	Low	68	Low	100 Å²	100	102.5 Å²	102.5	52%	0.524	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-56.7	139.2	158.9	-68.9	169.8	0	0	0	107.5	P387 P397	P387-L399 HydrophobicContact CB-CD1 4.24Å; P387-L399 HydrophobicContact CG-CD1 4.16Å; P397-L399 PolarHBondContact O-N 2.66Å
400	P	60.6	Low	68.7	Low	95 Å²	95	102.5 Å²	102.5	62%	0.617	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-59.3	152.2	176.1	26.7	-34.6	0	0	0	110
401	P	62.4	Low	69.4	Low	111 Å²	111	102.2 Å²	102.2	72%	0.721	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-55.5	130.9	173.8	24.2	-33.3	0	0	0	109.3	K403	P401-K403 PolarHBondContact O-N 3.06Å
402	P	62	Low	70.3	Confident	48 Å²	48	101.2 Å²	101.2	31%	0.312	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-63.6	127.7	-175.8	23.6	-31.8	0	0	0	110	D407 F408	P402-D407 HydrophobicContact CB-CB 3.81Å; P402-F408 HydrophobicContact CB-CB 4.13Å; P402-F408 HydrophobicContact CG-CB 3.76Å; P402-F408 HydrophobicContact CG-CD2 3.74Å; P402-F408 HydrophobicContact CG-CG 4.25Å
403	K	67.7	Low	71.3	Confident	191 Å²	191	93.4 Å²	93.4	83%	0.83	49%	0.491	S	S	*	.	S	Bend	trans	-77.3	-29.5	-173.5	-60.6	179.6	-177.2	177.1	0	112.8	P401	P401-K403 PolarHBondContact O-N 3.06Å
404	N	76.5	Confident	72.4	Confident	104 Å²	104	94.7 Å²	94.7	56%	0.556	50%	0.495	S	S	*	.	S	Bend	trans	-115.7	153.9	-178.2	-56.6	-43	0	0	0	111.2	E406 D407 F408	N404-E406 VanDerWaalsContact C-N 3.3Å; N404-E406 PolarHBondContact O-N 2.82Å; N404-D407 WeakPolarHBondContact CB-OD2 3.46Å; N404-D407 PolarHBondContact ND2-OD2 2.75Å; N404-D407 PolarHBondContact O-N 3.03Å; N404-F408 PolarHBondContact O-N 3.19Å; N404-F408 VanDerWaalsContact O-N 3.08Å
405	K	79.4	Confident	73.6	Confident	157 Å²	157	91.6 Å²	91.6	68%	0.683	48%	0.475	S	S	*	.	H	α-helix	trans	-58.5	-39.8	176.4	-176.3	176.2	174.6	180	0	112.8	F408 E409	K405-F408 WeakPolarHBondContact O-CB 3.41Å; K405-F408 PolarHBondContact O-N 2.78Å; K405-E409 WeakPolarHBondContact CE-OE1 3.49Å; K405-E409 PolarHBondContact O-N 3.13Å
406	E	80	Confident	75	Confident	166 Å²	166	84.9 Å²	84.9	78%	0.776	44%	0.439	S	S	*	.	H	α-helix	trans	-65	-41.2	178.4	-63.1	-178.5	-176.8	0	0	112.1	N404 F408 E409 K410	N404-E406 VanDerWaalsContact C-N 3.3Å; N404-E406 PolarHBondContact O-N 2.82Å; E406-F408 VanDerWaalsContact C-N 3.32Å; E406-F408 PolarHBondContact O-N 3.23Å; E406-E409 PolarHBondContact O-N 3.41Å; E406-K410 WeakPolarHBondContact O-CB 3.44Å; E406-K410 PolarHBondContact O-N 2.62Å
407	D	78.1	Confident	76.3	Confident	63 Å²	63	84.3 Å²	84.3	34%	0.337	43%	0.434	S	S	.	.	H	α-helix	trans	-64.6	-36.9	174.9	-67	-50.1	0	0	0	111.7	P402 N404 T411	P402-D407 HydrophobicContact CB-CB 3.81Å; N404-D407 WeakPolarHBondContact CB-OD2 3.46Å; N404-D407 PolarHBondContact ND2-OD2 2.75Å; N404-D407 PolarHBondContact O-N 3.03Å; D407-T411 WeakPolarHBondContact O-CB 3.46Å; D407-T411 PolarHBondContact O-N 3.46Å; D407-T411 PolarHBondContact O-OG1 2.76Å
408	F	79.9	Confident	77.7	Confident	80 Å²	80	81.2 Å²	81.2	35%	0.351	41%	0.409	S	S	.	.	H	α-helix	trans	-65	-50.1	174.1	179.1	-108.4	0	0	0	111.5	L381 P402 N404 K405 E406 K410 T411 L412	L381-F408 HydrophobicContact CD2-CD2 4.47Å; L381-F408 HydrophobicContact CD2-CE2 4.1Å; P402-F408 HydrophobicContact CB-CB 4.13Å; P402-F408 HydrophobicContact CG-CB 3.76Å; P402-F408 HydrophobicContact CG-CD2 3.74Å; P402-F408 HydrophobicContact CG-CG 4.25Å; N404-F408 PolarHBondContact O-N 3.19Å; N404-F408 VanDerWaalsContact O-N 3.08Å; K405-F408 WeakPolarHBondContact O-CB 3.41Å; K405-F408 PolarHBondContact O-N 2.78Å; E406-F408 VanDerWaalsContact C-N 3.32Å; E406-F408 PolarHBondContact O-N 3.23Å; F408-K410 PolarHBondContact O-N 2.85Å; F408-T411 PolarHBondContact O-N 2.75Å; F408-L412 HydrophobicContact CD1-CD1 3.85Å; F408-L412 HydrophobicContact CD1-CG 4.46Å; F408-L412 HydrophobicContact CE1-CD1 3.46Å; F408-L412 VanDerWaalsContact CE1-CD1 3.46Å; F408-L412 HydrophobicContact CE1-CG 4.29Å; F408-L412 HydrophobicContact CE2-CD1 4.31Å; F408-L412 HydrophobicContact CE2-CD2 4.48Å; F408-L412 HydrophobicContact CE2-CG 4.35Å; F408-L412 HydrophobicContact CG-CD1 4.45Å; F408-L412 HydrophobicContact CZ-CD1 3.72Å; F408-L412 HydrophobicContact CZ-CD2 4.44Å; F408-L412 HydrophobicContact CZ-CG 4.24Å; F408-L412 WeakPolarHBondContact O-CB 3.45Å; F408-L412 WeakPolarHBondContact O-CG 3.3Å; F408-L412 PolarHBondContact O-N 2.97Å
409	E	82.1	Confident	79.2	Confident	86 Å²	86	76.1 Å²	76.1	40%	0.402	38%	0.384	S	S	.	.	H	α-helix	trans	-62.4	-42.5	177.1	-72.1	-174.3	-150	0	0	112.2	K405 E406 L412 S413	K405-E409 WeakPolarHBondContact CE-OE1 3.49Å; K405-E409 PolarHBondContact O-N 3.13Å; E406-E409 PolarHBondContact O-N 3.41Å; E409-L412 PolarHBondContact O-N 2.93Å; E409-S413 WeakPolarHBondContact O-CB 3.37Å; E409-S413 PolarHBondContact O-N 3.37Å
410	K	84	Confident	80.5	Confident	128 Å²	128	72 Å²	72	56%	0.557	36%	0.363	S	S	*	.	H	α-helix	trans	-59.2	-46.7	173.9	-172.7	176.4	-178.6	-179.4	0	111.2	E406 F408 S413 Q414	E406-K410 WeakPolarHBondContact O-CB 3.44Å; E406-K410 PolarHBondContact O-N 2.62Å; F408-K410 PolarHBondContact O-N 2.85Å; K410-S413 PolarHBondContact O-N 3.41Å; K410-S413 PolarHBondContact O-OG 2.98Å; K410-Q414 WeakPolarHBondContact O-CG 3.26Å; K410-Q414 PolarHBondContact O-N 3.32Å
411	T	82.1	Confident	81.8	Confident	41 Å²	41	70.3 Å²	70.3	25%	0.252	35%	0.348	S	S	.	.	H	α-helix	trans	-62.8	-48.8	176.7	-61	0	0	0	0	111.6	L381 D407 F408 S413 Q414 A415	L381-T411 HydrophobicContact CD1-CG2 4.22Å; D407-T411 WeakPolarHBondContact O-CB 3.46Å; D407-T411 PolarHBondContact O-N 3.46Å; D407-T411 PolarHBondContact O-OG1 2.76Å; F408-T411 PolarHBondContact O-N 2.75Å; T411-S413 VanDerWaalsContact C-N 3.28Å; T411-S413 PolarHBondContact O-N 3.13Å; T411-Q414 PolarHBondContact O-N 2.88Å; T411-Q414 VanDerWaalsContact O-N 3.13Å; T411-A415 WeakPolarHBondContact O-CB 3.47Å; T411-A415 PolarHBondContact O-N 2.67Å
412	L	84.7	Confident	83	Confident	26 Å²	26	65.7 Å²	65.7	14%	0.136	32%	0.318	C	S	.	.	H	α-helix	trans	-56.3	-42.5	175.6	-75.2	-178.9	0	0	0	111.9	L381 P382 F408 E409 Q414 A415 S501	L381-L412 HydrophobicContact CB-CD2 4.48Å; L381-L412 HydrophobicContact CD2-CD2 4.14Å; P382-L412 HydrophobicContact CG-CD1 4.48Å; P382-L412 HydrophobicContact CG-CD2 3.54Å; F408-L412 HydrophobicContact CD1-CD1 3.85Å; F408-L412 HydrophobicContact CD1-CG 4.46Å; F408-L412 HydrophobicContact CE1-CD1 3.46Å; F408-L412 VanDerWaalsContact CE1-CD1 3.46Å; F408-L412 HydrophobicContact CE1-CG 4.29Å; F408-L412 HydrophobicContact CE2-CD1 4.31Å; F408-L412 HydrophobicContact CE2-CD2 4.48Å; F408-L412 HydrophobicContact CE2-CG 4.35Å; F408-L412 HydrophobicContact CG-CD1 4.45Å; F408-L412 HydrophobicContact CZ-CD1 3.72Å; F408-L412 HydrophobicContact CZ-CD2 4.44Å; F408-L412 HydrophobicContact CZ-CG 4.24Å; F408-L412 WeakPolarHBondContact O-CB 3.45Å; F408-L412 WeakPolarHBondContact O-CG 3.3Å; F408-L412 PolarHBondContact O-N 2.97Å; E409-L412 PolarHBondContact O-N 2.93Å; L412-Q414 PolarHBondContact O-N 2.65Å; L412-A415 PolarHBondContact O-N 2.88Å; L412-S501 WeakPolarHBondContact O-CA 3.5Å; L412-S501 WeakPolarHBondContact O-CB 3.49Å; L412-S501 PolarHBondContact O-N 2.79Å; L412-S501 PolarHBondContact O-OG 2.8Å
413	S	86.9	Confident	83.9	Confident	29 Å²	29	69.7 Å²	69.7	20%	0.203	34%	0.342	C	S	.	.	H	α-helix	trans	-65.7	-18.4	-178.6	84.1	0	0	0	0	114.1	E409 K410 T411 R495 N499	E409-S413 WeakPolarHBondContact O-CB 3.37Å; E409-S413 PolarHBondContact O-N 3.37Å; K410-S413 PolarHBondContact O-N 3.41Å; K410-S413 PolarHBondContact O-OG 2.98Å; T411-S413 VanDerWaalsContact C-N 3.28Å; T411-S413 PolarHBondContact O-N 3.13Å; S413-R495 VanDerWaalsContact O-CZ 3.26Å; S413-R495 PolarHBondContact O-NH1 2.84Å; S413-R495 VanDerWaalsContact O-NH1 3.11Å; S413-R495 PolarHBondContact O-NH2 3.31Å; S413-N499 WeakPolarHBondContact CA-O 3.33Å; S413-N499 VanDerWaalsContact CB-O 3.23Å; S413-N499 WeakPolarHBondContact CB-O 3Å
414	Q	85.8	Confident	84.7	Confident	111 Å²	111	66.5 Å²	66.5	52%	0.519	33%	0.33	S	S	.	.	H	α-helix	trans	-105	-23.1	179.1	-62.7	-176.9	15.7	0	0	113	R388 K410 T411 L412	R388-Q414 VanDerWaalsContact CG-O 3.29Å; R388-Q414 WeakPolarHBondContact CG-O 3.23Å; K410-Q414 WeakPolarHBondContact O-CG 3.26Å; K410-Q414 PolarHBondContact O-N 3.32Å; T411-Q414 PolarHBondContact O-N 2.88Å; T411-Q414 VanDerWaalsContact O-N 3.13Å; L412-Q414 PolarHBondContact O-N 2.65Å
415	A	88	Confident	85.1	Confident	1 Å²	1	71.5 Å²	71.5	1%	0.008	34%	0.341	C	S	.	.			trans	-64.9	158.7	178.6	0	0	0	0	0	113.1	L381 A385 Q386 T411 L412 S501 F502	L381-A415 HydrophobicContact CD1-CB 4.11Å; A385-A415 HydrophobicContact CB-CB 3.92Å; Q386-A415 CarbonylContact O-C 3.59Å; Q386-A415 VanDerWaalsContact O-CA 3.32Å; Q386-A415 WeakPolarHBondContact O-CA 3.47Å; T411-A415 WeakPolarHBondContact O-CB 3.47Å; T411-A415 PolarHBondContact O-N 2.67Å; L412-A415 PolarHBondContact O-N 2.88Å; A415-S501 WeakPolarHBondContact O-CB 3.43Å; A415-F502 PolarHBondContact O-N 3.41Å
416	I	89.3	Confident	85.6	Confident	4 Å²	4	70.7 Å²	70.7	2%	0.021	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	125.8	-177.9	-61.7	164.4	0	0	0	110.6	Q386 R388 L391 F502 R504	Q386-I416 PolarHBondContact N-O 2.99Å; Q386-I416 PolarHBondContact O-N 3.35Å; R388-I416 HydrophobicContact CG-CD1 3.92Å; R388-I416 HydrophobicContact CG-CG1 4.39Å; L391-I416 HydrophobicContact CD1-CB 3.51Å; L391-I416 HydrophobicContact CD1-CD1 4.02Å; L391-I416 HydrophobicContact CD1-CG1 4.34Å; L391-I416 HydrophobicContact CD1-CG2 3.74Å; I416-F502 CarbonylContact C-O 3.5Å; I416-F502 WeakPolarHBondContact CA-O 3.49Å; I416-F502 HydrophobicContact CG1-CB 4.11Å; I416-R504 HydrophobicContact CG2-CB 4.03Å
417	V	90.9	Very high	86.2	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.012	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	108	169.4	177.7	0	0	0	0	108.9	F383 A385 V419 V471 F502 W503 R504	F383-V417 HydrophobicContact CB-CG1 4.09Å; F383-V417 HydrophobicContact CB-CG2 3.88Å; A385-V417 HydrophobicContact CB-CG2 3.71Å; V417-V419 PolarHBondContact O-N 3.32Å; V417-V471 HydrophobicContact CG1-CG1 3.54Å; V417-F502 PolarHBondContact N-O 2.99Å; V417-W503 HydrophobicContact CB-CD2 4.08Å; V417-W503 HydrophobicContact CB-CE3 4.35Å; V417-W503 HydrophobicContact CB-CG 4.31Å; V417-W503 HydrophobicContact CG1-CD2 4.01Å; V417-W503 HydrophobicContact CG1-CE3 3.8Å; V417-W503 HydrophobicContact CG1-CH2 4.21Å; V417-W503 HydrophobicContact CG1-CZ2 4.39Å; V417-W503 HydrophobicContact CG1-CZ3 3.91Å; V417-W503 HydrophobicContact CG2-CD2 4.49Å; V417-R504 PolarHBondContact O-N 2.7Å
418	K	89.8	Confident	86.8	Confident	50 Å²	50	63 Å²	63	22%	0.217	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	104.8	173.8	-178.6	-168.9	175.1	-168.2	0	109.5	E371 H372 L374 P376 L391 V420	E371-K418 PolarHBondContact O-NZ 3.02Å; H372-K418 VanDerWaalsContact O-CE 3.22Å; H372-K418 WeakPolarHBondContact O-CE 3.34Å; H372-K418 PolarHBondContact O-NZ 3.48Å; L374-K418 PolarHBondContact O-NZ 3.44Å; P376-K418 HydrophobicContact CG-CB 4.38Å; L391-K418 HydrophobicContact CD2-CB 4.19Å; L391-K418 HydrophobicContact CD2-CD 4.31Å; K418-V420 HydrophobicContact CD-CG2 4.24Å; K418-V420 HydrophobicContact CG-CG2 4.21Å; K418-V420 PolarHBondContact O-N 2.81Å
419	V	91.1	Very high	87.4	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.03	31%	0.312	C	S	.	.			trans	-76.3	125.5	176.8	-175.1	0	0	0	0	110.2	V417 V471 Y472 W475 W503 R504 P506	V417-V419 PolarHBondContact O-N 3.32Å; V419-V471 HydrophobicContact CB-CG1 4.46Å; V419-V471 HydrophobicContact CG1-CG1 4.5Å; V419-V471 HydrophobicContact CG2-CG1 4.05Å; V419-Y472 HydrophobicContact CG1-CD2 4.17Å; V419-W475 HydrophobicContact CB-CG 4.31Å; V419-W475 HydrophobicContact CG1-CB 3.91Å; V419-W475 HydrophobicContact CG1-CD2 3.82Å; V419-W475 HydrophobicContact CG1-CE3 3.78Å; V419-W475 HydrophobicContact CG1-CG 3.84Å; V419-W475 HydrophobicContact CG2-CB 3.84Å; V419-W475 HydrophobicContact CG2-CD2 4.47Å; V419-W475 HydrophobicContact CG2-CG 3.78Å; V419-W503 HydrophobicContact CG2-CE3 3.7Å; V419-W503 HydrophobicContact CG2-CZ3 4.21Å; V419-R504 VanDerWaalsContact CB-O 3.29Å; V419-R504 WeakPolarHBondContact CB-O 3.35Å; V419-R504 WeakPolarHBondContact CG2-O 3.38Å; V419-R504 PolarHBondContact N-O 3.38Å; V419-P506 HydrophobicContact CG1-CG 4.35Å
420	V	88.6	Confident	88	Confident	14 Å²	14	59.6 Å²	59.6	9%	0.085	30%	0.303	C	S	.	.			trans	-118.5	136.9	-179.6	173.1	0	0	0	0	109.6	T373 K418 P422	T373-V420 WeakPolarHBondContact O-CG1 3.41Å; K418-V420 HydrophobicContact CD-CG2 4.24Å; K418-V420 HydrophobicContact CG-CG2 4.21Å; K418-V420 PolarHBondContact O-N 2.81Å; V420-P422 WeakPolarHBondContact O-CD 3.45Å
421	I	88.4	Confident	88.5	Confident	59 Å²	59	53.5 Å²	53.5	30%	0.303	28%	0.277	S	S	.	.			trans	-77.7	125.2	177.9	-50.1	-176	0	0	0	109.2	T423 L428 Y472 W489 P506	I421-T423 PolarHBondContact O-N 3.4Å; I421-L428 HydrophobicContact CG2-CD1 3.9Å; I421-L428 HydrophobicContact CG2-CD2 4.16Å; I421-Y472 HydrophobicContact CB-CD2 4.47Å; I421-Y472 HydrophobicContact CB-CE2 4.21Å; I421-Y472 HydrophobicContact CG1-CD2 4.36Å; I421-Y472 HydrophobicContact CG1-CE2 3.92Å; I421-Y472 HydrophobicContact CG2-CE2 4.02Å; I421-W489 HydrophobicContact CD1-CZ2 4.48Å; I421-P506 HydrophobicContact CD1-CB 4Å; I421-P506 HydrophobicContact CD1-CG 4.21Å; I421-P506 HydrophobicContact CG1-CB 3.64Å; I421-P506 HydrophobicContact CG1-CG 3.9Å
422	P	87.6	Confident	89.1	Confident	15 Å²	15	55.3 Å²	55.3	10%	0.097	28%	0.282	C	S	.	.			trans	-54.9	126.5	175.2	-29.1	36.1	0	0	0	112.7	V420 E424 L427 I431 A469 Y472	V420-P422 WeakPolarHBondContact O-CD 3.45Å; P422-E424 VanDerWaalsContact C-N 3.31Å; P422-L427 HydrophobicContact CB-CD2 4.47Å; P422-I431 HydrophobicContact CG-CD1 4.1Å; P422-A469 HydrophobicContact CG-CB 4.48Å; P422-Y472 HydrophobicContact CG-CD1 4.04Å; P422-Y472 HydrophobicContact CG-CG 4.1Å
423	T	80.7	Confident	89.5	Confident	131 Å²	131	62 Å²	62	80%	0.804	31%	0.306	S	S	*	.	S	Bend	trans	-71.5	-26.6	179.5	51.3	0	0	0	0	112.7	I421 R425	I421-T423 PolarHBondContact O-N 3.4Å; T423-R425 PolarHBondContact O-N 2.9Å; T423-R425 VanDerWaalsContact O-N 3.17Å
424	E	85.3	Confident	89.9	Confident	125 Å²	125	61 Å²	61	58%	0.584	30%	0.298	S	S	*	.			trans	-72.2	104.1	176.2	-77.2	-167.4	-147.8	0	0	112.1	P422 N426 L427 L428	P422-E424 VanDerWaalsContact C-N 3.31Å; E424-N426 PolarHBondContact O-N 2.7Å; E424-N426 VanDerWaalsContact O-N 3.12Å; E424-L427 HydrophobicContact CB-CB 3.84Å; E424-L427 PolarHBondContact O-N 3.04Å; E424-L427 VanDerWaalsContact O-N 3.16Å; E424-L428 WeakPolarHBondContact O-CB 3.13Å; E424-L428 PolarHBondContact O-N 2.8Å
425	R	84.8	Confident	90.4	Very high	209 Å²	209	55.9 Å²	55.9	79%	0.789	27%	0.274	S	S	*	.	H	α-helix	trans	-54.5	-32.9	179.9	-171.6	176.1	-174.6	143.3	5.8	114.4	T423 A429	T423-R425 PolarHBondContact O-N 2.9Å; T423-R425 VanDerWaalsContact O-N 3.17Å; R425-A429 WeakPolarHBondContact O-CB 3.4Å; R425-A429 PolarHBondContact O-N 3.34Å; R425-A429 VanDerWaalsContact O-N 3.12Å
426	N	90.5	Very high	90.6	Very high	140 Å²	140	61.8 Å²	61.8	75%	0.749	30%	0.302	S	S	*	.	H	α-helix	trans	-72.5	-47.1	179.5	-66.2	-24.1	0	0	0	111.3	E424 A429 L430	E424-N426 PolarHBondContact O-N 2.7Å; E424-N426 VanDerWaalsContact O-N 3.12Å; N426-A429 PolarHBondContact O-N 3.37Å; N426-L430 PolarHBondContact O-N 3.38Å
427	L	91.6	Very high	90.9	Very high	40 Å²	40	65.4 Å²	65.4	21%	0.209	32%	0.317	C	S	.	.	H	α-helix	trans	-62.3	-45	175.1	178.3	59.5	0	0	0	111.1	P422 E424 A429 L430 I431 F461 A469	P422-L427 HydrophobicContact CB-CD2 4.47Å; E424-L427 HydrophobicContact CB-CB 3.84Å; E424-L427 PolarHBondContact O-N 3.04Å; E424-L427 VanDerWaalsContact O-N 3.16Å; L427-A429 VanDerWaalsContact C-N 3.34Å; L427-A429 PolarHBondContact O-N 2.91Å; L427-L430 WeakPolarHBondContact O-CB 3.45Å; L427-L430 PolarHBondContact O-N 3.26Å; L427-L430 VanDerWaalsContact O-N 3.14Å; L427-I431 HydrophobicContact CD1-CD1 4.02Å; L427-I431 HydrophobicContact CD1-CG1 4.28Å; L427-I431 HydrophobicContact CG-CD1 3.89Å; L427-I431 VanDerWaalsContact O-CG1 3.32Å; L427-I431 WeakPolarHBondContact O-CG1 3.38Å; L427-I431 PolarHBondContact O-N 2.94Å; L427-F461 HydrophobicContact CD1-CD1 3.78Å; L427-F461 HydrophobicContact CD1-CE1 4.39Å; L427-F461 HydrophobicContact CD1-CG 4.47Å; L427-A469 HydrophobicContact CD2-CB 3.99Å
428	L	90.9	Very high	91.1	Very high	26 Å²	26	65.9 Å²	65.9	14%	0.136	32%	0.32	C	S	.	.	H	α-helix	trans	-58.3	-44.1	176.4	-174.9	64.6	0	0	0	112.1	I421 E424 I431 H432 Y472	I421-L428 HydrophobicContact CG2-CD1 3.9Å; I421-L428 HydrophobicContact CG2-CD2 4.16Å; E424-L428 WeakPolarHBondContact O-CB 3.13Å; E424-L428 PolarHBondContact O-N 2.8Å; L428-I431 PolarHBondContact O-N 3.06Å; L428-H432 WeakPolarHBondContact CD1-NE2 3.48Å; L428-H432 PolarHBondContact O-CD2 3.31Å; L428-H432 VanDerWaalsContact O-CG 3.27Å; L428-H432 PolarHBondContact O-N 2.85Å; L428-Y472 HydrophobicContact CD1-CD1 4.22Å; L428-Y472 HydrophobicContact CD1-CE1 3.46Å; L428-Y472 VanDerWaalsContact CD1-CE1 3.46Å
429	A	92.2	Very high	91.3	Very high	53 Å²	53	66.6 Å²	66.6	44%	0.438	33%	0.328	S	S	.	.	H	α-helix	trans	-69.4	-30.2	176.8	0	0	0	0	0	113.3	R425 N426 L427 R433	R425-A429 WeakPolarHBondContact O-CB 3.4Å; R425-A429 PolarHBondContact O-N 3.34Å; R425-A429 VanDerWaalsContact O-N 3.12Å; N426-A429 PolarHBondContact O-N 3.37Å; L427-A429 VanDerWaalsContact C-N 3.34Å; L427-A429 PolarHBondContact O-N 2.91Å; A429-R433 PolarHBondContact O-N 2.94Å
430	L	94.6	Very high	91.4	Very high	43 Å²	43	72.1 Å²	72.1	23%	0.225	35%	0.349	C	S	.	.	H	α-helix	trans	-69.4	-46	172.4	-179.2	60.8	0	0	0	111.1	N426 L427 H432 R433 M434 M458 F459 F461	N426-L430 PolarHBondContact O-N 3.38Å; L427-L430 WeakPolarHBondContact O-CB 3.45Å; L427-L430 PolarHBondContact O-N 3.26Å; L427-L430 VanDerWaalsContact O-N 3.14Å; L430-H432 PolarHBondContact O-N 2.67Å; L430-R433 PolarHBondContact O-N 3.45Å; L430-M434 PolarHBondContact O-N 3.4Å; L430-M458 HydrophobicContact CD2-CB 3.83Å; L430-M458 VanDerWaalsContact CD2-O 3.28Å; L430-M458 WeakPolarHBondContact CD2-O 3.45Å; L430-F459 HydrophobicContact CD1-CE1 4.01Å; L430-F459 HydrophobicContact CD1-CZ 3.92Å; L430-F459 HydrophobicContact CD2-CE1 4.34Å; L430-F459 HydrophobicContact CD2-CZ 4.39Å; L430-F459 HydrophobicContact CG-CE1 4.37Å; L430-F461 HydrophobicContact CD2-CE1 4.22Å; L430-F461 HydrophobicContact CG-CE1 4.32Å
431	I	94.7	Very high	91.6	Very high	0 Å²	0	74.2 Å²	74.2	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-59.5	-45.6	175.8	-69.1	165.9	0	0	0	110.8	P422 L427 L428 R433 M434 I435 F461 A469 Y472 Y473	P422-I431 HydrophobicContact CG-CD1 4.1Å; L427-I431 HydrophobicContact CD1-CD1 4.02Å; L427-I431 HydrophobicContact CD1-CG1 4.28Å; L427-I431 HydrophobicContact CG-CD1 3.89Å; L427-I431 VanDerWaalsContact O-CG1 3.32Å; L427-I431 WeakPolarHBondContact O-CG1 3.38Å; L427-I431 PolarHBondContact O-N 2.94Å; L428-I431 PolarHBondContact O-N 3.06Å; I431-R433 VanDerWaalsContact C-N 3.32Å; I431-R433 PolarHBondContact O-N 3.45Å; I431-M434 WeakPolarHBondContact O-CB 3.37Å; I431-M434 PolarHBondContact O-N 3.17Å; I431-I435 HydrophobicContact CG2-CD1 3.88Å; I431-I435 WeakPolarHBondContact O-CG1 3.45Å; I431-I435 PolarHBondContact O-N 3.49Å; I431-F461 HydrophobicContact CD1-CD2 4.4Å; I431-F461 HydrophobicContact CD1-CG 4.34Å; I431-F461 HydrophobicContact CG1-CD1 4.1Å; I431-F461 HydrophobicContact CG1-CD2 3.91Å; I431-F461 HydrophobicContact CG1-CE1 3.97Å; I431-F461 HydrophobicContact CG1-CE2 3.79Å; I431-F461 HydrophobicContact CG1-CG 4.08Å; I431-F461 HydrophobicContact CG1-CZ 3.83Å; I431-A469 HydrophobicContact CD1-CB 4.22Å; I431-Y472 HydrophobicContact CD1-CD1 4.47Å; I431-Y472 HydrophobicContact CG2-CD1 3.98Å; I431-Y472 HydrophobicContact CG2-CE1 4.12Å; I431-Y473 HydrophobicContact CG2-CD2 4.09Å
432	H	94.1	Very high	91.7	Very high	79 Å²	79	72.5 Å²	72.5	37%	0.366	35%	0.354	S	S	.	.	H	α-helix	trans	-61.2	-39.3	177.7	-70.2	176.2	0	0	0	112.5	L428 L430 E436 Y472	L428-H432 WeakPolarHBondContact CD1-NE2 3.48Å; L428-H432 PolarHBondContact O-CD2 3.31Å; L428-H432 VanDerWaalsContact O-CG 3.27Å; L428-H432 PolarHBondContact O-N 2.85Å; L430-H432 PolarHBondContact O-N 2.67Å; H432-E436 WeakPolarHBondContact O-CB 3.24Å; H432-E436 PolarHBondContact O-N 2.89Å; H432-Y472 AromaticContact NE2-CE1 3.7Å; H432-Y472 AromaticContact NE2-CZ 3.76Å; H432-Y472 PolarHBondContact NE2-OH 3.1Å
433	R	94.6	Very high	91.9	Very high	167 Å²	167	76.2 Å²	76.2	63%	0.63	38%	0.379	S	S	*	.	H	α-helix	trans	-67.4	-42.6	172	-80.9	-177	166.9	-172.7	-4	112.6	A429 L430 I431 I435 E436 F437	A429-R433 PolarHBondContact O-N 2.94Å; L430-R433 PolarHBondContact O-N 3.45Å; I431-R433 VanDerWaalsContact C-N 3.32Å; I431-R433 PolarHBondContact O-N 3.45Å; R433-I435 PolarHBondContact O-N 2.86Å; R433-E436 WeakPolarHBondContact O-CB 3.45Å; R433-E436 PolarHBondContact O-N 3.37Å; R433-E436 VanDerWaalsContact O-N 3.11Å; R433-F437 VanDerWaalsContact O-CD2 3.26Å; R433-F437 WeakPolarHBondContact O-CD2 3.27Å; R433-F437 PolarHBondContact O-N 2.66Å
434	M	94.8	Very high	92.3	Very high	7 Å²	7	73.3 Å²	73.3	3%	0.034	36%	0.356	C	S	.	.	H	α-helix	trans	-55.2	-46.1	177.5	-171.3	63.3	-168.6	0	0	110.4	L430 I431 F437 V438 F445 E446 I449 F461 L462 Y473	L430-M434 PolarHBondContact O-N 3.4Å; I431-M434 WeakPolarHBondContact O-CB 3.37Å; I431-M434 PolarHBondContact O-N 3.17Å; M434-F437 PolarHBondContact O-N 2.82Å; M434-V438 HydrophobicContact CE-CG2 3.79Å; M434-V438 HydrophobicContact CG-CG2 4.48Å; M434-V438 WeakPolarHBondContact O-CG2 3.45Å; M434-V438 PolarHBondContact O-N 2.84Å; M434-F445 HydrophobicContact CE-CD1 4.09Å; M434-F445 HydrophobicContact CE-CE1 4.03Å; M434-F445 HydrophobicContact SD-CD1 4.48Å; M434-F445 HydrophobicContact SD-CE1 3.87Å; M434-E446 HydrophobicContact CE-CB 4.27Å; M434-E446 HydrophobicContact CE-CG 4.11Å; M434-I449 HydrophobicContact CE-CB 3.76Å; M434-I449 HydrophobicContact CE-CG1 4.05Å; M434-I449 HydrophobicContact CE-CG2 3.89Å; M434-I449 HydrophobicContact SD-CB 4.35Å; M434-I449 HydrophobicContact SD-CG1 4.31Å; M434-I449 HydrophobicContact SD-CG2 4.01Å; M434-F461 HydrophobicContact CB-CZ 4.17Å; M434-F461 HydrophobicContact CG-CE2 4.46Å; M434-F461 HydrophobicContact CG-CZ 4.19Å; M434-L462 HydrophobicContact CE-CD1 4.03Å; M434-L462 HydrophobicContact CE-CD2 4.23Å; M434-L462 HydrophobicContact CG-CD2 4.32Å; M434-Y473 HydrophobicContact CB-CE2 4.28Å; M434-Y473 HydrophobicContact CG-CE2 3.82Å
435	I	95.3	Very high	92.7	Very high	3 Å²	3	69 Å²	69	2%	0.015	34%	0.336	C	S	.	.	H	α-helix	trans	-64.7	-42.8	176	-61.7	165.4	0	0	0	111.7	I431 R433 F437 V438 V439 Y473 K476 L477 I480	I431-I435 HydrophobicContact CG2-CD1 3.88Å; I431-I435 WeakPolarHBondContact O-CG1 3.45Å; I431-I435 PolarHBondContact O-N 3.49Å; R433-I435 PolarHBondContact O-N 2.86Å; I435-F437 VanDerWaalsContact C-N 3.25Å; I435-F437 PolarHBondContact O-N 2.92Å; I435-V438 PolarHBondContact O-N 2.8Å; I435-V439 HydrophobicContact CG2-CG2 3.92Å; I435-V439 WeakPolarHBondContact O-CB 3.44Å; I435-V439 VanDerWaalsContact O-CG2 3.27Å; I435-V439 WeakPolarHBondContact O-CG2 3.41Å; I435-V439 PolarHBondContact O-N 2.93Å; I435-Y473 HydrophobicContact CD1-CD2 4.02Å; I435-Y473 HydrophobicContact CD1-CE2 4.48Å; I435-Y473 HydrophobicContact CG1-CD2 3.64Å; I435-Y473 HydrophobicContact CG1-CE2 3.61Å; I435-K476 HydrophobicContact CD1-CB 3.74Å; I435-K476 HydrophobicContact CD1-CG 3.85Å; I435-L477 HydrophobicContact CG1-CB 4.28Å; I435-L477 HydrophobicContact CG2-CB 4.46Å; I435-L477 HydrophobicContact CG2-CD1 4.01Å; I435-I480 HydrophobicContact CG2-CD1 3.87Å
436	E	93.7	Very high	93.1	Very high	126 Å²	126	60 Å²	60	59%	0.589	30%	0.303	S	S	*	.	H	α-helix	trans	-56.3	-37.6	175.1	-174.4	-173.3	173.8	0	0	112.6	H432 R433 R440	H432-E436 WeakPolarHBondContact O-CB 3.24Å; H432-E436 PolarHBondContact O-N 2.89Å; R433-E436 WeakPolarHBondContact O-CB 3.45Å; R433-E436 PolarHBondContact O-N 3.37Å; R433-E436 VanDerWaalsContact O-N 3.11Å; E436-R440 WeakPolarHBondContact O-CB 3.09Å
437	F	95.2	Very high	93.1	Very high	80 Å²	80	55.2 Å²	55.2	35%	0.351	28%	0.283	S	S	.	.	H	α-helix	trans	-78.8	-44.9	175.3	-78	-81.3	0	0	0	113	R433 M434 I435 V439 R440 E441 F445	R433-F437 VanDerWaalsContact O-CD2 3.26Å; R433-F437 WeakPolarHBondContact O-CD2 3.27Å; R433-F437 PolarHBondContact O-N 2.66Å; M434-F437 PolarHBondContact O-N 2.82Å; I435-F437 VanDerWaalsContact C-N 3.25Å; I435-F437 PolarHBondContact O-N 2.92Å; F437-V439 PolarHBondContact O-N 3.31Å; F437-R440 VanDerWaalsContact CD1-NH2 3.25Å; F437-R440 PolarHBondContact O-N 3.42Å; F437-R440 VanDerWaalsContact O-N 3.07Å; F437-E441 WeakPolarHBondContact O-CB 3.5Å; F437-E441 PolarHBondContact O-N 3.1Å; F437-F445 HydrophobicContact CB-CD1 3.75Å; F437-F445 HydrophobicContact CB-CD2 4.44Å; F437-F445 HydrophobicContact CB-CE1 3.28Å; F437-F445 HydrophobicContact CB-CE2 4.04Å; F437-F445 HydrophobicContact CB-CG 4.32Å; F437-F445 HydrophobicContact CB-CZ 3.45Å; F437-F445 VanDerWaalsContact CB-CZ 3.45Å; F437-F445 HydrophobicContact CD1-CE2 4.11Å; F437-F445 HydrophobicContact CD1-CZ 4.04Å; F437-F445 HydrophobicContact CD2-CZ 4.42Å; F437-F445 HydrophobicContact CG-CE1 4.07Å; F437-F445 HydrophobicContact CG-CE2 4.24Å; F437-F445 AromaticContact CG-CZ 3.73Å; F437-F445 HydrophobicContact CG-CZ 3.73Å
438	V	95.6	Very high	93.1	Very high	11 Å²	11	58.5 Å²	58.5	7%	0.067	30%	0.298	C	S	.	.	H	α-helix	trans	-63	-39.8	-180	171.8	0	0	0	0	112	M434 I435 R440 G442 F445 E446 L477	M434-V438 HydrophobicContact CE-CG2 3.79Å; M434-V438 HydrophobicContact CG-CG2 4.48Å; M434-V438 WeakPolarHBondContact O-CG2 3.45Å; M434-V438 PolarHBondContact O-N 2.84Å; I435-V438 PolarHBondContact O-N 2.8Å; V438-R440 PolarHBondContact O-N 2.88Å; V438-G442 CarbonylContact O-C 3.5Å; V438-G442 VanDerWaalsContact O-CA 3.29Å; V438-G442 WeakPolarHBondContact O-CA 3.47Å; V438-G442 PolarHBondContact O-N 2.89Å; V438-F445 HydrophobicContact CG2-CD1 3.83Å; V438-E446 HydrophobicContact CG2-CB 3.97Å; V438-L477 HydrophobicContact CB-CD1 4.47Å; V438-L477 HydrophobicContact CG1-CD1 3.98Å; V438-L477 HydrophobicContact CG1-CD2 4.11Å
439	V	93.3	Very high	93.1	Very high	65 Å²	65	58.2 Å²	58.2	39%	0.394	30%	0.297	S	S	.	.	H	α-helix	trans	-66.7	-20.8	175.9	173	0	0	0	0	112.4	I435 F437 L477 I480 L481	I435-V439 HydrophobicContact CG2-CG2 3.92Å; I435-V439 WeakPolarHBondContact O-CB 3.44Å; I435-V439 VanDerWaalsContact O-CG2 3.27Å; I435-V439 WeakPolarHBondContact O-CG2 3.41Å; I435-V439 PolarHBondContact O-N 2.93Å; F437-V439 PolarHBondContact O-N 3.31Å; V439-L477 HydrophobicContact CG2-CD1 3.61Å; V439-I480 HydrophobicContact CG1-CG2 4.36Å; V439-I480 HydrophobicContact CG2-CG2 4.07Å; V439-L481 HydrophobicContact CG2-CD2 4.25Å
440	R	93.1	Very high	93.1	Very high	122 Å²	122	57.4 Å²	57.4	46%	0.46	28%	0.284	S	S	.	.	H	α-helix	trans	-101.1	-37.4	-176.5	-168	-178.2	58.1	64.8	4.7	113.8	E436 F437 V438 S759	E436-R440 WeakPolarHBondContact O-CB 3.09Å; F437-R440 VanDerWaalsContact CD1-NH2 3.25Å; F437-R440 PolarHBondContact O-N 3.42Å; F437-R440 VanDerWaalsContact O-N 3.07Å; V438-R440 PolarHBondContact O-N 2.88Å; R440-S759 PolarHBondContact O-OG 2.68Å
441	E	92.9	Very high	92.8	Very high	58 Å²	58	61.7 Å²	61.7	27%	0.271	31%	0.307	S	S	.	.	H	α-helix	trans	-101.1	-12.7	-176.9	-56.5	-73.3	-165.8	0	0	113	F437 F445 W761	F437-E441 WeakPolarHBondContact O-CB 3.5Å; F437-E441 PolarHBondContact O-N 3.1Å; E441-F445 HydrophobicContact CB-CB 3.68Å; E441-F445 HydrophobicContact CB-CD2 4.18Å; E441-F445 HydrophobicContact CB-CG 4.12Å; E441-F445 HydrophobicContact CG-CB 4.46Å; E441-F445 HydrophobicContact CG-CD2 4.04Å; E441-F445 HydrophobicContact CG-CG 4.38Å; E441-W761 VanDerWaalsContact O-CD1 3.32Å
442	G	90.9	Very high	92.6	Very high	22 Å²	22	69.5 Å²	69.5	23%	0.227	34%	0.337	C	S	.	.			trans	87.4	179.3	-177.9	0	0	0	0	0	114.7	V438 M444 F445	V438-G442 CarbonylContact O-C 3.5Å; V438-G442 VanDerWaalsContact O-CA 3.29Å; V438-G442 WeakPolarHBondContact O-CA 3.47Å; V438-G442 PolarHBondContact O-N 2.89Å; G442-M444 PolarHBondContact O-N 3.21Å; G442-F445 WeakPolarHBondContact O-CB 3.33Å; G442-F445 PolarHBondContact O-N 2.92Å; G442-F445 VanDerWaalsContact O-N 3.11Å
443	P	91.2	Very high	92.5	Very high	94 Å²	94	67.6 Å²	67.6	61%	0.61	33%	0.328	S	S	*	.	H	α-helix	trans	-64.5	-24.9	-174.4	25.9	-34.8	0	0	0	113.7	F445 E446 A447	P443-F445 PolarHBondContact O-N 3.33Å; P443-E446 WeakPolarHBondContact O-CA 3.35Å; P443-E446 WeakPolarHBondContact O-CB 3.05Å; P443-E446 PolarHBondContact O-N 3.16Å; P443-A447 PolarHBondContact O-N 2.88Å; P443-A447 VanDerWaalsContact O-N 3.16Å
444	M	88.6	Confident	92.2	Very high	69 Å²	69	64.7 Å²	64.7	34%	0.34	32%	0.324	S	S	.	.	H	α-helix	trans	-61.2	-26.3	174.9	-65.1	-51	-64.9	0	0	113	G442 M448 Q772	G442-M444 PolarHBondContact O-N 3.21Å; M444-M448 VanDerWaalsContact O-CB 3.3Å; M444-M448 WeakPolarHBondContact O-CB 3.28Å; M444-M448 PolarHBondContact O-N 3.24Å; M444-Q772 HydrophobicContact CE-CB 4.23Å
445	F	93.8	Very high	91.9	Very high	36 Å²	36	71.9 Å²	71.9	16%	0.158	36%	0.363	C	S	.	.	H	α-helix	trans	-69.5	-35.5	171	-177.7	-85.9	0	0	0	112.1	M434 F437 V438 E441 G442 P443 M448 I449	M434-F445 HydrophobicContact CE-CD1 4.09Å; M434-F445 HydrophobicContact CE-CE1 4.03Å; M434-F445 HydrophobicContact SD-CD1 4.48Å; M434-F445 HydrophobicContact SD-CE1 3.87Å; F437-F445 HydrophobicContact CB-CD1 3.75Å; F437-F445 HydrophobicContact CB-CD2 4.44Å; F437-F445 HydrophobicContact CB-CE1 3.28Å; F437-F445 HydrophobicContact CB-CE2 4.04Å; F437-F445 HydrophobicContact CB-CG 4.32Å; F437-F445 HydrophobicContact CB-CZ 3.45Å; F437-F445 VanDerWaalsContact CB-CZ 3.45Å; F437-F445 HydrophobicContact CD1-CE2 4.11Å; F437-F445 HydrophobicContact CD1-CZ 4.04Å; F437-F445 HydrophobicContact CD2-CZ 4.42Å; F437-F445 HydrophobicContact CG-CE1 4.07Å; F437-F445 HydrophobicContact CG-CE2 4.24Å; F437-F445 AromaticContact CG-CZ 3.73Å; F437-F445 HydrophobicContact CG-CZ 3.73Å; V438-F445 HydrophobicContact CG2-CD1 3.83Å; E441-F445 HydrophobicContact CB-CB 3.68Å; E441-F445 HydrophobicContact CB-CD2 4.18Å; E441-F445 HydrophobicContact CB-CG 4.12Å; E441-F445 HydrophobicContact CG-CB 4.46Å; E441-F445 HydrophobicContact CG-CD2 4.04Å; E441-F445 HydrophobicContact CG-CG 4.38Å; G442-F445 WeakPolarHBondContact O-CB 3.33Å; G442-F445 PolarHBondContact O-N 2.92Å; G442-F445 VanDerWaalsContact O-N 3.11Å; P443-F445 PolarHBondContact O-N 3.33Å; F445-M448 HydrophobicContact CD2-CE 3.82Å; F445-M448 HydrophobicContact CE2-CE 4.03Å; F445-I449 HydrophobicContact CD1-CG1 4.05Å; F445-I449 HydrophobicContact CE1-CD1 4.3Å; F445-I449 HydrophobicContact CE1-CG1 3.56Å; F445-I449 HydrophobicContact CE2-CD1 4.42Å; F445-I449 HydrophobicContact CE2-CG1 4.31Å; F445-I449 HydrophobicContact CZ-CD1 3.94Å; F445-I449 HydrophobicContact CZ-CG1 3.71Å; F445-I449 VanDerWaalsContact O-CG1 3.32Å; F445-I449 WeakPolarHBondContact O-CG1 3.34Å; F445-I449 PolarHBondContact O-N 3.28Å; F445-I449 VanDerWaalsContact O-N 3.08Å
446	E	93.6	Very high	91.5	Very high	20 Å²	20	73.5 Å²	73.5	9%	0.093	37%	0.371	C	S	.	.	H	α-helix	trans	-62.9	-52.4	174.4	-169.3	179.1	135.9	0	0	110.3	M434 V438 P443 M448 I449 M450 L462 Y473 R474	M434-E446 HydrophobicContact CE-CB 4.27Å; M434-E446 HydrophobicContact CE-CG 4.11Å; V438-E446 HydrophobicContact CG2-CB 3.97Å; P443-E446 WeakPolarHBondContact O-CA 3.35Å; P443-E446 WeakPolarHBondContact O-CB 3.05Å; P443-E446 PolarHBondContact O-N 3.16Å; E446-M448 VanDerWaalsContact C-N 3.34Å; E446-M448 PolarHBondContact O-N 3.03Å; E446-I449 PolarHBondContact O-N 2.89Å; E446-I449 VanDerWaalsContact O-N 3.16Å; E446-M450 HydrophobicContact CG-CG 4.49Å; E446-M450 HydrophobicContact CG-SD 4.1Å; E446-M450 WeakPolarHBondContact O-CG 3.37Å; E446-M450 PolarHBondContact O-N 2.89Å; E446-L462 HydrophobicContact CG-CD2 4.46Å; E446-Y473 VanDerWaalsContact CD-OH 3.25Å; E446-Y473 PolarHBondContact OE2-OH 3.49Å; E446-R474 VanDerWaalsContact CD-NH1 3.31Å; E446-R474 IonicContact OE1-CZ 3.57Å; E446-R474 IonicContact OE1-NH1 2.79Å; E446-R474 PolarHBondContact OE1-NH1 3.09Å; E446-R474 IonicContact OE1-NH2 2.79Å; E446-R474 PolarHBondContact OE1-NH2 3.25Å; E446-R474 IonicContact OE2-NH1 3.24Å; E446-R474 PolarHBondContact OE2-NH1 3.19Å
447	A	90.1	Very high	91.3	Very high	39 Å²	39	72.4 Å²	72.4	32%	0.322	38%	0.375	S	S	.	.	H	α-helix	trans	-58	-43.2	178.2	0	0	0	0	0	112.6	P443 I449 M450 N451	P443-A447 PolarHBondContact O-N 2.88Å; P443-A447 VanDerWaalsContact O-N 3.16Å; A447-I449 PolarHBondContact O-N 3.01Å; A447-M450 PolarHBondContact O-N 3.07Å; A447-N451 PolarHBondContact O-N 3.2Å
448	M	91.3	Very high	90.9	Very high	109 Å²	109	74 Å²	74	54%	0.537	39%	0.385	S	S	.	.	H	α-helix	trans	-62.2	-40.2	177	-176.2	-174.4	66.2	0	0	112.5	M444 F445 E446 R452	M444-M448 VanDerWaalsContact O-CB 3.3Å; M444-M448 WeakPolarHBondContact O-CB 3.28Å; M444-M448 PolarHBondContact O-N 3.24Å; F445-M448 HydrophobicContact CD2-CE 3.82Å; F445-M448 HydrophobicContact CE2-CE 4.03Å; E446-M448 VanDerWaalsContact C-N 3.34Å; E446-M448 PolarHBondContact O-N 3.03Å; M448-R452 WeakPolarHBondContact O-CB 3.36Å; M448-R452 PolarHBondContact O-N 2.83Å
449	I	92.4	Very high	90.7	Very high	20 Å²	20	74.8 Å²	74.8	10%	0.103	39%	0.387	C	S	.	.	H	α-helix	trans	-72.3	-38.4	176.7	-66.4	-63.1	0	0	0	111.2	M434 F445 E446 A447 R452 E453 F459 L462	M434-I449 HydrophobicContact CE-CB 3.76Å; M434-I449 HydrophobicContact CE-CG1 4.05Å; M434-I449 HydrophobicContact CE-CG2 3.89Å; M434-I449 HydrophobicContact SD-CB 4.35Å; M434-I449 HydrophobicContact SD-CG1 4.31Å; M434-I449 HydrophobicContact SD-CG2 4.01Å; F445-I449 HydrophobicContact CD1-CG1 4.05Å; F445-I449 HydrophobicContact CE1-CD1 4.3Å; F445-I449 HydrophobicContact CE1-CG1 3.56Å; F445-I449 HydrophobicContact CE2-CD1 4.42Å; F445-I449 HydrophobicContact CE2-CG1 4.31Å; F445-I449 HydrophobicContact CZ-CD1 3.94Å; F445-I449 HydrophobicContact CZ-CG1 3.71Å; F445-I449 VanDerWaalsContact O-CG1 3.32Å; F445-I449 WeakPolarHBondContact O-CG1 3.34Å; F445-I449 PolarHBondContact O-N 3.28Å; F445-I449 VanDerWaalsContact O-N 3.08Å; E446-I449 PolarHBondContact O-N 2.89Å; E446-I449 VanDerWaalsContact O-N 3.16Å; A447-I449 PolarHBondContact O-N 3.01Å; I449-R452 PolarHBondContact O-N 2.93Å; I449-E453 HydrophobicContact CG2-CG 4.21Å; I449-E453 WeakPolarHBondContact O-CB 3.44Å; I449-E453 PolarHBondContact O-N 3.46Å; I449-F459 HydrophobicContact CG2-CD1 3.82Å; I449-F459 HydrophobicContact CG2-CE1 3.75Å; I449-F459 HydrophobicContact CG2-CZ 4.4Å; I449-L462 HydrophobicContact CG2-CD1 3.84Å
450	M	90.6	Very high	90.5	Very high	35 Å²	35	78.4 Å²	78.4	17%	0.172	39%	0.394	C	S	.	.	H	α-helix	trans	-59.1	-52.8	175.5	-73.6	-179.3	72.8	0	0	111.4	E446 A447 R452 E453 I454 L462 F463	E446-M450 HydrophobicContact CG-CG 4.49Å; E446-M450 HydrophobicContact CG-SD 4.1Å; E446-M450 WeakPolarHBondContact O-CG 3.37Å; E446-M450 PolarHBondContact O-N 2.89Å; A447-M450 PolarHBondContact O-N 3.07Å; M450-R452 VanDerWaalsContact C-N 3.26Å; M450-R452 PolarHBondContact O-N 3.07Å; M450-E453 PolarHBondContact O-N 3.12Å; M450-I454 PolarHBondContact O-N 3.03Å; M450-L462 HydrophobicContact CG-CB 3.91Å; M450-L462 HydrophobicContact CG-CD1 3.91Å; M450-L462 HydrophobicContact CG-CG 4.43Å; M450-L462 HydrophobicContact SD-CB 4.4Å; M450-F463 HydrophobicContact CB-CE1 3.82Å; M450-F463 HydrophobicContact CB-CZ 4.16Å; M450-F463 HydrophobicContact CE-CD1 3.88Å; M450-F463 HydrophobicContact CE-CE1 4.05Å; M450-F463 HydrophobicContact CG-CE1 4.11Å; M450-F463 HydrophobicContact CG-CZ 4.34Å; M450-F463 WeakPolarHBondContact O-CE1 3.4Å; M450-F463 VanDerWaalsContact O-CZ 3.29Å; M450-F463 WeakPolarHBondContact O-CZ 3.14Å
451	N	89.6	Confident	90.5	Very high	134 Å²	134	73 Å²	73	72%	0.717	37%	0.374	S	S	*	.	H	α-helix	trans	-62.8	-33.1	179.9	-67.6	-8.2	0	0	0	112.7	A447	A447-N451 PolarHBondContact O-N 3.2Å
452	R	91	Very high	90.5	Very high	164 Å²	164	70.2 Å²	70.2	62%	0.619	36%	0.361	S	S	*	.	H	α-helix	trans	-80.4	-39.6	-177.5	176.6	-174.3	162	128.7	1.7	113.9	M448 I449 M450	M448-R452 WeakPolarHBondContact O-CB 3.36Å; M448-R452 PolarHBondContact O-N 2.83Å; I449-R452 PolarHBondContact O-N 2.93Å; M450-R452 VanDerWaalsContact C-N 3.26Å; M450-R452 PolarHBondContact O-N 3.07Å
453	E	91.1	Very high	90.4	Very high	38 Å²	38	72 Å²	72	18%	0.178	36%	0.363	C	S	.	.	H	α-helix	trans	-110.8	17.5	-168.6	-55.7	-73.7	152.2	0	0	112.3	I449 M450 N455 N456 F459	I449-E453 HydrophobicContact CG2-CG 4.21Å; I449-E453 WeakPolarHBondContact O-CB 3.44Å; I449-E453 PolarHBondContact O-N 3.46Å; M450-E453 PolarHBondContact O-N 3.12Å; E453-N455 PolarHBondContact O-N 3.46Å; E453-N455 VanDerWaalsContact O-N 3.17Å; E453-N456 HydrophobicContact CB-CB 4.1Å; E453-N456 VanDerWaalsContact O-CB 3.24Å; E453-N456 WeakPolarHBondContact O-CB 3.45Å; E453-N456 PolarHBondContact O-N 2.98Å; E453-N456 PolarHBondContact OE2-ND2 3.28Å; E453-F459 HydrophobicContact CB-CB 4.08Å; E453-F459 HydrophobicContact CB-CD2 3.56Å; E453-F459 HydrophobicContact CB-CE2 4.1Å; E453-F459 HydrophobicContact CB-CG 3.86Å; E453-F459 HydrophobicContact CG-CD2 3.84Å; E453-F459 HydrophobicContact CG-CE2 3.82Å; E453-F459 HydrophobicContact CG-CG 4.38Å; E453-F459 HydrophobicContact CG-CZ 4.37Å
454	I	88.2	Confident	90.2	Very high	107 Å²	107	70.9 Å²	70.9	55%	0.549	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-38.3	177.5	-167.7	169.1	0	0	0	113.9	M450 N456 F463	M450-I454 PolarHBondContact O-N 3.03Å; I454-N456 VanDerWaalsContact C-N 3.32Å; I454-N456 PolarHBondContact O-N 2.81Å; I454-F463 VanDerWaalsContact CA-CZ 3.47Å; I454-F463 HydrophobicContact CB-CE1 4.19Å; I454-F463 HydrophobicContact CB-CZ 4.1Å; I454-F463 HydrophobicContact CG1-CE1 4.08Å; I454-F463 HydrophobicContact CG1-CZ 4.35Å
455	N	87.9	Confident	90	Very high	158 Å²	158	70.8 Å²	70.8	85%	0.845	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	4.7	178.2	-70.4	-56.5	0	0	0	114.1	E453	E453-N455 PolarHBondContact O-N 3.46Å; E453-N455 VanDerWaalsContact O-N 3.17Å
456	N	88.1	Confident	89.3	Confident	37 Å²	37	74.4 Å²	74.4	20%	0.198	37%	0.367	C	S	.	.			trans	-103.5	111.6	-173.7	-172.8	-15.4	0	0	0	111.4	E453 I454 M458 F459	E453-N456 HydrophobicContact CB-CB 4.1Å; E453-N456 VanDerWaalsContact O-CB 3.24Å; E453-N456 WeakPolarHBondContact O-CB 3.45Å; E453-N456 PolarHBondContact O-N 2.98Å; E453-N456 PolarHBondContact OE2-ND2 3.28Å; I454-N456 VanDerWaalsContact C-N 3.32Å; I454-N456 PolarHBondContact O-N 2.81Å; N456-M458 PolarHBondContact O-N 3.22Å; N456-M458 WeakPolarHBondContact OD1-CB 3.38Å; N456-M458 PolarHBondContact OD1-N 3.12Å; N456-M458 VanDerWaalsContact OD1-N 3.14Å; N456-F459 HydrophobicContact CB-CD2 4.1Å; N456-F459 PolarHBondContact O-N 2.84Å
457	P	88.4	Confident	89.1	Confident	103 Å²	103	75 Å²	75	67%	0.669	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-15.8	-176.1	26.2	-35.2	0	0	0	114.1	F459 R460	P457-F459 VanDerWaalsContact C-N 3.31Å; P457-R460 VanDerWaalsContact O-CB 3.25Å; P457-R460 WeakPolarHBondContact O-CB 3.45Å
458	M	86.9	Confident	89.1	Confident	114 Å²	114	75.5 Å²	75.5	56%	0.562	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-24.9	172.6	-61.7	-170.3	-62.1	0	0	113.1	L430 N456 F461	L430-M458 HydrophobicContact CD2-CB 3.83Å; L430-M458 VanDerWaalsContact CD2-O 3.28Å; L430-M458 WeakPolarHBondContact CD2-O 3.45Å; N456-M458 PolarHBondContact O-N 3.22Å; N456-M458 WeakPolarHBondContact OD1-CB 3.38Å; N456-M458 PolarHBondContact OD1-N 3.12Å; N456-M458 VanDerWaalsContact OD1-N 3.14Å; M458-F461 WeakPolarHBondContact O-CD1 3.44Å
459	F	91.7	Very high	89.1	Confident	26 Å²	26	71 Å²	71	11%	0.114	35%	0.352	C	S	.	.	S	Bend	trans	-99.4	4.9	178.2	-70.6	-82.5	0	0	0	113.3	L430 I449 E453 N456 P457 F461 L462 F463	L430-F459 HydrophobicContact CD1-CE1 4.01Å; L430-F459 HydrophobicContact CD1-CZ 3.92Å; L430-F459 HydrophobicContact CD2-CE1 4.34Å; L430-F459 HydrophobicContact CD2-CZ 4.39Å; L430-F459 HydrophobicContact CG-CE1 4.37Å; I449-F459 HydrophobicContact CG2-CD1 3.82Å; I449-F459 HydrophobicContact CG2-CE1 3.75Å; I449-F459 HydrophobicContact CG2-CZ 4.4Å; E453-F459 HydrophobicContact CB-CB 4.08Å; E453-F459 HydrophobicContact CB-CD2 3.56Å; E453-F459 HydrophobicContact CB-CE2 4.1Å; E453-F459 HydrophobicContact CB-CG 3.86Å; E453-F459 HydrophobicContact CG-CD2 3.84Å; E453-F459 HydrophobicContact CG-CE2 3.82Å; E453-F459 HydrophobicContact CG-CG 4.38Å; E453-F459 HydrophobicContact CG-CZ 4.37Å; N456-F459 HydrophobicContact CB-CD2 4.1Å; N456-F459 PolarHBondContact O-N 2.84Å; P457-F459 VanDerWaalsContact C-N 3.31Å; F459-F461 HydrophobicContact CD1-CE1 4.18Å; F459-F461 HydrophobicContact CD1-CZ 4.45Å; F459-F461 PolarHBondContact O-N 2.99Å; F459-L462 HydrophobicContact CB-CD1 4.32Å; F459-L462 HydrophobicContact CD1-CD1 3.92Å; F459-L462 WeakPolarHBondContact O-CB 3.43Å; F459-L462 PolarHBondContact O-N 2.81Å; F459-F463 HydrophobicContact CB-CE2 4.29Å; F459-F463 WeakPolarHBondContact O-CD2 3.29Å; F459-F463 WeakPolarHBondContact O-CE2 3.2Å
460	R	90.1	Very high	89.2	Confident	142 Å²	142	70.1 Å²	70.1	54%	0.536	35%	0.348	S	S	.	.	H	α-helix	trans	-46.4	-31.6	176.3	-175.3	170.2	173.4	133.2	9.8	114	P457 L462 F463 E464	P457-R460 VanDerWaalsContact O-CB 3.25Å; P457-R460 WeakPolarHBondContact O-CB 3.45Å; R460-L462 PolarHBondContact O-N 3.26Å; R460-F463 PolarHBondContact O-N 2.73Å; R460-E464 HydrophobicContact CG-CG 3.95Å; R460-E464 WeakPolarHBondContact CG-OE2 3.29Å; R460-E464 IonicContact CZ-OE1 2.76Å; R460-E464 IonicContact CZ-OE2 3.48Å; R460-E464 IonicContact NE-OE1 3.92Å; R460-E464 PolarHBondContact NE-OE1 3.44Å; R460-E464 IonicContact NE-OE2 3.18Å; R460-E464 PolarHBondContact NE-OE2 3.02Å; R460-E464 IonicContact NH2-OE1 3.93Å; R460-E464 PolarHBondContact NH2-OE1 3.49Å; R460-E464 IonicContact NH2-OE2 2.64Å; R460-E464 PolarHBondContact NH2-OE2 3.05Å; R460-E464 PolarHBondContact O-N 3.04Å
461	F	92.5	Very high	89.3	Confident	7 Å²	7	68.7 Å²	68.7	3%	0.031	34%	0.341	C	S	.	.	H	α-helix	trans	-64.5	-17.5	175.7	77.2	-91.5	0	0	0	115.1	L427 L430 I431 M434 M458 F459 A469 H470 Y473	L427-F461 HydrophobicContact CD1-CD1 3.78Å; L427-F461 HydrophobicContact CD1-CE1 4.39Å; L427-F461 HydrophobicContact CD1-CG 4.47Å; L430-F461 HydrophobicContact CD2-CE1 4.22Å; L430-F461 HydrophobicContact CG-CE1 4.32Å; I431-F461 HydrophobicContact CD1-CD2 4.4Å; I431-F461 HydrophobicContact CD1-CG 4.34Å; I431-F461 HydrophobicContact CG1-CD1 4.1Å; I431-F461 HydrophobicContact CG1-CD2 3.91Å; I431-F461 HydrophobicContact CG1-CE1 3.97Å; I431-F461 HydrophobicContact CG1-CE2 3.79Å; I431-F461 HydrophobicContact CG1-CG 4.08Å; I431-F461 HydrophobicContact CG1-CZ 3.83Å; M434-F461 HydrophobicContact CB-CZ 4.17Å; M434-F461 HydrophobicContact CG-CE2 4.46Å; M434-F461 HydrophobicContact CG-CZ 4.19Å; M458-F461 WeakPolarHBondContact O-CD1 3.44Å; F459-F461 HydrophobicContact CD1-CE1 4.18Å; F459-F461 HydrophobicContact CD1-CZ 4.45Å; F459-F461 PolarHBondContact O-N 2.99Å; F461-A469 HydrophobicContact CB-CB 3.59Å; F461-H470 WeakPolarHBondContact O-CA 3.39Å; F461-H470 WeakPolarHBondContact O-CB 3.32Å; F461-H470 PolarHBondContact O-ND1 2.79Å; F461-Y473 HydrophobicContact CD2-CD1 4.39Å; F461-Y473 HydrophobicContact CD2-CG 4.01Å; F461-Y473 HydrophobicContact CE2-CD1 4.29Å; F461-Y473 AromaticContact CE2-CD2 3.88Å; F461-Y473 HydrophobicContact CE2-CD2 3.88Å; F461-Y473 HydrophobicContact CE2-CE2 4.4Å; F461-Y473 AromaticContact CE2-CG 3.81Å; F461-Y473 HydrophobicContact CE2-CG 3.81Å
462	L	92.4	Very high	89.5	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-77.7	-31.7	175.1	-66.5	175.5	0	0	0	112	M434 E446 I449 M450 F459 R460 H470 Y473	M434-L462 HydrophobicContact CE-CD1 4.03Å; M434-L462 HydrophobicContact CE-CD2 4.23Å; M434-L462 HydrophobicContact CG-CD2 4.32Å; E446-L462 HydrophobicContact CG-CD2 4.46Å; I449-L462 HydrophobicContact CG2-CD1 3.84Å; M450-L462 HydrophobicContact CG-CB 3.91Å; M450-L462 HydrophobicContact CG-CD1 3.91Å; M450-L462 HydrophobicContact CG-CG 4.43Å; M450-L462 HydrophobicContact SD-CB 4.4Å; F459-L462 HydrophobicContact CB-CD1 4.32Å; F459-L462 HydrophobicContact CD1-CD1 3.92Å; F459-L462 WeakPolarHBondContact O-CB 3.43Å; F459-L462 PolarHBondContact O-N 2.81Å; R460-L462 PolarHBondContact O-N 3.26Å; L462-H470 PolarHBondContact O-CE1 3.31Å; L462-H470 PolarHBondContact O-ND1 2.78Å; L462-Y473 HydrophobicContact CD2-CD1 4.09Å; L462-Y473 HydrophobicContact CD2-CE1 3.67Å; L462-Y473 HydrophobicContact CD2-CE2 4.49Å
463	F	89.9	Confident	89.7	Confident	61 Å²	61	54.8 Å²	54.8	27%	0.268	28%	0.279	S	S	.	.	H	α-helix	trans	-96.7	-37.8	-173.7	-46.2	-84.5	0	0	0	112.5	M450 I454 F459 R460 N465	M450-F463 HydrophobicContact CB-CE1 3.82Å; M450-F463 HydrophobicContact CB-CZ 4.16Å; M450-F463 HydrophobicContact CE-CD1 3.88Å; M450-F463 HydrophobicContact CE-CE1 4.05Å; M450-F463 HydrophobicContact CG-CE1 4.11Å; M450-F463 HydrophobicContact CG-CZ 4.34Å; M450-F463 WeakPolarHBondContact O-CE1 3.4Å; M450-F463 VanDerWaalsContact O-CZ 3.29Å; M450-F463 WeakPolarHBondContact O-CZ 3.14Å; I454-F463 VanDerWaalsContact CA-CZ 3.47Å; I454-F463 HydrophobicContact CB-CE1 4.19Å; I454-F463 HydrophobicContact CB-CZ 4.1Å; I454-F463 HydrophobicContact CG1-CE1 4.08Å; I454-F463 HydrophobicContact CG1-CZ 4.35Å; F459-F463 HydrophobicContact CB-CE2 4.29Å; F459-F463 WeakPolarHBondContact O-CD2 3.29Å; F459-F463 WeakPolarHBondContact O-CE2 3.2Å; R460-F463 PolarHBondContact O-N 2.73Å; F463-N465 PolarHBondContact O-N 3.5Å; F463-N465 VanDerWaalsContact O-N 3.09Å; F463-N465 PolarHBondContact O-OD1 3.41Å
464	E	85.7	Confident	89.9	Confident	69 Å²	69	55.5 Å²	55.5	32%	0.322	28%	0.28	S	S	.	.			trans	-88.4	82.8	-173.7	-62.6	-167.9	155.7	0	0	112.6	R460 Q466 T467 H470	R460-E464 HydrophobicContact CG-CG 3.95Å; R460-E464 WeakPolarHBondContact CG-OE2 3.29Å; R460-E464 IonicContact CZ-OE1 2.76Å; R460-E464 IonicContact CZ-OE2 3.48Å; R460-E464 IonicContact NE-OE1 3.92Å; R460-E464 PolarHBondContact NE-OE1 3.44Å; R460-E464 IonicContact NE-OE2 3.18Å; R460-E464 PolarHBondContact NE-OE2 3.02Å; R460-E464 IonicContact NH2-OE1 3.93Å; R460-E464 PolarHBondContact NH2-OE1 3.49Å; R460-E464 IonicContact NH2-OE2 2.64Å; R460-E464 PolarHBondContact NH2-OE2 3.05Å; R460-E464 PolarHBondContact O-N 3.04Å; E464-Q466 PolarHBondContact O-N 2.77Å; E464-T467 HydrophobicContact CB-CG2 3.51Å; E464-T467 HydrophobicContact CG-CG2 4.49Å; E464-T467 WeakPolarHBondContact O-CB 3.31Å; E464-T467 PolarHBondContact O-N 3.37Å; E464-T467 PolarHBondContact O-OG1 3.23Å; E464-T467 WeakPolarHBondContact OE2-CG2 3.4Å; E464-H470 VanDerWaalsContact O-CB 3.26Å; E464-H470 WeakPolarHBondContact O-CB 2.91Å
465	N	84.2	Confident	90.2	Very high	68 Å²	68	50.5 Å²	50.5	36%	0.364	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-26.3	-174.7	-61.7	-23.1	0	0	0	115.4	F463 H470	F463-N465 PolarHBondContact O-N 3.5Å; F463-N465 VanDerWaalsContact O-N 3.09Å; F463-N465 PolarHBondContact O-OD1 3.41Å; N465-H470 PolarHBondContact OD1-CE1 3.05Å; N465-H470 PolarHBondContact OD1-NE2 3.07Å
466	Q	80.2	Confident	90.5	Very high	111 Å²	111	43.1 Å²	43.1	52%	0.519	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-10.2	178.3	-59.1	-171	36.7	0	0	114	E464	E464-Q466 PolarHBondContact O-N 2.77Å
467	T	88.1	Confident	90.8	Very high	32 Å²	32	42.2 Å²	42.2	20%	0.196	21%	0.21	C	C	.	.	S	Bend	trans	-72.8	144.7	-176.5	59.2	0	0	0	0	112.2	E464 A469 H470 V471	E464-T467 HydrophobicContact CB-CG2 3.51Å; E464-T467 HydrophobicContact CG-CG2 4.49Å; E464-T467 WeakPolarHBondContact O-CB 3.31Å; E464-T467 PolarHBondContact O-N 3.37Å; E464-T467 PolarHBondContact O-OG1 3.23Å; E464-T467 WeakPolarHBondContact OE2-CG2 3.4Å; T467-A469 PolarHBondContact O-N 2.83Å; T467-A469 VanDerWaalsContact O-N 3.1Å; T467-H470 PolarHBondContact O-N 2.8Å; T467-H470 WeakPolarHBondContact OG1-CB 3.31Å; T467-H470 PolarHBondContact OG1-N 3.14Å; T467-H470 VanDerWaalsContact OG1-N 3.16Å; T467-V471 WeakPolarHBondContact O-CG2 3.43Å; T467-V471 PolarHBondContact O-N 2.77Å
468	P	90	Very high	91.1	Very high	51 Å²	51	40.5 Å²	40.5	33%	0.331	19%	0.19	S	C	.	.	H	α-helix	trans	-57.2	-27.9	173	-25.2	35.2	0	0	0	113.1	P375 Y472	P375-P468 HydrophobicContact CB-CB 4.21Å; P375-P468 HydrophobicContact CB-CG 3.47Å; P375-P468 VanDerWaalsContact CB-CG 3.47Å; P375-P468 HydrophobicContact CG-CG 3.96Å; P468-Y472 VanDerWaalsContact O-CB 3.29Å; P468-Y472 WeakPolarHBondContact O-CB 3.46Å; P468-Y472 PolarHBondContact O-N 3.5Å
469	A	92	Very high	91.4	Very high	13 Å²	13	35.2 Å²	35.2	11%	0.107	16%	0.164	C	C	.	.	H	α-helix	trans	-69.1	-42.7	174.8	0	0	0	0	0	112.7	P422 L427 I431 F461 T467 Y472 Y473	P422-A469 HydrophobicContact CG-CB 4.48Å; L427-A469 HydrophobicContact CD2-CB 3.99Å; I431-A469 HydrophobicContact CD1-CB 4.22Å; F461-A469 HydrophobicContact CB-CB 3.59Å; T467-A469 PolarHBondContact O-N 2.83Å; T467-A469 VanDerWaalsContact O-N 3.1Å; A469-Y472 PolarHBondContact O-N 2.87Å; A469-Y473 WeakPolarHBondContact O-CB 3.23Å; A469-Y473 PolarHBondContact O-N 3.24Å
470	H	94	Very high	91.5	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.009	17%	0.171	C	C	.	.	H	α-helix	trans	-64.9	-46.5	173.2	-171.2	103.1	0	0	0	111.6	F383 F461 L462 E464 N465 T467 Y472 Y473 R474	F383-H470 AromaticContact CE1-CD2 3.88Å; F383-H470 AromaticContact CE1-NE2 3.83Å; F461-H470 WeakPolarHBondContact O-CA 3.39Å; F461-H470 WeakPolarHBondContact O-CB 3.32Å; F461-H470 PolarHBondContact O-ND1 2.79Å; L462-H470 PolarHBondContact O-CE1 3.31Å; L462-H470 PolarHBondContact O-ND1 2.78Å; E464-H470 VanDerWaalsContact O-CB 3.26Å; E464-H470 WeakPolarHBondContact O-CB 2.91Å; N465-H470 PolarHBondContact OD1-CE1 3.05Å; N465-H470 PolarHBondContact OD1-NE2 3.07Å; T467-H470 PolarHBondContact O-N 2.8Å; T467-H470 WeakPolarHBondContact OG1-CB 3.31Å; T467-H470 PolarHBondContact OG1-N 3.14Å; T467-H470 VanDerWaalsContact OG1-N 3.16Å; H470-Y472 VanDerWaalsContact C-N 3.3Å; H470-Y472 PolarHBondContact O-N 2.87Å; H470-Y473 WeakPolarHBondContact O-CB 3.48Å; H470-Y473 PolarHBondContact O-N 2.92Å; H470-Y473 VanDerWaalsContact O-N 3.1Å; H470-R474 VanDerWaalsContact NE2-CG 3.31Å; H470-R474 WeakPolarHBondContact NE2-CG 3.34Å; H470-R474 PolarHBondContact NE2-NE 3.18Å; H470-R474 VanDerWaalsContact NE2-NE 3.17Å; H470-R474 PolarHBondContact O-N 3.45Å
471	V	93	Very high	91.6	Very high	5 Å²	5	34.7 Å²	34.7	3%	0.03	17%	0.172	C	C	.	.	H	α-helix	trans	-57	-45	177	174.3	0	0	0	0	110.6	F383 V417 V419 T467 W475 W503	F383-V471 HydrophobicContact CB-CG2 4.07Å; F383-V471 HydrophobicContact CD1-CG2 4.48Å; F383-V471 WeakPolarHBondContact O-CG2 3.4Å; V417-V471 HydrophobicContact CG1-CG1 3.54Å; V419-V471 HydrophobicContact CB-CG1 4.46Å; V419-V471 HydrophobicContact CG1-CG1 4.5Å; V419-V471 HydrophobicContact CG2-CG1 4.05Å; T467-V471 WeakPolarHBondContact O-CG2 3.43Å; T467-V471 PolarHBondContact O-N 2.77Å; V471-W475 VanDerWaalsContact O-CB 3.29Å; V471-W475 WeakPolarHBondContact O-CB 3.34Å; V471-W475 PolarHBondContact O-N 2.79Å; V471-W503 HydrophobicContact CG1-CH2 4.45Å; V471-W503 HydrophobicContact CG1-CZ3 3.86Å
472	Y	94	Very high	91.5	Very high	6 Å²	6	38.8 Å²	38.8	2%	0.024	19%	0.191	C	C	.	.	H	α-helix	trans	-65.4	-40.7	174.4	-177.7	-97	0	0	0	113.2	V419 I421 P422 L428 I431 H432 P468 A469 H470 W475 K476	V419-Y472 HydrophobicContact CG1-CD2 4.17Å; I421-Y472 HydrophobicContact CB-CD2 4.47Å; I421-Y472 HydrophobicContact CB-CE2 4.21Å; I421-Y472 HydrophobicContact CG1-CD2 4.36Å; I421-Y472 HydrophobicContact CG1-CE2 3.92Å; I421-Y472 HydrophobicContact CG2-CE2 4.02Å; P422-Y472 HydrophobicContact CG-CD1 4.04Å; P422-Y472 HydrophobicContact CG-CG 4.1Å; L428-Y472 HydrophobicContact CD1-CD1 4.22Å; L428-Y472 HydrophobicContact CD1-CE1 3.46Å; L428-Y472 VanDerWaalsContact CD1-CE1 3.46Å; I431-Y472 HydrophobicContact CD1-CD1 4.47Å; I431-Y472 HydrophobicContact CG2-CD1 3.98Å; I431-Y472 HydrophobicContact CG2-CE1 4.12Å; H432-Y472 AromaticContact NE2-CE1 3.7Å; H432-Y472 AromaticContact NE2-CZ 3.76Å; H432-Y472 PolarHBondContact NE2-OH 3.1Å; P468-Y472 VanDerWaalsContact O-CB 3.29Å; P468-Y472 WeakPolarHBondContact O-CB 3.46Å; P468-Y472 PolarHBondContact O-N 3.5Å; A469-Y472 PolarHBondContact O-N 2.87Å; H470-Y472 VanDerWaalsContact C-N 3.3Å; H470-Y472 PolarHBondContact O-N 2.87Å; Y472-W475 AromaticContact CD2-CE3 3.99Å; Y472-W475 HydrophobicContact CD2-CE3 3.99Å; Y472-W475 HydrophobicContact CD2-CZ3 4.16Å; Y472-W475 AromaticContact CE2-CE3 3.97Å; Y472-W475 HydrophobicContact CE2-CE3 3.97Å; Y472-W475 AromaticContact CE2-CZ3 3.67Å; Y472-W475 HydrophobicContact CE2-CZ3 3.67Å; Y472-K476 HydrophobicContact CE1-CB 4.25Å; Y472-K476 HydrophobicContact CE1-CG 4.46Å; Y472-K476 WeakPolarHBondContact O-CB 3.46Å; Y472-K476 PolarHBondContact O-N 3.37Å
473	Y	95.4	Very high	91.3	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.3	-55.5	176.4	169.2	-113.5	0	0	0	111.6	I431 M434 I435 E446 F461 L462 A469 H470 W475 K476 L477	I431-Y473 HydrophobicContact CG2-CD2 4.09Å; M434-Y473 HydrophobicContact CB-CE2 4.28Å; M434-Y473 HydrophobicContact CG-CE2 3.82Å; I435-Y473 HydrophobicContact CD1-CD2 4.02Å; I435-Y473 HydrophobicContact CD1-CE2 4.48Å; I435-Y473 HydrophobicContact CG1-CD2 3.64Å; I435-Y473 HydrophobicContact CG1-CE2 3.61Å; E446-Y473 VanDerWaalsContact CD-OH 3.25Å; E446-Y473 PolarHBondContact OE2-OH 3.49Å; F461-Y473 HydrophobicContact CD2-CD1 4.39Å; F461-Y473 HydrophobicContact CD2-CG 4.01Å; F461-Y473 HydrophobicContact CE2-CD1 4.29Å; F461-Y473 AromaticContact CE2-CD2 3.88Å; F461-Y473 HydrophobicContact CE2-CD2 3.88Å; F461-Y473 HydrophobicContact CE2-CE2 4.4Å; F461-Y473 AromaticContact CE2-CG 3.81Å; F461-Y473 HydrophobicContact CE2-CG 3.81Å; L462-Y473 HydrophobicContact CD2-CD1 4.09Å; L462-Y473 HydrophobicContact CD2-CE1 3.67Å; L462-Y473 HydrophobicContact CD2-CE2 4.49Å; A469-Y473 WeakPolarHBondContact O-CB 3.23Å; A469-Y473 PolarHBondContact O-N 3.24Å; H470-Y473 WeakPolarHBondContact O-CB 3.48Å; H470-Y473 PolarHBondContact O-N 2.92Å; H470-Y473 VanDerWaalsContact O-N 3.1Å; Y473-W475 PolarHBondContact O-N 3.14Å; Y473-K476 PolarHBondContact O-N 2.83Å; Y473-L477 WeakPolarHBondContact O-CB 3.38Å; Y473-L477 PolarHBondContact O-N 3.44Å
474	R	94.5	Very high	91.3	Very high	53 Å²	53	40.3 Å²	40.3	20%	0.2	22%	0.218	C	C	.	.	H	α-helix	trans	-58.8	-47.6	179.1	-68.5	-69.1	177.2	-145.3	-5.2	111.7	F383 E446 H470 Y478 W503	F383-R474 HydrophobicContact CE1-CG 4.34Å; E446-R474 VanDerWaalsContact CD-NH1 3.31Å; E446-R474 IonicContact OE1-CZ 3.57Å; E446-R474 IonicContact OE1-NH1 2.79Å; E446-R474 PolarHBondContact OE1-NH1 3.09Å; E446-R474 IonicContact OE1-NH2 2.79Å; E446-R474 PolarHBondContact OE1-NH2 3.25Å; E446-R474 IonicContact OE2-NH1 3.24Å; E446-R474 PolarHBondContact OE2-NH1 3.19Å; H470-R474 VanDerWaalsContact NE2-CG 3.31Å; H470-R474 WeakPolarHBondContact NE2-CG 3.34Å; H470-R474 PolarHBondContact NE2-NE 3.18Å; H470-R474 VanDerWaalsContact NE2-NE 3.17Å; H470-R474 PolarHBondContact O-N 3.45Å; R474-Y478 WeakPolarHBondContact O-CB 3.33Å; R474-Y478 PolarHBondContact O-N 3.11Å; R474-W503 HydrophobicContact CB-CH2 4.19Å
475	W	94.6	Very high	91.4	Very high	3 Å²	3	39.2 Å²	39.2	1%	0.011	22%	0.219	C	C	.	.	H	α-helix	trans	-61	-45.8	176.7	169.9	77.2	0	0	0	112.7	V419 V471 Y472 Y473 Y478 S479 W489 F494 W503 P505 P506	V419-W475 HydrophobicContact CB-CG 4.31Å; V419-W475 HydrophobicContact CG1-CB 3.91Å; V419-W475 HydrophobicContact CG1-CD2 3.82Å; V419-W475 HydrophobicContact CG1-CE3 3.78Å; V419-W475 HydrophobicContact CG1-CG 3.84Å; V419-W475 HydrophobicContact CG2-CB 3.84Å; V419-W475 HydrophobicContact CG2-CD2 4.47Å; V419-W475 HydrophobicContact CG2-CG 3.78Å; V471-W475 VanDerWaalsContact O-CB 3.29Å; V471-W475 WeakPolarHBondContact O-CB 3.34Å; V471-W475 PolarHBondContact O-N 2.79Å; Y472-W475 AromaticContact CD2-CE3 3.99Å; Y472-W475 HydrophobicContact CD2-CE3 3.99Å; Y472-W475 HydrophobicContact CD2-CZ3 4.16Å; Y472-W475 AromaticContact CE2-CE3 3.97Å; Y472-W475 HydrophobicContact CE2-CE3 3.97Å; Y472-W475 AromaticContact CE2-CZ3 3.67Å; Y472-W475 HydrophobicContact CE2-CZ3 3.67Å; Y473-W475 PolarHBondContact O-N 3.14Å; W475-Y478 PolarHBondContact O-N 2.87Å; W475-S479 WeakPolarHBondContact O-CB 3.1Å; W475-S479 PolarHBondContact O-N 2.96Å; W475-W489 HydrophobicContact CH2-CB 4.41Å; W475-W489 AromaticContact CH2-CD1 3.67Å; W475-W489 AromaticContact CH2-CD2 3.73Å; W475-W489 HydrophobicContact CH2-CD2 3.73Å; W475-W489 AromaticContact CH2-CE2 3.7Å; W475-W489 HydrophobicContact CH2-CE3 4.44Å; W475-W489 AromaticContact CH2-CG 3.71Å; W475-W489 HydrophobicContact CH2-CG 3.71Å; W475-W489 HydrophobicContact CH2-CZ2 4.35Å; W475-W489 AromaticContact CH2-NE1 3.66Å; W475-W489 HydrophobicContact CZ2-CB 4.23Å; W475-W489 AromaticContact CZ2-CD1 3.5Å; W475-W489 HydrophobicContact CZ2-CD2 4.29Å; W475-W489 AromaticContact CZ2-CG 3.77Å; W475-W489 HydrophobicContact CZ2-CG 3.77Å; W475-W489 AromaticContact CZ2-NE1 3.86Å; W475-F494 AromaticContact CD1-CE1 3.81Å; W475-F494 AromaticContact CD1-CZ 3.83Å; W475-F494 AromaticContact NE1-CE1 3.86Å; W475-W503 HydrophobicContact CB-CE3 3.97Å; W475-W503 HydrophobicContact CB-CZ3 3.92Å; W475-P505 HydrophobicContact CZ2-CB 3.98Å; W475-P506 HydrophobicContact CE3-CG 4.21Å; W475-P506 HydrophobicContact CH2-CG 3.64Å; W475-P506 HydrophobicContact CZ2-CG 4.19Å; W475-P506 HydrophobicContact CZ3-CG 3.64Å
476	K	94.7	Very high	91.4	Very high	3 Å²	3	40.5 Å²	40.5	1%	0.013	23%	0.231	C	C	.	.	H	α-helix	trans	-75.1	-31.3	-174.3	-171.2	51.8	172	174.7	0	112.4	I435 Y472 Y473 I480 S485 P486	I435-K476 HydrophobicContact CD1-CB 3.74Å; I435-K476 HydrophobicContact CD1-CG 3.85Å; Y472-K476 HydrophobicContact CE1-CB 4.25Å; Y472-K476 HydrophobicContact CE1-CG 4.46Å; Y472-K476 WeakPolarHBondContact O-CB 3.46Å; Y472-K476 PolarHBondContact O-N 3.37Å; Y473-K476 PolarHBondContact O-N 2.83Å; K476-I480 HydrophobicContact CD-CD1 4.25Å; K476-I480 HydrophobicContact CD-CG1 4.44Å; K476-I480 HydrophobicContact CG-CD1 4.29Å; K476-I480 WeakPolarHBondContact O-CG1 3.38Å; K476-I480 PolarHBondContact O-N 3.19Å; K476-S485 PolarHBondContact NZ-O 2.97Å; K476-P486 WeakPolarHBondContact CE-O 3.46Å; K476-P486 PolarHBondContact NZ-O 3.42Å
477	L	95	Very high	91.4	Very high	18 Å²	18	40.7 Å²	40.7	9%	0.094	24%	0.239	C	C	.	.	H	α-helix	trans	-60.5	-53.4	167.6	178	59.3	0	0	0	110.4	I435 V438 V439 Y473 S479 I480 L481	I435-L477 HydrophobicContact CG1-CB 4.28Å; I435-L477 HydrophobicContact CG2-CB 4.46Å; I435-L477 HydrophobicContact CG2-CD1 4.01Å; V438-L477 HydrophobicContact CB-CD1 4.47Å; V438-L477 HydrophobicContact CG1-CD1 3.98Å; V438-L477 HydrophobicContact CG1-CD2 4.11Å; V439-L477 HydrophobicContact CG2-CD1 3.61Å; Y473-L477 WeakPolarHBondContact O-CB 3.38Å; Y473-L477 PolarHBondContact O-N 3.44Å; L477-S479 PolarHBondContact O-N 3.09Å; L477-I480 PolarHBondContact O-N 3.31Å; L477-L481 HydrophobicContact CD1-CD1 4.03Å; L477-L481 HydrophobicContact CD1-CG 4.36Å; L477-L481 HydrophobicContact CG-CD1 4.03Å; L477-L481 WeakPolarHBondContact O-CG 3.39Å; L477-L481 PolarHBondContact O-N 3.41Å
478	Y	93.8	Very high	91.2	Very high	66 Å²	66	46.4 Å²	46.4	26%	0.259	26%	0.262	S	S	.	.	H	α-helix	trans	-57.7	-47.6	177.7	178.2	-90.2	0	0	0	112.6	R474 W475 I480 L481 Q482 F494 M496	R474-Y478 WeakPolarHBondContact O-CB 3.33Å; R474-Y478 PolarHBondContact O-N 3.11Å; W475-Y478 PolarHBondContact O-N 2.87Å; Y478-I480 VanDerWaalsContact C-N 3.33Å; Y478-I480 PolarHBondContact O-N 3.28Å; Y478-L481 PolarHBondContact O-N 3.1Å; Y478-L481 VanDerWaalsContact O-N 3.14Å; Y478-Q482 HydrophobicContact CD1-CG 3.96Å; Y478-Q482 HydrophobicContact CD2-CG 4.49Å; Y478-Q482 HydrophobicContact CE1-CG 3.51Å; Y478-Q482 HydrophobicContact CE2-CG 4.12Å; Y478-Q482 HydrophobicContact CG-CG 4.42Å; Y478-Q482 WeakPolarHBondContact O-CG 3.39Å; Y478-Q482 PolarHBondContact O-N 3.48Å; Y478-F494 AromaticContact CD1-CE2 3.63Å; Y478-F494 HydrophobicContact CD1-CE2 3.63Å; Y478-F494 AromaticContact CD1-CZ 3.84Å; Y478-F494 HydrophobicContact CD1-CZ 3.84Å; Y478-F494 AromaticContact CE1-CD2 3.82Å; Y478-F494 HydrophobicContact CE1-CD2 3.82Å; Y478-F494 AromaticContact CE1-CE2 3.19Å; Y478-F494 HydrophobicContact CE1-CE2 3.19Å; Y478-F494 AromaticContact CE1-CZ 3.84Å; Y478-F494 HydrophobicContact CE1-CZ 3.84Å; Y478-F494 AromaticContact CZ-CE2 3.87Å; Y478-M496 HydrophobicContact CD1-CE 4.3Å; Y478-M496 HydrophobicContact CD2-CE 4.44Å; Y478-M496 HydrophobicContact CD2-CG 3.76Å; Y478-M496 HydrophobicContact CD2-SD 4.33Å; Y478-M496 HydrophobicContact CE2-CG 3.93Å; Y478-M496 HydrophobicContact CG-CE 3.94Å; Y478-M496 HydrophobicContact CG-CG 4.18Å; Y478-M496 HydrophobicContact CG-SD 4.38Å
479	S	93.2	Very high	91.2	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-55.4	-45.5	178.1	171.6	0	0	0	0	111.7	W475 L477 Q482 D484 W489	W475-S479 WeakPolarHBondContact O-CB 3.1Å; W475-S479 PolarHBondContact O-N 2.96Å; L477-S479 PolarHBondContact O-N 3.09Å; S479-Q482 PolarHBondContact O-N 3.15Å; S479-D484 VanDerWaalsContact O-CB 3.24Å; S479-D484 WeakPolarHBondContact O-CB 3.23Å; S479-D484 PolarHBondContact O-N 3.1Å; S479-D484 VanDerWaalsContact OG-CB 3.26Å; S479-D484 WeakPolarHBondContact OG-CB 3.43Å; S479-D484 PolarHBondContact OG-OD2 3.23Å; S479-W489 WeakPolarHBondContact OG-CB 3.17Å
480	I	93.2	Very high	91	Very high	48 Å²	48	52.2 Å²	52.2	25%	0.246	27%	0.274	C	S	.	.	H	α-helix	trans	-67.8	-38.8	177.7	-72.8	168.8	0	0	0	111.8	I435 V439 K476 L477 Y478 Q482 G483	I435-I480 HydrophobicContact CG2-CD1 3.87Å; V439-I480 HydrophobicContact CG1-CG2 4.36Å; V439-I480 HydrophobicContact CG2-CG2 4.07Å; K476-I480 HydrophobicContact CD-CD1 4.25Å; K476-I480 HydrophobicContact CD-CG1 4.44Å; K476-I480 HydrophobicContact CG-CD1 4.29Å; K476-I480 WeakPolarHBondContact O-CG1 3.38Å; K476-I480 PolarHBondContact O-N 3.19Å; L477-I480 PolarHBondContact O-N 3.31Å; Y478-I480 VanDerWaalsContact C-N 3.33Å; Y478-I480 PolarHBondContact O-N 3.28Å; I480-Q482 VanDerWaalsContact C-N 3.29Å; I480-Q482 PolarHBondContact O-N 3.06Å; I480-G483 PolarHBondContact O-N 3.48Å; I480-G483 VanDerWaalsContact O-N 3.08Å
481	L	92.3	Very high	90.6	Very high	110 Å²	110	55.9 Å²	55.9	58%	0.576	30%	0.297	S	S	*	.	H	α-helix	trans	-66.1	-29.2	174.8	-67.8	170.5	0	0	0	112.7	V439 L477 Y478 G483	V439-L481 HydrophobicContact CG2-CD2 4.25Å; L477-L481 HydrophobicContact CD1-CD1 4.03Å; L477-L481 HydrophobicContact CD1-CG 4.36Å; L477-L481 HydrophobicContact CG-CD1 4.03Å; L477-L481 WeakPolarHBondContact O-CG 3.39Å; L477-L481 PolarHBondContact O-N 3.41Å; Y478-L481 PolarHBondContact O-N 3.1Å; Y478-L481 VanDerWaalsContact O-N 3.14Å; L481-G483 PolarHBondContact O-N 3.34Å
482	Q	90.3	Very high	90.4	Very high	92 Å²	92	63.1 Å²	63.1	43%	0.43	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	12.8	171.5	-63.8	-59	-41.7	0	0	113.8	Y478 S479 I480 D484 R490	Y478-Q482 HydrophobicContact CD1-CG 3.96Å; Y478-Q482 HydrophobicContact CD2-CG 4.49Å; Y478-Q482 HydrophobicContact CE1-CG 3.51Å; Y478-Q482 HydrophobicContact CE2-CG 4.12Å; Y478-Q482 HydrophobicContact CG-CG 4.42Å; Y478-Q482 WeakPolarHBondContact O-CG 3.39Å; Y478-Q482 PolarHBondContact O-N 3.48Å; S479-Q482 PolarHBondContact O-N 3.15Å; I480-Q482 VanDerWaalsContact C-N 3.29Å; I480-Q482 PolarHBondContact O-N 3.06Å; Q482-D484 PolarHBondContact O-N 3.07Å; Q482-R490 PolarHBondContact O-NH2 3.11Å
483	G	88.7	Confident	90.2	Very high	67 Å²	67	65.7 Å²	65.7	69%	0.691	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	8.4	175.5	0	0	0	0	0	115.4	I480 L481	I480-G483 PolarHBondContact O-N 3.48Å; I480-G483 VanDerWaalsContact O-N 3.08Å; L481-G483 PolarHBondContact O-N 3.34Å
484	D	90.2	Very high	90.1	Very high	26 Å²	26	68 Å²	68	14%	0.139	35%	0.354	C	S	.	.			trans	-70.5	143.1	172	-69	-12.1	0	0	0	110.6	S479 Q482 W489 R490	S479-D484 VanDerWaalsContact O-CB 3.24Å; S479-D484 WeakPolarHBondContact O-CB 3.23Å; S479-D484 PolarHBondContact O-N 3.1Å; S479-D484 VanDerWaalsContact OG-CB 3.26Å; S479-D484 WeakPolarHBondContact OG-CB 3.43Å; S479-D484 PolarHBondContact OG-OD2 3.23Å; Q482-D484 PolarHBondContact O-N 3.07Å; D484-W489 HydrophobicContact CB-CB 3.95Å; D484-W489 VanDerWaalsContact OD2-CA 3.27Å; D484-W489 WeakPolarHBondContact OD2-CA 3.43Å; D484-W489 VanDerWaalsContact OD2-CB 3.27Å; D484-W489 WeakPolarHBondContact OD2-CB 3.26Å; D484-R490 IonicContact OD1-CZ 3.2Å; D484-R490 IonicContact OD1-NE 3.93Å; D484-R490 PolarHBondContact OD1-NE 3.28Å; D484-R490 VanDerWaalsContact OD1-NE 3.08Å; D484-R490 PolarHBondContact OD2-N 3.25Å
485	S	87.2	Confident	89.9	Confident	47 Å²	47	69.9 Å²	69.9	33%	0.329	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-74.5	158.7	178.5	72.1	0	0	0	0	112.4	K476 T487 K488	K476-S485 PolarHBondContact NZ-O 2.97Å; S485-T487 PolarHBondContact O-N 3.18Å; S485-T487 VanDerWaalsContact O-N 3.08Å; S485-K488 PolarHBondContact N-O 2.91Å; S485-K488 PolarHBondContact O-N 3.39Å; S485-K488 WeakPolarHBondContact OG-CA 3.37Å; S485-K488 VanDerWaalsContact OG-CB 3.32Å; S485-K488 WeakPolarHBondContact OG-CB 3.43Å; S485-K488 PolarHBondContact OG-N 2.94Å; S485-K488 PolarHBondContact OG-O 3.15Å
486	P	84.6	Confident	89.6	Confident	95 Å²	95	71.2 Å²	71.2	62%	0.617	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-35.2	177	-29.9	36.7	0	0	0	113.8	K476	K476-P486 WeakPolarHBondContact CE-O 3.46Å; K476-P486 PolarHBondContact NZ-O 3.42Å
487	T	80.2	Confident	89.2	Confident	114 Å²	114	76.4 Å²	76.4	70%	0.699	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.3	-3.8	-174.6	55.1	0	0	0	0	115.6	S485	S485-T487 PolarHBondContact O-N 3.18Å; S485-T487 VanDerWaalsContact O-N 3.08Å
488	K	83.5	Confident	88.7	Confident	153 Å²	153	85.3 Å²	85.3	67%	0.665	43%	0.429	S	S	*	.	B	Isolated β-bridge	trans	-143.3	127	173.7	-54.8	-179.5	-179.2	-179.8	0	110.5	S485	S485-K488 PolarHBondContact N-O 2.91Å; S485-K488 PolarHBondContact O-N 3.39Å; S485-K488 WeakPolarHBondContact OG-CA 3.37Å; S485-K488 VanDerWaalsContact OG-CB 3.32Å; S485-K488 WeakPolarHBondContact OG-CB 3.43Å; S485-K488 PolarHBondContact OG-N 2.94Å; S485-K488 PolarHBondContact OG-O 3.15Å
489	W	89.7	Confident	88.1	Confident	31 Å²	31	87.8 Å²	87.8	12%	0.117	45%	0.447	C	S	.	.			trans	-142.6	164.9	-173.9	54.8	83.1	0	0	0	110.6	I421 W475 S479 D484 P506 L508	I421-W489 HydrophobicContact CD1-CZ2 4.48Å; W475-W489 HydrophobicContact CH2-CB 4.41Å; W475-W489 AromaticContact CH2-CD1 3.67Å; W475-W489 AromaticContact CH2-CD2 3.73Å; W475-W489 HydrophobicContact CH2-CD2 3.73Å; W475-W489 AromaticContact CH2-CE2 3.7Å; W475-W489 HydrophobicContact CH2-CE3 4.44Å; W475-W489 AromaticContact CH2-CG 3.71Å; W475-W489 HydrophobicContact CH2-CG 3.71Å; W475-W489 HydrophobicContact CH2-CZ2 4.35Å; W475-W489 AromaticContact CH2-NE1 3.66Å; W475-W489 HydrophobicContact CZ2-CB 4.23Å; W475-W489 AromaticContact CZ2-CD1 3.5Å; W475-W489 HydrophobicContact CZ2-CD2 4.29Å; W475-W489 AromaticContact CZ2-CG 3.77Å; W475-W489 HydrophobicContact CZ2-CG 3.77Å; W475-W489 AromaticContact CZ2-NE1 3.86Å; S479-W489 WeakPolarHBondContact OG-CB 3.17Å; D484-W489 HydrophobicContact CB-CB 3.95Å; D484-W489 VanDerWaalsContact OD2-CA 3.27Å; D484-W489 WeakPolarHBondContact OD2-CA 3.43Å; D484-W489 VanDerWaalsContact OD2-CB 3.27Å; D484-W489 WeakPolarHBondContact OD2-CB 3.26Å; W489-P506 HydrophobicContact CZ2-CG 4.22Å; W489-P506 PolarHBondContact NE1-O 3.4Å; W489-L508 HydrophobicContact CD2-CD2 3.45Å; W489-L508 VanDerWaalsContact CD2-CD2 3.45Å; W489-L508 HydrophobicContact CD2-CG 4.38Å; W489-L508 VanDerWaalsContact CE2-CD2 3.48Å; W489-L508 HydrophobicContact CE3-CD2 3.73Å; W489-L508 HydrophobicContact CG-CD2 3.96Å; W489-L508 HydrophobicContact CH2-CD2 4.09Å; W489-L508 HydrophobicContact CZ2-CD2 3.82Å; W489-L508 HydrophobicContact CZ2-CG 4.47Å; W489-L508 HydrophobicContact CZ3-CD2 4.04Å
490	R	87.8	Confident	87.7	Confident	154 Å²	154	88.5 Å²	88.5	58%	0.581	46%	0.455	S	S	*	.			trans	-73.2	143.9	178.3	-58.9	171.8	-147.2	-154.9	10.1	110.6	Q482 D484 P505	Q482-R490 PolarHBondContact O-NH2 3.11Å; D484-R490 IonicContact OD1-CZ 3.2Å; D484-R490 IonicContact OD1-NE 3.93Å; D484-R490 PolarHBondContact OD1-NE 3.28Å; D484-R490 VanDerWaalsContact OD1-NE 3.08Å; D484-R490 PolarHBondContact OD2-N 3.25Å; R490-P505 VanDerWaalsContact O-CB 3.28Å; R490-P505 WeakPolarHBondContact O-CB 3.21Å; R490-P505 VanDerWaalsContact O-CG 3.27Å; R490-P505 WeakPolarHBondContact O-CG 3.34Å
491	T	87.3	Confident	87.6	Confident	79 Å²	79	86.7 Å²	86.7	49%	0.485	45%	0.446	S	S	.	.			trans	-117	7	-174.6	51.9	0	0	0	0	114.5	L508	T491-L508 HydrophobicContact CG2-CD1 4.19Å; T491-L508 HydrophobicContact CG2-CG 4.03Å
492	E	87.5	Confident	87.5	Confident	157 Å²	157	84.2 Å²	84.2	73%	0.734	43%	0.431	S	S	*	.	S	Bend	trans	-80.7	148.5	175.3	-67	167.2	-178.3	0	0	110.8	F494 P505	E492-F494 PolarHBondContact O-N 2.96Å; E492-P505 VanDerWaalsContact O-CD 3.22Å; E492-P505 WeakPolarHBondContact O-CD 3.49Å; E492-P505 WeakPolarHBondContact O-CG 3.34Å
493	D	90.8	Very high	87.7	Confident	61 Å²	61	80 Å²	80	33%	0.326	41%	0.411	S	S	.	.			trans	-67.4	123.7	173.3	-73	-9.7	0	0	0	109.5	W503 R504	D493-W503 WeakPolarHBondContact CA-O 3.12Å; D493-R504 WeakPolarHBondContact OD1-CA 3.47Å; D493-R504 VanDerWaalsContact OD1-CB 3.23Å; D493-R504 WeakPolarHBondContact OD1-CB 3.36Å; D493-R504 VanDerWaalsContact OD1-CG 3.23Å; D493-R504 WeakPolarHBondContact OD1-CG 3.22Å; D493-R504 IonicContact OD1-CZ 3.18Å; D493-R504 IonicContact OD1-NE 3.53Å; D493-R504 PolarHBondContact OD1-NE 2.81Å; D493-R504 IonicContact OD1-NH2 3.44Å; D493-R504 IonicContact OD2-CZ 2.73Å; D493-R504 IonicContact OD2-NE 3.76Å; D493-R504 PolarHBondContact OD2-NE 3.2Å; D493-R504 IonicContact OD2-NH2 2.77Å; D493-R504 PolarHBondContact OD2-NH2 3.13Å
494	F	92.3	Very high	87.7	Confident	47 Å²	47	81.1 Å²	81.1	21%	0.206	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	171.3	-176.1	74.6	-81	0	0	0	111.5	W475 Y478 E492 M496 F502 W503 P505	W475-F494 AromaticContact CD1-CE1 3.81Å; W475-F494 AromaticContact CD1-CZ 3.83Å; W475-F494 AromaticContact NE1-CE1 3.86Å; Y478-F494 AromaticContact CD1-CE2 3.63Å; Y478-F494 HydrophobicContact CD1-CE2 3.63Å; Y478-F494 AromaticContact CD1-CZ 3.84Å; Y478-F494 HydrophobicContact CD1-CZ 3.84Å; Y478-F494 AromaticContact CE1-CD2 3.82Å; Y478-F494 HydrophobicContact CE1-CD2 3.82Å; Y478-F494 AromaticContact CE1-CE2 3.19Å; Y478-F494 HydrophobicContact CE1-CE2 3.19Å; Y478-F494 AromaticContact CE1-CZ 3.84Å; Y478-F494 HydrophobicContact CE1-CZ 3.84Å; Y478-F494 AromaticContact CZ-CE2 3.87Å; E492-F494 PolarHBondContact O-N 2.96Å; F494-M496 HydrophobicContact CE2-CB 4.04Å; F494-M496 HydrophobicContact CE2-CE 4.43Å; F494-M496 HydrophobicContact CZ-CE 4.26Å; F494-F502 CarbonylContact O-C 3.57Å; F494-F502 VanDerWaalsContact O-CA 3.31Å; F494-F502 WeakPolarHBondContact O-CA 3.26Å; F494-W503 HydrophobicContact CD1-CB 4.05Å; F494-W503 VanDerWaalsContact CD1-O 3.31Å; F494-W503 WeakPolarHBondContact CD1-O 3.46Å; F494-W503 HydrophobicContact CE1-CB 3.53Å; F494-W503 HydrophobicContact CE2-CB 4.13Å; F494-W503 HydrophobicContact CZ-CB 3.57Å; F494-W503 HydrophobicContact CZ-CG 4.18Å; F494-W503 PolarHBondContact N-O 2.79Å; F494-W503 PolarHBondContact O-N 2.9Å; F494-P505 HydrophobicContact CD1-CG 4.13Å; F494-P505 HydrophobicContact CE1-CG 4.08Å
495	R	90.4	Very high	87.8	Confident	94 Å²	94	80.3 Å²	80.3	36%	0.355	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	128.5	169.5	-68.7	-173.4	-173.4	-123.4	10.1	110.4	S413 N499 G500 F502	S413-R495 VanDerWaalsContact O-CZ 3.26Å; S413-R495 PolarHBondContact O-NH1 2.84Å; S413-R495 VanDerWaalsContact O-NH1 3.11Å; S413-R495 PolarHBondContact O-NH2 3.31Å; R495-N499 PolarHBondContact NH1-O 2.83Å; R495-N499 VanDerWaalsContact NH1-O 3.14Å; R495-G500 PolarHBondContact NH1-O 3.17Å; R495-F502 HydrophobicContact CG-CD1 3.84Å; R495-F502 HydrophobicContact CG-CE1 4.01Å; R495-F502 HydrophobicContact CG-CG 4.26Å
496	M	89.1	Confident	87.7	Confident	31 Å²	31	78.3 Å²	78.3	15%	0.153	38%	0.376	C	S	.	.	S	Bend	trans	-80.8	-28.7	175.9	-169	178.5	-64.1	0	0	112.4	Y478 F494 W503	Y478-M496 HydrophobicContact CD1-CE 4.3Å; Y478-M496 HydrophobicContact CD2-CE 4.44Å; Y478-M496 HydrophobicContact CD2-CG 3.76Å; Y478-M496 HydrophobicContact CD2-SD 4.33Å; Y478-M496 HydrophobicContact CE2-CG 3.93Å; Y478-M496 HydrophobicContact CG-CE 3.94Å; Y478-M496 HydrophobicContact CG-CG 4.18Å; Y478-M496 HydrophobicContact CG-SD 4.38Å; F494-M496 HydrophobicContact CE2-CB 4.04Å; F494-M496 HydrophobicContact CE2-CE 4.43Å; F494-M496 HydrophobicContact CZ-CE 4.26Å; M496-W503 HydrophobicContact CB-CG 4.32Å; M496-W503 HydrophobicContact CE-CD2 3.73Å; M496-W503 HydrophobicContact CE-CE3 3.77Å; M496-W503 HydrophobicContact CE-CG 4.34Å; M496-W503 HydrophobicContact CE-CH2 4.07Å; M496-W503 HydrophobicContact CE-CZ2 4.03Å; M496-W503 HydrophobicContact CE-CZ3 3.94Å; M496-W503 HydrophobicContact SD-CZ2 4.15Å
497	F	86.5	Confident	87.4	Confident	112 Å²	112	77 Å²	77	49%	0.491	37%	0.368	S	S	.	.	S	Bend	trans	-129.7	151.1	-176.9	-52.5	-72.7	0	0	0	110.5	F383 G500 W503	F383-F497 HydrophobicContact CE2-CE2 4.21Å; F497-G500 PolarHBondContact O-N 3.29Å; F497-W503 HydrophobicContact CE2-CZ2 4.48Å
498	K	84.2	Confident	86.9	Confident	205 Å²	205	74.4 Å²	74.4	89%	0.891	35%	0.349	S	S	*	.	S	Bend	trans	-60.8	138.8	169.4	-65.5	-177.8	-178.6	177.9	0	109.1	G500	K498-G500 PolarHBondContact O-N 3.32Å
499	N	80.9	Confident	86.1	Confident	118 Å²	118	69.9 Å²	69.9	63%	0.631	33%	0.333	S	S	*	.	S	Bend	trans	57.4	-21.2	-173.8	-60.9	2.8	0	0	0	117.1	S413 R495	S413-N499 WeakPolarHBondContact CA-O 3.33Å; S413-N499 VanDerWaalsContact CB-O 3.23Å; S413-N499 WeakPolarHBondContact CB-O 3Å; R495-N499 PolarHBondContact NH1-O 2.83Å; R495-N499 VanDerWaalsContact NH1-O 3.14Å
500	G	84.7	Confident	84.9	Confident	18 Å²	18	70.5 Å²	70.5	19%	0.186	34%	0.341	C	S	.	.	S	Bend	trans	-66.3	168.1	177.9	0	0	0	0	0	114.9	R495 F497 K498	R495-G500 PolarHBondContact NH1-O 3.17Å; F497-G500 PolarHBondContact O-N 3.29Å; K498-G500 PolarHBondContact O-N 3.32Å
501	S	90.6	Very high	83.9	Confident	10 Å²	10	64.5 Å²	64.5	7%	0.07	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-58.4	156.7	-173.9	-53.9	0	0	0	0	115.2	L412 A415 W503	L412-S501 WeakPolarHBondContact O-CA 3.5Å; L412-S501 WeakPolarHBondContact O-CB 3.49Å; L412-S501 PolarHBondContact O-N 2.79Å; L412-S501 PolarHBondContact O-OG 2.8Å; A415-S501 WeakPolarHBondContact O-CB 3.43Å; S501-W503 VanDerWaalsContact O-CD1 3.31Å
502	F	91.6	Very high	82.7	Confident	58 Å²	58	64.3 Å²	64.3	25%	0.254	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	130.3	172.8	-72.4	-86.7	0	0	0	110.7	A415 I416 V417 F494 R495	A415-F502 PolarHBondContact O-N 3.41Å; I416-F502 CarbonylContact C-O 3.5Å; I416-F502 WeakPolarHBondContact CA-O 3.49Å; I416-F502 HydrophobicContact CG1-CB 4.11Å; V417-F502 PolarHBondContact N-O 2.99Å; F494-F502 CarbonylContact O-C 3.57Å; F494-F502 VanDerWaalsContact O-CA 3.31Å; F494-F502 WeakPolarHBondContact O-CA 3.26Å; R495-F502 HydrophobicContact CG-CD1 3.84Å; R495-F502 HydrophobicContact CG-CE1 4.01Å; R495-F502 HydrophobicContact CG-CG 4.26Å
503	W	93.3	Very high	81.3	Confident	3 Å²	3	63.2 Å²	63.2	1%	0.011	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.7	173.9	-72	67	0	0	0	109.4	F383 V417 V419 V471 R474 W475 D493 F494 M496 F497 S501 P505	F383-W503 HydrophobicContact CB-CH2 4.22Å; F383-W503 HydrophobicContact CB-CZ2 4.19Å; F383-W503 AromaticContact CD1-CH2 3.9Å; F383-W503 HydrophobicContact CD1-CH2 3.9Å; F383-W503 HydrophobicContact CD1-CZ2 4.13Å; F383-W503 HydrophobicContact CD2-CH2 4.33Å; F383-W503 AromaticContact CD2-CZ2 3.74Å; F383-W503 HydrophobicContact CD2-CZ2 3.74Å; F383-W503 HydrophobicContact CE1-CH2 4.36Å; F383-W503 HydrophobicContact CE1-CZ2 4.49Å; F383-W503 HydrophobicContact CE2-CZ2 4.12Å; F383-W503 AromaticContact CG-CH2 3.87Å; F383-W503 HydrophobicContact CG-CH2 3.87Å; F383-W503 AromaticContact CG-CZ2 3.74Å; F383-W503 HydrophobicContact CG-CZ2 3.74Å; F383-W503 HydrophobicContact CZ-CZ2 4.48Å; V417-W503 HydrophobicContact CB-CD2 4.08Å; V417-W503 HydrophobicContact CB-CE3 4.35Å; V417-W503 HydrophobicContact CB-CG 4.31Å; V417-W503 HydrophobicContact CG1-CD2 4.01Å; V417-W503 HydrophobicContact CG1-CE3 3.8Å; V417-W503 HydrophobicContact CG1-CH2 4.21Å; V417-W503 HydrophobicContact CG1-CZ2 4.39Å; V417-W503 HydrophobicContact CG1-CZ3 3.91Å; V417-W503 HydrophobicContact CG2-CD2 4.49Å; V419-W503 HydrophobicContact CG2-CE3 3.7Å; V419-W503 HydrophobicContact CG2-CZ3 4.21Å; V471-W503 HydrophobicContact CG1-CH2 4.45Å; V471-W503 HydrophobicContact CG1-CZ3 3.86Å; R474-W503 HydrophobicContact CB-CH2 4.19Å; W475-W503 HydrophobicContact CB-CE3 3.97Å; W475-W503 HydrophobicContact CB-CZ3 3.92Å; D493-W503 WeakPolarHBondContact CA-O 3.12Å; F494-W503 HydrophobicContact CD1-CB 4.05Å; F494-W503 VanDerWaalsContact CD1-O 3.31Å; F494-W503 WeakPolarHBondContact CD1-O 3.46Å; F494-W503 HydrophobicContact CE1-CB 3.53Å; F494-W503 HydrophobicContact CE2-CB 4.13Å; F494-W503 HydrophobicContact CZ-CB 3.57Å; F494-W503 HydrophobicContact CZ-CG 4.18Å; F494-W503 PolarHBondContact N-O 2.79Å; F494-W503 PolarHBondContact O-N 2.9Å; M496-W503 HydrophobicContact CB-CG 4.32Å; M496-W503 HydrophobicContact CE-CD2 3.73Å; M496-W503 HydrophobicContact CE-CE3 3.77Å; M496-W503 HydrophobicContact CE-CG 4.34Å; M496-W503 HydrophobicContact CE-CH2 4.07Å; M496-W503 HydrophobicContact CE-CZ2 4.03Å; M496-W503 HydrophobicContact CE-CZ3 3.94Å; M496-W503 HydrophobicContact SD-CZ2 4.15Å; F497-W503 HydrophobicContact CE2-CZ2 4.48Å; S501-W503 VanDerWaalsContact O-CD1 3.31Å; W503-P505 WeakPolarHBondContact O-CD 3.32Å
504	R	90.2	Very high	79.5	Confident	91 Å²	91	61.2 Å²	61.2	34%	0.343	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	111	173.8	179.2	163.7	-65.1	161.1	4	109.8	I416 V417 V419 D493	I416-R504 HydrophobicContact CG2-CB 4.03Å; V417-R504 PolarHBondContact O-N 2.7Å; V419-R504 VanDerWaalsContact CB-O 3.29Å; V419-R504 WeakPolarHBondContact CB-O 3.35Å; V419-R504 WeakPolarHBondContact CG2-O 3.38Å; V419-R504 PolarHBondContact N-O 3.38Å; D493-R504 WeakPolarHBondContact OD1-CA 3.47Å; D493-R504 VanDerWaalsContact OD1-CB 3.23Å; D493-R504 WeakPolarHBondContact OD1-CB 3.36Å; D493-R504 VanDerWaalsContact OD1-CG 3.23Å; D493-R504 WeakPolarHBondContact OD1-CG 3.22Å; D493-R504 IonicContact OD1-CZ 3.18Å; D493-R504 IonicContact OD1-NE 3.53Å; D493-R504 PolarHBondContact OD1-NE 2.81Å; D493-R504 IonicContact OD1-NH2 3.44Å; D493-R504 IonicContact OD2-CZ 2.73Å; D493-R504 IonicContact OD2-NE 3.76Å; D493-R504 PolarHBondContact OD2-NE 3.2Å; D493-R504 IonicContact OD2-NH2 2.77Å; D493-R504 PolarHBondContact OD2-NH2 3.13Å
505	P	90.9	Very high	77.9	Confident	9 Å²	9	59.5 Å²	59.5	6%	0.058	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-61.3	153.7	177	-21.1	32.9	0	0	0	112.2	W475 R490 E492 F494 W503	W475-P505 HydrophobicContact CZ2-CB 3.98Å; R490-P505 VanDerWaalsContact O-CB 3.28Å; R490-P505 WeakPolarHBondContact O-CB 3.21Å; R490-P505 VanDerWaalsContact O-CG 3.27Å; R490-P505 WeakPolarHBondContact O-CG 3.34Å; E492-P505 VanDerWaalsContact O-CD 3.22Å; E492-P505 WeakPolarHBondContact O-CD 3.49Å; E492-P505 WeakPolarHBondContact O-CG 3.34Å; F494-P505 HydrophobicContact CD1-CG 4.13Å; F494-P505 HydrophobicContact CE1-CG 4.08Å; W503-P505 WeakPolarHBondContact O-CD 3.32Å
506	P	85.8	Confident	76.3	Confident	4 Å²	4	57.2 Å²	57.2	3%	0.026	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-69.6	142	170.2	31	-31.5	0	0	0	109.6	V419 I421 W475 W489 L508	V419-P506 HydrophobicContact CG1-CG 4.35Å; I421-P506 HydrophobicContact CD1-CB 4Å; I421-P506 HydrophobicContact CD1-CG 4.21Å; I421-P506 HydrophobicContact CG1-CB 3.64Å; I421-P506 HydrophobicContact CG1-CG 3.9Å; W475-P506 HydrophobicContact CE3-CG 4.21Å; W475-P506 HydrophobicContact CH2-CG 3.64Å; W475-P506 HydrophobicContact CZ2-CG 4.19Å; W475-P506 HydrophobicContact CZ3-CG 3.64Å; W489-P506 HydrophobicContact CZ2-CG 4.22Å; W489-P506 PolarHBondContact NE1-O 3.4Å; P506-L508 PolarHBondContact O-N 2.75Å
507	P	78.8	Confident	74.5	Confident	67 Å²	67	62 Å²	62	44%	0.435	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-62.5	138.3	177.1	26.1	-35.1	0	0	0	111.2	N509 P510	P507-N509 PolarHBondContact O-N 2.71Å; P507-N509 VanDerWaalsContact O-N 3.13Å; P507-P510 HydrophobicContact CG-CB 3.76Å; P507-P510 HydrophobicContact CG-CG 4.27Å
508	L	69.8	Low	72.6	Confident	61 Å²	61	64 Å²	64	32%	0.319	33%	0.326	S	S	.	.	S	Bend	trans	-55.5	-34.6	-174.9	-83.5	166.2	0	0	0	114.3	W489 T491 P506	W489-L508 HydrophobicContact CD2-CD2 3.45Å; W489-L508 VanDerWaalsContact CD2-CD2 3.45Å; W489-L508 HydrophobicContact CD2-CG 4.38Å; W489-L508 VanDerWaalsContact CE2-CD2 3.48Å; W489-L508 HydrophobicContact CE3-CD2 3.73Å; W489-L508 HydrophobicContact CG-CD2 3.96Å; W489-L508 HydrophobicContact CH2-CD2 4.09Å; W489-L508 HydrophobicContact CZ2-CD2 3.82Å; W489-L508 HydrophobicContact CZ2-CG 4.47Å; W489-L508 HydrophobicContact CZ3-CD2 4.04Å; T491-L508 HydrophobicContact CG2-CD1 4.19Å; T491-L508 HydrophobicContact CG2-CG 4.03Å; P506-L508 PolarHBondContact O-N 2.75Å
509	N	67	Low	71	Confident	58 Å²	58	56.1 Å²	56.1	31%	0.31	29%	0.292	S	S	.	.			trans	-151.1	101.5	165.3	-82.4	-74.9	0	0	0	108.1	P507 Y511 L512 H513	P507-N509 PolarHBondContact O-N 2.71Å; P507-N509 VanDerWaalsContact O-N 3.13Å; N509-Y511 PolarHBondContact O-N 2.99Å; N509-Y511 VanDerWaalsContact O-N 3.13Å; N509-L512 HydrophobicContact CB-CB 3.91Å; N509-L512 HydrophobicContact CB-CD1 3.75Å; N509-L512 HydrophobicContact CB-CG 3.76Å; N509-L512 PolarHBondContact O-N 2.92Å; N509-H513 PolarHBondContact O-ND1 3.11Å
510	P	62.7	Low	69.5	Low	44 Å²	44	53.5 Å²	53.5	29%	0.286	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-12.6	178.4	23.9	-31.2	0	0	0	113.5	P507	P507-P510 HydrophobicContact CG-CB 3.76Å; P507-P510 HydrophobicContact CG-CG 4.27Å
511	Y	67	Low	67.5	Low	27 Å²	27	56.5 Å²	56.5	11%	0.106	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-15.1	-173.6	-47.5	-61	0	0	0	114.2	P299 M326 P362 I365 T373 N509	P299-Y511 HydrophobicContact CB-CD1 4.02Å; P299-Y511 HydrophobicContact CB-CG 4.34Å; P299-Y511 HydrophobicContact CG-CD1 4.08Å; P299-Y511 HydrophobicContact CG-CG 4.35Å; M326-Y511 WeakPolarHBondContact CB-O 3.47Å; P362-Y511 VanDerWaalsContact CD-CE2 3.43Å; P362-Y511 HydrophobicContact CG-CD1 4.04Å; P362-Y511 HydrophobicContact CG-CD2 3.88Å; P362-Y511 HydrophobicContact CG-CE1 4.07Å; P362-Y511 HydrophobicContact CG-CE2 3.9Å; P362-Y511 HydrophobicContact CG-CG 3.93Å; I365-Y511 HydrophobicContact CD1-CE1 4.23Å; I365-Y511 VanDerWaalsContact CD1-OH 3.26Å; I365-Y511 WeakPolarHBondContact CD1-OH 3.21Å; I365-Y511 HydrophobicContact CG1-CE1 4Å; I365-Y511 HydrophobicContact CG2-CE1 4.16Å; T373-Y511 HydrophobicContact CG2-CE1 4.44Å; N509-Y511 PolarHBondContact O-N 2.99Å; N509-Y511 VanDerWaalsContact O-N 3.13Å
512	L	62.1	Low	65.3	Low	76 Å²	76	63 Å²	63	40%	0.398	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-31.8	176.8	-66.4	-178.3	0	0	0	111.6	M326 N509 G514	M326-L512 HydrophobicContact CB-CD2 4.38Å; M326-L512 WeakPolarHBondContact O-CD2 3.06Å; M326-L512 HydrophobicContact SD-CD2 4.33Å; N509-L512 HydrophobicContact CB-CB 3.91Å; N509-L512 HydrophobicContact CB-CD1 3.75Å; N509-L512 HydrophobicContact CB-CG 3.76Å; N509-L512 PolarHBondContact O-N 2.92Å; L512-G514 PolarHBondContact O-N 2.86Å
513	H	58.8	Low	63.2	Low	134 Å²	134	61.8 Å²	61.8	62%	0.62	32%	0.321	S	S	*	.	S	Bend	trans	-73.5	105.1	156.7	-49	89.9	0	0	0	105.8	N509	N509-H513 PolarHBondContact O-ND1 3.11Å
514	G	53.9	Low	61.1	Low	18 Å²	18	65.2 Å²	65.2	19%	0.186	34%	0.336	C	S	.	.			trans	-64.6	170.2	173	0	0	0	0	0	111.4	N327 D330 L512 S516	N327-G514 WeakPolarHBondContact ND2-CA 3.49Å; N327-G514 PolarHBondContact ND2-N 3.33Å; D330-G514 WeakPolarHBondContact OD1-CA 3.46Å; L512-G514 PolarHBondContact O-N 2.86Å; G514-S516 PolarHBondContact O-N 2.77Å
515	M	58	Low	58.8	Low	11 Å²	11	64.4 Å²	64.4	5%	0.054	34%	0.341	C	S	.	.	S	Bend	trans	-40.6	129.9	175.3	-70.5	165.7	158.9	0	0	111.5	R333 S368 M369 Q519 A523	R333-M515 PolarHBondContact NH1-O 3.46Å; S368-M515 WeakPolarHBondContact OG-CE 3.39Å; M369-M515 HydrophobicContact CE-CE 4.1Å; M369-M515 HydrophobicContact CE-CG 4.33Å; M369-M515 HydrophobicContact CG-CE 4.32Å; M369-M515 HydrophobicContact CG-CG 4.3Å; M369-M515 HydrophobicContact SD-CE 4.46Å; M369-M515 HydrophobicContact SD-CG 3.79Å; M515-Q519 HydrophobicContact CB-CB 4.07Å; M515-A523 HydrophobicContact CE-CB 4.33Å; M515-A523 HydrophobicContact SD-CB 4.26Å
516	S	56.2	Low	56.4	Low	47 Å²	47	73.4 Å²	73.4	33%	0.329	38%	0.383	S	S	.	.			trans	-61.7	157.2	179.2	58.4	0	0	0	0	111.1	G514 E518 Q519 E520	G514-S516 PolarHBondContact O-N 2.77Å; S516-E518 PolarHBondContact O-N 2.81Å; S516-E518 VanDerWaalsContact O-N 3.1Å; S516-Q519 CarbonylContact O-C 3.46Å; S516-Q519 WeakPolarHBondContact O-CA 3.2Å; S516-Q519 PolarHBondContact O-N 2.84Å; S516-Q519 PolarHBondContact OG-N 2.9Å; S516-E520 WeakPolarHBondContact O-CG 3.32Å; S516-E520 PolarHBondContact O-N 3.04Å
517	E	51.4	Low	53.8	Low	132 Å²	132	79.8 Å²	79.8	62%	0.617	41%	0.412	S	S	*	.	H	α-helix	trans	-60.9	-22.3	179.5	-62.9	179.4	-176	0	0	112	R329	R329-E517 IonicContact NH1-OE1 3.63Å; R329-E517 PolarHBondContact NH1-OE1 2.81Å
518	E	47.8	Very low	51.9	Low	154 Å²	154	79.9 Å²	79.9	72%	0.72	41%	0.413	S	S	*	.	H	α-helix	trans	-65.4	-54.7	167.3	-60.8	167.4	149.1	0	0	111.1	S516 E520 T521	S516-E518 PolarHBondContact O-N 2.81Å; S516-E518 VanDerWaalsContact O-N 3.1Å; E518-E520 VanDerWaalsContact C-N 3.26Å; E518-E520 PolarHBondContact O-N 2.85Å; E518-T521 PolarHBondContact O-N 3.35Å; E518-T521 PolarHBondContact O-OG1 2.83Å
519	Q	50.4	Low	50.6	Low	38 Å²	38	79 Å²	79	18%	0.178	41%	0.411	C	S	.	.	H	α-helix	trans	-66.1	-23.5	176.2	-71.8	176.3	6.1	0	0	113.6	H372 M515 S516 T521 E522 A523	H372-Q519 PolarHBondContact NE2-NE2 2.85Å; M515-Q519 HydrophobicContact CB-CB 4.07Å; S516-Q519 CarbonylContact O-C 3.46Å; S516-Q519 WeakPolarHBondContact O-CA 3.2Å; S516-Q519 PolarHBondContact O-N 2.84Å; S516-Q519 PolarHBondContact OG-N 2.9Å; Q519-T521 PolarHBondContact O-N 3.34Å; Q519-E522 PolarHBondContact O-N 3.4Å; Q519-A523 VanDerWaalsContact O-CB 3.27Å; Q519-A523 WeakPolarHBondContact O-CB 3.44Å; Q519-A523 PolarHBondContact O-N 2.68Å
520	E	47.9	Very low	49.8	Very low	64 Å²	64	83.5 Å²	83.5	30%	0.299	43%	0.428	S	S	.	.	H	α-helix	trans	-62.3	-29.5	170.9	-71.2	-170.4	154.4	0	0	111.9	R333 S516 E518 F524	R333-E520 WeakPolarHBondContact CD-OE1 3.14Å; R333-E520 IonicContact CZ-OE1 3.17Å; R333-E520 IonicContact NE-OE1 3.04Å; R333-E520 IonicContact NH1-OE1 3.43Å; R333-E520 PolarHBondContact NH1-OE1 2.98Å; S516-E520 WeakPolarHBondContact O-CG 3.32Å; S516-E520 PolarHBondContact O-N 3.04Å; E518-E520 VanDerWaalsContact C-N 3.26Å; E518-E520 PolarHBondContact O-N 2.85Å; E520-F524 WeakPolarHBondContact O-CB 3.39Å
521	T	42.8	Very low	49.4	Very low	81 Å²	81	92 Å²	92	50%	0.497	46%	0.461	S	S	.	.	H	α-helix	trans	-77.7	-35.6	175.5	68.5	0	0	0	0	112.9	E518 Q519	E518-T521 PolarHBondContact O-N 3.35Å; E518-T521 PolarHBondContact O-OG1 2.83Å; Q519-T521 PolarHBondContact O-N 3.34Å
522	E	44.8	Very low	49.5	Very low	146 Å²	146	92.4 Å²	92.4	68%	0.682	47%	0.473	S	S	*	.	H	α-helix	trans	-80.3	-42.9	-178.8	-61.4	-176.1	145.7	0	0	112.8	Q519 F524	Q519-E522 PolarHBondContact O-N 3.4Å; E522-F524 VanDerWaalsContact C-N 3.31Å; E522-F524 PolarHBondContact O-N 3.27Å
523	A	48.3	Very low	50.4	Low	32 Å²	32	90.1 Å²	90.1	26%	0.264	47%	0.465	S	S	.	.	H	α-helix	trans	-78.3	-14.1	-173.3	0	0	0	0	0	114	M515 Q519	M515-A523 HydrophobicContact CE-CB 4.33Å; M515-A523 HydrophobicContact SD-CB 4.26Å; Q519-A523 VanDerWaalsContact O-CB 3.27Å; Q519-A523 WeakPolarHBondContact O-CB 3.44Å; Q519-A523 PolarHBondContact O-N 2.68Å
524	F	49.5	Very low	51.7	Low	76 Å²	76	84.4 Å²	84.4	33%	0.333	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.2	12.2	-167.4	-131.1	-88.5	0	0	0	117.1	F297 N337 E520 E522	F297-F524 HydrophobicContact CD1-CD2 4.27Å; F297-F524 AromaticContact CD1-CE2 3.51Å; F297-F524 HydrophobicContact CD1-CE2 3.51Å; F297-F524 HydrophobicContact CD1-CZ 4.05Å; F297-F524 HydrophobicContact CE1-CD2 4.12Å; F297-F524 HydrophobicContact CE1-CE1 4.21Å; F297-F524 AromaticContact CE1-CE2 3.05Å; F297-F524 HydrophobicContact CE1-CE2 3.05Å; F297-F524 AromaticContact CE1-CZ 3.13Å; F297-F524 HydrophobicContact CE1-CZ 3.13Å; F297-F524 HydrophobicContact CE2-CE2 4.3Å; F297-F524 HydrophobicContact CG-CE2 4.34Å; F297-F524 AromaticContact CZ-CE2 3.51Å; F297-F524 HydrophobicContact CZ-CE2 3.51Å; F297-F524 AromaticContact CZ-CZ 3.43Å; F297-F524 HydrophobicContact CZ-CZ 3.43Å; F297-F524 VanDerWaalsContact CZ-CZ 3.43Å; N337-F524 HydrophobicContact CB-CE1 3.79Å; N337-F524 HydrophobicContact CB-CZ 3.71Å; N337-F524 WeakPolarHBondContact ND2-CE1 3.26Å; E520-F524 WeakPolarHBondContact O-CB 3.39Å; E522-F524 VanDerWaalsContact C-N 3.31Å; E522-F524 PolarHBondContact O-N 3.27Å
525	V	40.1	Very low	53.4	Low	74 Å²	74	89 Å²	89	45%	0.448	45%	0.454	S	S	.	.	S	Bend	trans	-126.2	136	173.7	-169.6	0	0	0	0	109.6	E527 P528	V525-E527 VanDerWaalsContact C-N 3.28Å; V525-E527 PolarHBondContact O-N 2.88Å; V525-P528 HydrophobicContact CB-CB 4.06Å; V525-P528 HydrophobicContact CB-CG 4.05Å; V525-P528 HydrophobicContact CG1-CB 3.91Å; V525-P528 HydrophobicContact CG1-CG 4.36Å; V525-P528 HydrophobicContact CG2-CB 4.28Å; V525-P528 HydrophobicContact CG2-CG 4.43Å
526	E	40.4	Very low	54.8	Low	198 Å²	198	96 Å²	96	93%	0.925	49%	0.486	S	S	*	.	S	Bend	trans	-68.3	90.8	162.8	-69.4	173.4	129.8	0	0	107.2
527	E	32.7	Very low	56.4	Low	137 Å²	137	101.6 Å²	101.6	64%	0.64	51%	0.507	S	S	*	.			trans	33.7	105.6	-163	-76.8	-141	140.1	0	0	115	V525 S529	V525-E527 VanDerWaalsContact C-N 3.28Å; V525-E527 PolarHBondContact O-N 2.88Å; E527-S529 PolarHBondContact O-N 3.34Å
528	P	38.2	Very low	58.4	Low	70 Å²	70	97.3 Å²	97.3	46%	0.455	49%	0.487	S	S	.	.			trans	-69.7	88.8	161.8	29.2	-22	0	0	0	106.2	V525 K530	V525-P528 HydrophobicContact CB-CB 4.06Å; V525-P528 HydrophobicContact CB-CG 4.05Å; V525-P528 HydrophobicContact CG1-CB 3.91Å; V525-P528 HydrophobicContact CG1-CG 4.36Å; V525-P528 HydrophobicContact CG2-CB 4.28Å; V525-P528 HydrophobicContact CG2-CG 4.43Å; P528-K530 PolarHBondContact O-N 3.47Å
529	S	41.6	Very low	60.6	Low	42 Å²	42	93.8 Å²	93.8	29%	0.294	47%	0.468	S	S	.	.			trans	-40.4	112.4	-169.4	-47.5	0	0	0	0	108.9	E527 K531 K535	E527-S529 PolarHBondContact O-N 3.34Å; S529-K531 PolarHBondContact O-N 3.23Å; S529-K531 VanDerWaalsContact O-N 3.13Å; S529-K535 WeakPolarHBondContact OG-CG 3.26Å
530	K	50.6	Low	62.7	Low	152 Å²	152	96.7 Å²	96.7	66%	0.661	48%	0.484	S	S	*	.			trans	-46.2	124.8	-167.1	-61	170.3	-172.4	165.6	0	107.4	P528 G532 A533	P528-K530 PolarHBondContact O-N 3.47Å; K530-G532 CarbonylContact O-C 3.57Å; K530-G532 PolarHBondContact O-N 2.85Å; K530-A533 HydrophobicContact CB-CB 4.11Å; K530-A533 WeakPolarHBondContact O-CB 3.11Å; K530-A533 PolarHBondContact O-N 3.46Å
531	K	53.9	Low	65	Low	224 Å²	224	98.9 Å²	98.9	97%	0.974	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	100.6	-174.2	-73.4	-175.6	179.1	177.3	0	109.4	S529	S529-K531 PolarHBondContact O-N 3.23Å; S529-K531 VanDerWaalsContact O-N 3.13Å
532	G	69.7	Low	67.5	Low	35 Å²	35	95 Å²	95	36%	0.361	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	125.5	-0.9	-162.3	0	0	0	0	0	116.7	K530 E568 A569	K530-G532 CarbonylContact O-C 3.57Å; K530-G532 PolarHBondContact O-N 2.85Å; G532-E568 WeakPolarHBondContact CA-O 3.27Å; G532-A569 VanDerWaalsContact O-CA 3.31Å; G532-A569 WeakPolarHBondContact O-CA 3.28Å
533	A	81.9	Confident	69.9	Low	28 Å²	28	90.5 Å²	90.5	23%	0.231	45%	0.448	C	S	.	.			trans	-126.8	151.1	-176.4	0	0	0	0	0	112.8	K530 E572	K530-A533 HydrophobicContact CB-CB 4.11Å; K530-A533 WeakPolarHBondContact O-CB 3.11Å; K530-A533 PolarHBondContact O-N 3.46Å; A533-E572 WeakPolarHBondContact CA-OE2 3.37Å
534	L	86.2	Confident	72.2	Confident	14 Å²	14	95.9 Å²	95.9	7%	0.073	47%	0.467	C	S	.	.			trans	-72.6	148.7	174.1	-63.4	173.4	0	0	0	110.6	Q538 R539 L542 N566 A569 E572 I573	L534-Q538 HydrophobicContact CB-CB 4.18Å; L534-Q538 HydrophobicContact CD2-CB 4.03Å; L534-R539 HydrophobicContact CB-CB 4.16Å; L534-R539 HydrophobicContact CD1-CB 4.25Å; L534-R539 HydrophobicContact CD1-CG 4.49Å; L534-L542 HydrophobicContact CD1-CD2 3.88Å; L534-N566 HydrophobicContact CD2-CB 4.09Å; L534-A569 HydrophobicContact CD2-CB 3.72Å; L534-A569 HydrophobicContact CG-CB 3.84Å; L534-E572 HydrophobicContact CD1-CG 4.38Å; L534-E572 PolarHBondContact N-OE2 3.39Å; L534-I573 HydrophobicContact CD1-CG1 3.99Å; L534-I573 HydrophobicContact CD2-CD1 4.1Å; L534-I573 HydrophobicContact CD2-CG1 4.07Å; L534-I573 HydrophobicContact CG-CG1 4.29Å
535	K	88.2	Confident	74.4	Confident	115 Å²	115	94.3 Å²	94.3	50%	0.5	46%	0.462	S	S	.	.			trans	-70.4	154.6	159.8	-62.9	168.6	-173.6	175.3	0	109.5	S529 E537 Q538 R539	S529-K535 WeakPolarHBondContact OG-CG 3.26Å; K535-E537 PolarHBondContact O-N 3.36Å; K535-Q538 HydrophobicContact CB-CG 4.43Å; K535-Q538 CarbonylContact O-C 3.55Å; K535-Q538 WeakPolarHBondContact O-CA 3.46Å; K535-Q538 WeakPolarHBondContact O-CB 3.37Å; K535-Q538 PolarHBondContact O-N 2.78Å; K535-R539 PolarHBondContact O-N 3.28Å
536	E	88	Confident	77.1	Confident	157 Å²	157	91 Å²	91	73%	0.734	44%	0.442	S	S	*	.	H	α-helix	trans	-50.5	-44	176.2	-162.1	168.2	-148	0	0	111.9	Q538 R539 D540	E536-Q538 VanDerWaalsContact C-N 3.33Å; E536-Q538 PolarHBondContact O-N 3.05Å; E536-R539 PolarHBondContact O-N 3.08Å; E536-D540 WeakPolarHBondContact O-CB 3.22Å; E536-D540 PolarHBondContact O-N 2.66Å
537	E	90.4	Very high	79.7	Confident	165 Å²	165	89.2 Å²	89.2	77%	0.771	43%	0.427	S	S	*	.	H	α-helix	trans	-59.7	-34.4	173.4	-60.9	-175.3	159.7	0	0	114.6	K535 K541	K535-E537 PolarHBondContact O-N 3.36Å; E537-K541 VanDerWaalsContact O-CB 3.29Å; E537-K541 WeakPolarHBondContact O-CB 3.46Å; E537-K541 PolarHBondContact O-N 2.7Å
538	Q	92.9	Very high	82.7	Confident	41 Å²	41	85 Å²	85	19%	0.192	42%	0.419	C	S	.	.	H	α-helix	trans	-79.3	-35.8	177.7	-68.2	162.5	-76.3	0	0	110.9	L534 K535 E536 K541 L542 F562 N566	L534-Q538 HydrophobicContact CB-CB 4.18Å; L534-Q538 HydrophobicContact CD2-CB 4.03Å; K535-Q538 HydrophobicContact CB-CG 4.43Å; K535-Q538 CarbonylContact O-C 3.55Å; K535-Q538 WeakPolarHBondContact O-CA 3.46Å; K535-Q538 WeakPolarHBondContact O-CB 3.37Å; K535-Q538 PolarHBondContact O-N 2.78Å; E536-Q538 VanDerWaalsContact C-N 3.33Å; E536-Q538 PolarHBondContact O-N 3.05Å; Q538-K541 PolarHBondContact O-N 3.31Å; Q538-L542 PolarHBondContact O-N 3.35Å; Q538-F562 WeakPolarHBondContact O-CZ 3.05Å; Q538-N566 PolarHBondContact NE2-OD1 2.8Å
539	R	94.3	Very high	85.5	Confident	81 Å²	81	81.9 Å²	81.9	31%	0.306	40%	0.399	S	S	.	.	H	α-helix	trans	-67.5	-49	177.4	-169.1	-174.2	177	-68.4	-11.6	111.6	L534 K535 E536 K541 L542 E543 E572	L534-R539 HydrophobicContact CB-CB 4.16Å; L534-R539 HydrophobicContact CD1-CB 4.25Å; L534-R539 HydrophobicContact CD1-CG 4.49Å; K535-R539 PolarHBondContact O-N 3.28Å; E536-R539 PolarHBondContact O-N 3.08Å; R539-K541 VanDerWaalsContact C-N 3.27Å; R539-K541 PolarHBondContact O-N 3.33Å; R539-L542 WeakPolarHBondContact O-CB 3.33Å; R539-L542 PolarHBondContact O-N 2.76Å; R539-L542 VanDerWaalsContact O-N 3.14Å; R539-E543 IonicContact CZ-OE1 2.66Å; R539-E543 IonicContact NH1-OE1 3.58Å; R539-E543 PolarHBondContact NH1-OE1 3.12Å; R539-E543 IonicContact NH2-OE1 3.13Å; R539-E543 PolarHBondContact O-N 3.02Å; R539-E572 WeakPolarHBondContact CD-OE1 3.44Å; R539-E572 IonicContact NE-OE1 3.57Å
540	D	94	Very high	88.1	Confident	98 Å²	98	82 Å²	82	52%	0.524	40%	0.398	S	S	.	.	H	α-helix	trans	-57.3	-41.5	173.3	-84.2	-1.9	0	0	0	111.7	E536 E543 E544	E536-D540 WeakPolarHBondContact O-CB 3.22Å; E536-D540 PolarHBondContact O-N 2.66Å; D540-E543 PolarHBondContact O-N 3.18Å; D540-E544 PolarHBondContact O-N 2.9Å
541	K	95.7	Very high	90.2	Very high	110 Å²	110	77.2 Å²	77.2	48%	0.478	38%	0.383	S	S	.	.	H	α-helix	trans	-67.6	-37.9	176.8	-178.4	172.6	174.3	-178.1	0	112.8	E537 Q538 R539 E544 I545 F562	E537-K541 VanDerWaalsContact O-CB 3.29Å; E537-K541 WeakPolarHBondContact O-CB 3.46Å; E537-K541 PolarHBondContact O-N 2.7Å; Q538-K541 PolarHBondContact O-N 3.31Å; R539-K541 VanDerWaalsContact C-N 3.27Å; R539-K541 PolarHBondContact O-N 3.33Å; K541-E544 PolarHBondContact O-N 2.85Å; K541-I545 HydrophobicContact CG-CD1 4.12Å; K541-I545 WeakPolarHBondContact O-CB 3.4Å; K541-I545 WeakPolarHBondContact O-CD1 3.49Å; K541-I545 VanDerWaalsContact O-CG1 3.25Å; K541-I545 WeakPolarHBondContact O-CG1 3.28Å; K541-I545 PolarHBondContact O-N 3.17Å; K541-F562 HydrophobicContact CD-CD2 4.41Å; K541-F562 HydrophobicContact CD-CE2 3.82Å; K541-F562 HydrophobicContact CG-CE2 4.04Å; K541-F562 HydrophobicContact CG-CZ 4.47Å
542	L	96.4	Very high	92.2	Very high	1 Å²	1	74.8 Å²	74.8	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-62.6	-44.7	172.1	179.4	59.3	0	0	0	110.6	L534 Q538 R539 I545 L546 F562 I573 C576	L534-L542 HydrophobicContact CD1-CD2 3.88Å; Q538-L542 PolarHBondContact O-N 3.35Å; R539-L542 WeakPolarHBondContact O-CB 3.33Å; R539-L542 PolarHBondContact O-N 2.76Å; R539-L542 VanDerWaalsContact O-N 3.14Å; L542-I545 PolarHBondContact O-N 3.08Å; L542-L546 HydrophobicContact CD1-CD1 4.06Å; L542-L546 HydrophobicContact CD1-CG 4.16Å; L542-L546 HydrophobicContact CG-CD1 3.95Å; L542-L546 HydrophobicContact CG-CG 4.45Å; L542-L546 WeakPolarHBondContact O-CB 3.39Å; L542-L546 VanDerWaalsContact O-CG 3.3Å; L542-L546 WeakPolarHBondContact O-CG 3.38Å; L542-L546 PolarHBondContact O-N 3.11Å; L542-F562 HydrophobicContact CB-CE1 3.83Å; L542-F562 HydrophobicContact CB-CZ 4.38Å; L542-F562 HydrophobicContact CD1-CD1 4.05Å; L542-F562 HydrophobicContact CD1-CE1 3.95Å; L542-F562 HydrophobicContact CG-CE1 4.38Å; L542-I573 HydrophobicContact CD2-CB 4.34Å; L542-I573 HydrophobicContact CD2-CG1 4.08Å; L542-I573 HydrophobicContact CD2-CG2 4.27Å; L542-C576 HydrophobicContact CD2-CB 3.67Å; L542-C576 HydrophobicContact CG-CB 4.47Å
543	E	95.4	Very high	93.4	Very high	51 Å²	51	81.5 Å²	81.5	24%	0.238	39%	0.387	C	S	.	.	H	α-helix	trans	-60.6	-43.9	174.4	-77.7	-155.1	-137.8	0	0	112.2	R539 D540 L546 R547	R539-E543 IonicContact CZ-OE1 2.66Å; R539-E543 IonicContact NH1-OE1 3.58Å; R539-E543 PolarHBondContact NH1-OE1 3.12Å; R539-E543 IonicContact NH2-OE1 3.13Å; R539-E543 PolarHBondContact O-N 3.02Å; D540-E543 PolarHBondContact O-N 3.18Å; E543-L546 PolarHBondContact O-N 3.02Å; E543-R547 VanDerWaalsContact O-CB 3.22Å; E543-R547 WeakPolarHBondContact O-CB 3.42Å; E543-R547 VanDerWaalsContact O-CD 3.23Å; E543-R547 WeakPolarHBondContact O-CD 3.22Å; E543-R547 WeakPolarHBondContact O-CG 3.49Å; E543-R547 PolarHBondContact O-N 2.96Å; E543-R547 IonicContact OE2-CZ 3.11Å; E543-R547 IonicContact OE2-NE 3.33Å; E543-R547 PolarHBondContact OE2-NE 2.95Å; E543-R547 IonicContact OE2-NH2 2.66Å; E543-R547 PolarHBondContact OE2-NH2 3.46Å
544	E	95.5	Very high	94.1	Very high	144 Å²	144	86 Å²	86	67%	0.673	41%	0.407	S	S	*	.	H	α-helix	trans	-60.4	-46.4	175.9	-173.1	176.8	-152.3	0	0	111.5	D540 K541 R547 G548	D540-E544 PolarHBondContact O-N 2.9Å; K541-E544 PolarHBondContact O-N 2.85Å; E544-R547 PolarHBondContact O-N 2.65Å; E544-G548 PolarHBondContact O-N 3.21Å
545	I	96.6	Very high	94.6	Very high	43 Å²	43	87.7 Å²	87.7	22%	0.221	42%	0.416	C	S	.	.	H	α-helix	trans	-57.6	-51.8	175	-70.4	165.4	0	0	0	110.1	K541 L542 R547 G548 L549 A559 F562	K541-I545 HydrophobicContact CG-CD1 4.12Å; K541-I545 WeakPolarHBondContact O-CB 3.4Å; K541-I545 WeakPolarHBondContact O-CD1 3.49Å; K541-I545 VanDerWaalsContact O-CG1 3.25Å; K541-I545 WeakPolarHBondContact O-CG1 3.28Å; K541-I545 PolarHBondContact O-N 3.17Å; L542-I545 PolarHBondContact O-N 3.08Å; I545-R547 VanDerWaalsContact C-N 3.28Å; I545-R547 PolarHBondContact O-N 3.27Å; I545-G548 PolarHBondContact O-N 3.23Å; I545-G548 VanDerWaalsContact O-N 3.13Å; I545-L549 WeakPolarHBondContact O-CB 3.49Å; I545-L549 PolarHBondContact O-N 2.79Å; I545-A559 HydrophobicContact CG2-CB 3.51Å; I545-F562 HydrophobicContact CD1-CB 4.02Å; I545-F562 HydrophobicContact CD1-CD1 4.12Å; I545-F562 HydrophobicContact CD1-CD2 3.93Å; I545-F562 HydrophobicContact CD1-CE2 4.49Å; I545-F562 HydrophobicContact CD1-CG 3.73Å
546	L	96.7	Very high	95.1	Very high	5 Å²	5	82.6 Å²	82.6	3%	0.026	39%	0.394	C	S	.	.	H	α-helix	trans	-64.4	-31.2	180	-69.7	173	0	0	0	112.6	L542 E543 I577 R594 L597	L542-L546 HydrophobicContact CD1-CD1 4.06Å; L542-L546 HydrophobicContact CD1-CG 4.16Å; L542-L546 HydrophobicContact CG-CD1 3.95Å; L542-L546 HydrophobicContact CG-CG 4.45Å; L542-L546 WeakPolarHBondContact O-CB 3.39Å; L542-L546 VanDerWaalsContact O-CG 3.3Å; L542-L546 WeakPolarHBondContact O-CG 3.38Å; L542-L546 PolarHBondContact O-N 3.11Å; E543-L546 PolarHBondContact O-N 3.02Å; L546-I577 HydrophobicContact CD1-CG1 4.17Å; L546-I577 HydrophobicContact CD2-CG1 4.11Å; L546-R594 HydrophobicContact CD2-CG 4.26Å; L546-R594 PolarHBondContact O-NE 3.19Å; L546-R594 VanDerWaalsContact O-NE 3.12Å; L546-R594 PolarHBondContact O-NH2 3.29Å; L546-L597 HydrophobicContact CD2-CD2 3.71Å
547	R	95	Very high	95.5	Very high	161 Å²	161	75.9 Å²	75.9	61%	0.608	37%	0.367	S	S	*	.	H	α-helix	trans	-74.1	-34.3	174.1	-71.7	160.7	-173.5	-96.7	3.1	111.5	E543 E544 I545 K590	E543-R547 VanDerWaalsContact O-CB 3.22Å; E543-R547 WeakPolarHBondContact O-CB 3.42Å; E543-R547 VanDerWaalsContact O-CD 3.23Å; E543-R547 WeakPolarHBondContact O-CD 3.22Å; E543-R547 WeakPolarHBondContact O-CG 3.49Å; E543-R547 PolarHBondContact O-N 2.96Å; E543-R547 IonicContact OE2-CZ 3.11Å; E543-R547 IonicContact OE2-NE 3.33Å; E543-R547 PolarHBondContact OE2-NE 2.95Å; E543-R547 IonicContact OE2-NH2 2.66Å; E543-R547 PolarHBondContact OE2-NH2 3.46Å; E544-R547 PolarHBondContact O-N 2.65Å; I545-R547 VanDerWaalsContact C-N 3.28Å; I545-R547 PolarHBondContact O-N 3.27Å; R547-K590 PolarHBondContact O-NZ 2.73Å
548	G	94.9	Very high	95.8	Very high	47 Å²	47	73.6 Å²	73.6	49%	0.485	36%	0.36	S	S	.	.	H	α-helix	trans	-81.4	-31.8	178.8	0	0	0	0	0	115.2	E544 I545	E544-G548 PolarHBondContact O-N 3.21Å; I545-G548 PolarHBondContact O-N 3.23Å; I545-G548 VanDerWaalsContact O-N 3.13Å
549	L	96.7	Very high	96	Very high	6 Å²	6	71.8 Å²	71.8	3%	0.031	35%	0.352	C	S	.	.			trans	-45.9	134	-165.9	-158.8	68.7	0	0	0	115	I545 D555 A559 A593 R594 L597	I545-L549 WeakPolarHBondContact O-CB 3.49Å; I545-L549 PolarHBondContact O-N 2.79Å; L549-D555 HydrophobicContact CD1-CB 4.45Å; L549-D555 WeakPolarHBondContact CD1-O 3.31Å; L549-A559 HydrophobicContact CD1-CB 3.76Å; L549-A593 HydrophobicContact CD2-CB 3.97Å; L549-A593 WeakPolarHBondContact CD2-O 3.34Å; L549-A593 HydrophobicContact CG-CB 3.95Å; L549-R594 HydrophobicContact CD2-CG 4.14Å; L549-L597 HydrophobicContact CD2-CB 4.11Å; L549-L597 HydrophobicContact CD2-CD2 4.12Å
550	T	96.3	Very high	96.2	Very high	45 Å²	45	69 Å²	69	28%	0.276	34%	0.343	S	S	.	.			trans	-123.1	158.1	173.7	97.8	0	0	0	0	110.5	R552 D555 A593	T550-R552 PolarHBondContact O-N 2.79Å; T550-R552 WeakPolarHBondContact OG1-CD 3.44Å; T550-R552 WeakPolarHBondContact OG1-CG 3.23Å; T550-D555 WeakPolarHBondContact CB-OD2 3.33Å; T550-D555 WeakPolarHBondContact CG2-OD2 3.43Å; T550-D555 PolarHBondContact OG1-OD2 2.92Å; T550-A593 VanDerWaalsContact C-CB 3.48Å
551	P	94.9	Very high	96.3	Very high	51 Å²	51	67.7 Å²	67.7	33%	0.331	34%	0.338	S	S	.	.	S	Bend	trans	-78.4	41.2	-176.4	33.6	-36.6	0	0	0	112.8	P589 I592 A593 Y596	P551-P589 HydrophobicContact CG-CB 4.47Å; P551-I592 HydrophobicContact CB-CG2 4.41Å; P551-A593 HydrophobicContact CB-CB 4.11Å; P551-Y596 HydrophobicContact CB-CD2 4.36Å; P551-Y596 HydrophobicContact CB-CE2 4.35Å
552	R	96.4	Very high	96.3	Very high	173 Å²	173	63.5 Å²	63.5	65%	0.653	32%	0.32	S	S	*	.	S	Bend	trans	-100	140.4	174.2	-71.7	172.8	179	-97.2	-2	109	T550 N554 D555 I556	T550-R552 PolarHBondContact O-N 2.79Å; T550-R552 WeakPolarHBondContact OG1-CD 3.44Å; T550-R552 WeakPolarHBondContact OG1-CG 3.23Å; R552-N554 VanDerWaalsContact C-N 3.27Å; R552-N554 PolarHBondContact O-N 2.62Å; R552-D555 HydrophobicContact CB-CB 4.34Å; R552-D555 WeakPolarHBondContact CB-OD1 3.23Å; R552-D555 PolarHBondContact O-N 3.22Å; R552-I556 WeakPolarHBondContact O-CD1 3.23Å; R552-I556 WeakPolarHBondContact O-CG1 3.46Å; R552-I556 PolarHBondContact O-N 2.93Å; R552-I556 VanDerWaalsContact O-N 3.09Å
553	K	95.4	Very high	96.3	Very high	176 Å²	176	63.4 Å²	63.4	77%	0.765	32%	0.32	S	S	*	.	H	α-helix	trans	-55.6	-38.5	-177.2	-174.7	172.5	-178.6	173.9	0	113.6	G557	K553-G557 PolarHBondContact O-N 3.33Å
554	N	96.3	Very high	96.3	Very high	122 Å²	122	62 Å²	62	65%	0.652	31%	0.313	S	S	*	.	H	α-helix	trans	-66.6	-54.4	179.8	-62.5	22.4	0	0	0	110.7	R552 I556 G557 D558	R552-N554 VanDerWaalsContact C-N 3.27Å; R552-N554 PolarHBondContact O-N 2.62Å; N554-I556 VanDerWaalsContact C-N 3.26Å; N554-I556 PolarHBondContact O-N 3.25Å; N554-G557 CarbonylContact O-C 3.46Å; N554-G557 WeakPolarHBondContact O-CA 3.31Å; N554-G557 PolarHBondContact O-N 3.32Å; N554-D558 PolarHBondContact O-N 2.89Å
555	D	96.5	Very high	96.3	Very high	50 Å²	50	61 Å²	61	27%	0.267	31%	0.313	S	S	.	.	H	α-helix	trans	-55.1	-40.4	-179.8	-45.7	22.5	0	0	0	112.2	L549 T550 R552 A559	L549-D555 HydrophobicContact CD1-CB 4.45Å; L549-D555 WeakPolarHBondContact CD1-O 3.31Å; T550-D555 WeakPolarHBondContact CB-OD2 3.33Å; T550-D555 WeakPolarHBondContact CG2-OD2 3.43Å; T550-D555 PolarHBondContact OG1-OD2 2.92Å; R552-D555 HydrophobicContact CB-CB 4.34Å; R552-D555 WeakPolarHBondContact CB-OD1 3.23Å; R552-D555 PolarHBondContact O-N 3.22Å; D555-A559 WeakPolarHBondContact O-CB 3.2Å; D555-A559 PolarHBondContact O-N 3.48Å
556	I	97.8	Very high	96.1	Very high	8 Å²	8	59.7 Å²	59.7	4%	0.041	31%	0.306	C	S	.	.	H	α-helix	trans	-70.5	-43.5	175.8	-61.8	158.6	0	0	0	110.8	R552 N554 A559 M560 Y596 L597 D600	R552-I556 WeakPolarHBondContact O-CD1 3.23Å; R552-I556 WeakPolarHBondContact O-CG1 3.46Å; R552-I556 PolarHBondContact O-N 2.93Å; R552-I556 VanDerWaalsContact O-N 3.09Å; N554-I556 VanDerWaalsContact C-N 3.26Å; N554-I556 PolarHBondContact O-N 3.25Å; I556-A559 PolarHBondContact O-N 3.4Å; I556-M560 WeakPolarHBondContact O-CB 3.5Å; I556-M560 PolarHBondContact O-N 2.81Å; I556-Y596 HydrophobicContact CD1-CD2 3.87Å; I556-Y596 HydrophobicContact CD1-CG 4.31Å; I556-L597 HydrophobicContact CG2-CB 4.5Å; I556-D600 HydrophobicContact CG2-CB 4.12Å; I556-D600 WeakPolarHBondContact CG2-OD2 3.49Å
557	G	97	Very high	96	Very high	16 Å²	16	59.6 Å²	59.6	17%	0.165	31%	0.306	C	S	.	.	H	α-helix	trans	-62.3	-43.4	177.7	0	0	0	0	0	113	K553 N554 A559 M560 V561	K553-G557 PolarHBondContact O-N 3.33Å; N554-G557 CarbonylContact O-C 3.46Å; N554-G557 WeakPolarHBondContact O-CA 3.31Å; N554-G557 PolarHBondContact O-N 3.32Å; G557-A559 VanDerWaalsContact C-N 3.32Å; G557-A559 PolarHBondContact O-N 3.5Å; G557-M560 PolarHBondContact O-N 3.13Å; G557-V561 WeakPolarHBondContact O-CB 3.29Å; G557-V561 VanDerWaalsContact O-CG2 3.29Å; G557-V561 WeakPolarHBondContact O-CG2 3.18Å; G557-V561 PolarHBondContact O-N 3.13Å
558	D	96.9	Very high	95.9	Very high	117 Å²	117	57.7 Å²	57.7	63%	0.626	30%	0.304	S	S	*	.	H	α-helix	trans	-63.5	-38.6	176.4	-69.1	-30.7	0	0	0	111.2	N554 F562	N554-D558 PolarHBondContact O-N 2.89Å; D558-F562 PolarHBondContact O-N 2.76Å
559	A	97.8	Very high	95.8	Very high	3 Å²	3	55.5 Å²	55.5	3%	0.025	28%	0.281	C	S	.	.	H	α-helix	trans	-69.8	-40.5	174.4	0	0	0	0	0	112.8	I545 L549 D555 I556 G557 F562 C563 L597	I545-A559 HydrophobicContact CG2-CB 3.51Å; L549-A559 HydrophobicContact CD1-CB 3.76Å; D555-A559 WeakPolarHBondContact O-CB 3.2Å; D555-A559 PolarHBondContact O-N 3.48Å; I556-A559 PolarHBondContact O-N 3.4Å; G557-A559 VanDerWaalsContact C-N 3.32Å; G557-A559 PolarHBondContact O-N 3.5Å; A559-F562 WeakPolarHBondContact O-CB 3.32Å; A559-F562 PolarHBondContact O-N 3.11Å; A559-C563 PolarHBondContact O-N 3.06Å; A559-C563 PolarHBondContact O-SG 2.72Å; A559-C563 VanDerWaalsContact O-SG 3.39Å; A559-L597 HydrophobicContact CB-CD1 3.73Å; A559-L597 HydrophobicContact CB-CD2 4.04Å
560	M	97.2	Very high	95.8	Very high	23 Å²	23	55.2 Å²	55.2	11%	0.113	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-41.6	175.1	169.8	-81	-62.9	0	0	111.2	I556 G557 F562 C563 L564 L597 D600 V601 N604	I556-M560 WeakPolarHBondContact O-CB 3.5Å; I556-M560 PolarHBondContact O-N 2.81Å; G557-M560 PolarHBondContact O-N 3.13Å; M560-F562 VanDerWaalsContact C-N 3.29Å; M560-F562 PolarHBondContact O-N 3.14Å; M560-C563 WeakPolarHBondContact O-CB 3.35Å; M560-C563 PolarHBondContact O-N 3.01Å; M560-C563 VanDerWaalsContact O-N 3.14Å; M560-L564 WeakPolarHBondContact O-CG 3.43Å; M560-L564 PolarHBondContact O-N 2.74Å; M560-L564 HydrophobicContact SD-CD1 3.43Å; M560-L564 WeakPolarHBondContact SD-CD1 3.31Å; M560-L564 HydrophobicContact SD-CG 4.04Å; M560-L597 HydrophobicContact CB-CD1 3.96Å; M560-D600 HydrophobicContact CB-CB 4.2Å; M560-D600 HydrophobicContact CG-CB 4.08Å; M560-V601 HydrophobicContact CB-CG2 4.08Å; M560-V601 HydrophobicContact CG-CG2 3.94Å; M560-N604 HydrophobicContact SD-CB 4.26Å
561	V	96.2	Very high	95.7	Very high	70 Å²	70	58.3 Å²	58.3	42%	0.424	29%	0.291	S	S	.	.	H	α-helix	trans	-63.3	-35.9	172.8	168.3	0	0	0	0	111	G557 N565	G557-V561 WeakPolarHBondContact O-CB 3.29Å; G557-V561 VanDerWaalsContact O-CG2 3.29Å; G557-V561 WeakPolarHBondContact O-CG2 3.18Å; G557-V561 PolarHBondContact O-N 3.13Å; V561-N565 VanDerWaalsContact CG1-ND2 3.31Å; V561-N565 WeakPolarHBondContact CG1-ND2 3.39Å; V561-N565 WeakPolarHBondContact O-CB 3.43Å; V561-N565 VanDerWaalsContact O-CG 3.28Å; V561-N565 PolarHBondContact O-N 3.39Å; V561-N565 VanDerWaalsContact O-N 3.09Å; V561-N565 PolarHBondContact O-ND2 3.48Å
562	F	96.7	Very high	95.7	Very high	21 Å²	21	58.1 Å²	58.1	9%	0.092	29%	0.286	C	S	.	.	H	α-helix	trans	-61.6	-48.1	169.9	-179.9	-88.6	0	0	0	111.4	Q538 K541 L542 I545 D558 A559 M560 L564 N565 N566	Q538-F562 WeakPolarHBondContact O-CZ 3.05Å; K541-F562 HydrophobicContact CD-CD2 4.41Å; K541-F562 HydrophobicContact CD-CE2 3.82Å; K541-F562 HydrophobicContact CG-CE2 4.04Å; K541-F562 HydrophobicContact CG-CZ 4.47Å; L542-F562 HydrophobicContact CB-CE1 3.83Å; L542-F562 HydrophobicContact CB-CZ 4.38Å; L542-F562 HydrophobicContact CD1-CD1 4.05Å; L542-F562 HydrophobicContact CD1-CE1 3.95Å; L542-F562 HydrophobicContact CG-CE1 4.38Å; I545-F562 HydrophobicContact CD1-CB 4.02Å; I545-F562 HydrophobicContact CD1-CD1 4.12Å; I545-F562 HydrophobicContact CD1-CD2 3.93Å; I545-F562 HydrophobicContact CD1-CE2 4.49Å; I545-F562 HydrophobicContact CD1-CG 3.73Å; D558-F562 PolarHBondContact O-N 2.76Å; A559-F562 WeakPolarHBondContact O-CB 3.32Å; A559-F562 PolarHBondContact O-N 3.11Å; M560-F562 VanDerWaalsContact C-N 3.29Å; M560-F562 PolarHBondContact O-N 3.14Å; F562-L564 PolarHBondContact O-N 3.06Å; F562-N565 PolarHBondContact O-N 2.89Å; F562-N566 WeakPolarHBondContact CE2-ND2 3.45Å; F562-N566 WeakPolarHBondContact CZ-ND2 3.45Å; F562-N566 PolarHBondContact O-N 3.35Å; F562-N566 PolarHBondContact O-ND2 2.99Å
563	C	96.9	Very high	95.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-57.7	-50.3	177	-64.8	0	0	0	0	112.3	A559 M560 N565 N566 A567 I573 V601 Y615	A559-C563 PolarHBondContact O-N 3.06Å; A559-C563 PolarHBondContact O-SG 2.72Å; A559-C563 VanDerWaalsContact O-SG 3.39Å; M560-C563 WeakPolarHBondContact O-CB 3.35Å; M560-C563 PolarHBondContact O-N 3.01Å; M560-C563 VanDerWaalsContact O-N 3.14Å; C563-N565 PolarHBondContact O-N 2.93Å; C563-N566 CarbonylContact O-C 3.5Å; C563-N566 PolarHBondContact O-N 3.11Å; C563-N566 VanDerWaalsContact O-N 3.11Å; C563-A567 PolarHBondContact O-N 2.94Å; C563-A567 VanDerWaalsContact O-N 3.1Å; C563-I573 HydrophobicContact CB-CG2 4.26Å; C563-V601 HydrophobicContact CB-CG1 4.47Å; C563-V601 HydrophobicContact CB-CG2 3.74Å; C563-Y615 VanDerWaalsContact C-OH 3.27Å; C563-Y615 PolarHBondContact O-OH 3.36Å
564	L	94.9	Very high	95.8	Very high	20 Å²	20	41.5 Å²	41.5	11%	0.105	22%	0.219	C	C	.	.	H	α-helix	trans	-63.2	-37.7	-178.7	-65.6	179.9	0	0	0	113.2	M560 F562 N566 A567 N604 A612 Y615	M560-L564 WeakPolarHBondContact O-CG 3.43Å; M560-L564 PolarHBondContact O-N 2.74Å; M560-L564 HydrophobicContact SD-CD1 3.43Å; M560-L564 WeakPolarHBondContact SD-CD1 3.31Å; M560-L564 HydrophobicContact SD-CG 4.04Å; F562-L564 PolarHBondContact O-N 3.06Å; L564-N566 PolarHBondContact O-N 2.75Å; L564-A567 VanDerWaalsContact O-CB 3.31Å; L564-A567 WeakPolarHBondContact O-CB 3.17Å; L564-A567 PolarHBondContact O-N 2.71Å; L564-N604 HydrophobicContact CD1-CB 3.76Å; L564-N604 HydrophobicContact CD2-CB 4.29Å; L564-A612 HydrophobicContact CD2-CB 3.97Å; L564-Y615 HydrophobicContact CD2-CD2 4.46Å; L564-Y615 HydrophobicContact CD2-CE2 4.32Å
565	N	94.3	Very high	95.8	Very high	123 Å²	123	38.1 Å²	38.1	66%	0.658	20%	0.201	S	C	*	.	H	α-helix	trans	-67.8	-19.7	176.8	-76.7	-46.2	0	0	0	113.5	V561 F562 C563	V561-N565 VanDerWaalsContact CG1-ND2 3.31Å; V561-N565 WeakPolarHBondContact CG1-ND2 3.39Å; V561-N565 WeakPolarHBondContact O-CB 3.43Å; V561-N565 VanDerWaalsContact O-CG 3.28Å; V561-N565 PolarHBondContact O-N 3.39Å; V561-N565 VanDerWaalsContact O-N 3.09Å; V561-N565 PolarHBondContact O-ND2 3.48Å; F562-N565 PolarHBondContact O-N 2.89Å; C563-N565 PolarHBondContact O-N 2.93Å
566	N	94.1	Very high	95.8	Very high	16 Å²	16	36.3 Å²	36.3	9%	0.086	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	22.5	177.8	-57.6	-87.2	0	0	0	111.5	L534 Q538 F562 C563 L564 E568 A569 I573	L534-N566 HydrophobicContact CD2-CB 4.09Å; Q538-N566 PolarHBondContact NE2-OD1 2.8Å; F562-N566 WeakPolarHBondContact CE2-ND2 3.45Å; F562-N566 WeakPolarHBondContact CZ-ND2 3.45Å; F562-N566 PolarHBondContact O-N 3.35Å; F562-N566 PolarHBondContact O-ND2 2.99Å; C563-N566 CarbonylContact O-C 3.5Å; C563-N566 PolarHBondContact O-N 3.11Å; C563-N566 VanDerWaalsContact O-N 3.11Å; L564-N566 PolarHBondContact O-N 2.75Å; N566-E568 PolarHBondContact O-N 3.04Å; N566-A569 PolarHBondContact O-N 3.08Å; N566-I573 HydrophobicContact CB-CD1 3.85Å; N566-I573 VanDerWaalsContact O-CD1 3.28Å; N566-I573 WeakPolarHBondContact O-CD1 3.29Å
567	A	93.7	Very high	95.8	Very high	3 Å²	3	35.9 Å²	35.9	3%	0.025	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-61.8	-10.2	-175.2	0	0	0	0	0	114.8	C563 L564 A569 A570 N611 A612 Y615	C563-A567 PolarHBondContact O-N 2.94Å; C563-A567 VanDerWaalsContact O-N 3.1Å; L564-A567 VanDerWaalsContact O-CB 3.31Å; L564-A567 WeakPolarHBondContact O-CB 3.17Å; L564-A567 PolarHBondContact O-N 2.71Å; A567-A569 PolarHBondContact O-N 3.28Å; A567-A570 WeakPolarHBondContact O-CB 3.39Å; A567-A570 PolarHBondContact O-N 2.96Å; A567-N611 HydrophobicContact CB-CB 4.3Å; A567-N611 WeakPolarHBondContact O-CB 3.49Å; A567-A612 HydrophobicContact CB-CB 4.46Å; A567-Y615 HydrophobicContact CB-CE2 3.79Å
568	E	92.2	Very high	95.8	Very high	121 Å²	121	35.7 Å²	35.7	57%	0.565	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-57.6	-34.6	163.9	60.5	-172.8	175.4	0	0	112.7	G532 N566	G532-E568 WeakPolarHBondContact CA-O 3.27Å; N566-E568 PolarHBondContact O-N 3.04Å
569	A	94.1	Very high	95.8	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.008	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-102	35.3	178	0	0	0	0	0	113.4	G532 L534 N566 A567 E571 E572 I573	G532-A569 VanDerWaalsContact O-CA 3.31Å; G532-A569 WeakPolarHBondContact O-CA 3.28Å; L534-A569 HydrophobicContact CD2-CB 3.72Å; L534-A569 HydrophobicContact CG-CB 3.84Å; N566-A569 PolarHBondContact O-N 3.08Å; A567-A569 PolarHBondContact O-N 3.28Å; A569-E571 PolarHBondContact O-N 3.5Å; A569-E572 PolarHBondContact O-N 3.44Å; A569-I573 HydrophobicContact CB-CD1 4.35Å; A569-I573 WeakPolarHBondContact O-CD1 3.24Å; A569-I573 VanDerWaalsContact O-CG1 3.26Å; A569-I573 WeakPolarHBondContact O-CG1 3.4Å; A569-I573 PolarHBondContact O-N 3.11Å
570	A	95.2	Very high	95.7	Very high	1 Å²	1	36 Å²	36	1%	0.008	18%	0.184	C	C	.	.	H	α-helix	trans	-56.4	-34.2	-173.5	0	0	0	0	0	114	A567 V574 Y615 F618	A567-A570 WeakPolarHBondContact O-CB 3.39Å; A567-A570 PolarHBondContact O-N 2.96Å; A570-V574 WeakPolarHBondContact O-CB 3.48Å; A570-V574 VanDerWaalsContact O-CG2 3.25Å; A570-V574 WeakPolarHBondContact O-CG2 3.29Å; A570-V574 PolarHBondContact O-N 3.32Å; A570-Y615 HydrophobicContact CB-CD1 3.91Å; A570-Y615 HydrophobicContact CB-CD2 4.49Å; A570-Y615 HydrophobicContact CB-CE1 3.69Å; A570-Y615 HydrophobicContact CB-CE2 4.31Å; A570-Y615 HydrophobicContact CB-CG 4.29Å; A570-F618 HydrophobicContact CB-CD2 3.88Å; A570-F618 HydrophobicContact CB-CE2 4.11Å
571	E	95.1	Very high	95.7	Very high	109 Å²	109	34.9 Å²	34.9	51%	0.509	18%	0.178	S	C	.	.	H	α-helix	trans	-65.3	-53.5	179.2	-167.3	161.3	-149.8	0	0	111.9	A569 I573 V574 D575 F618	A569-E571 PolarHBondContact O-N 3.5Å; E571-I573 VanDerWaalsContact C-N 3.31Å; E571-I573 PolarHBondContact O-N 3.19Å; E571-V574 PolarHBondContact O-N 2.83Å; E571-D575 PolarHBondContact O-N 3.18Å; E571-F618 HydrophobicContact CB-CD1 4Å; E571-F618 HydrophobicContact CB-CD2 4.04Å; E571-F618 HydrophobicContact CB-CE1 3.77Å; E571-F618 HydrophobicContact CB-CE2 3.8Å; E571-F618 HydrophobicContact CB-CG 4.15Å; E571-F618 HydrophobicContact CB-CZ 3.67Å; E571-F618 HydrophobicContact CG-CD1 3.77Å; E571-F618 HydrophobicContact CG-CE1 3.62Å; E571-F618 HydrophobicContact CG-CG 4.34Å; E571-F618 HydrophobicContact CG-CZ 4.05Å; E571-F618 WeakPolarHBondContact OE1-CE1 3.42Å
572	E	95.2	Very high	95.7	Very high	47 Å²	47	33.7 Å²	33.7	22%	0.22	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-36.3	177.8	-172.2	-176.9	174.9	0	0	112.1	A533 L534 R539 A569 D575 C576	A533-E572 WeakPolarHBondContact CA-OE2 3.37Å; L534-E572 HydrophobicContact CD1-CG 4.38Å; L534-E572 PolarHBondContact N-OE2 3.39Å; R539-E572 WeakPolarHBondContact CD-OE1 3.44Å; R539-E572 IonicContact NE-OE1 3.57Å; A569-E572 PolarHBondContact O-N 3.44Å; E572-D575 PolarHBondContact O-N 3.1Å; E572-C576 WeakPolarHBondContact O-CB 3.49Å; E572-C576 PolarHBondContact O-N 3.02Å; E572-C576 PolarHBondContact O-SG 3.45Å
573	I	96.9	Very high	95.6	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.8	-42.4	175.7	-67.3	165.3	0	0	0	110.7	L534 L542 C563 N566 A569 E571 I577 Y615	L534-I573 HydrophobicContact CD1-CG1 3.99Å; L534-I573 HydrophobicContact CD2-CD1 4.1Å; L534-I573 HydrophobicContact CD2-CG1 4.07Å; L534-I573 HydrophobicContact CG-CG1 4.29Å; L542-I573 HydrophobicContact CD2-CB 4.34Å; L542-I573 HydrophobicContact CD2-CG1 4.08Å; L542-I573 HydrophobicContact CD2-CG2 4.27Å; C563-I573 HydrophobicContact CB-CG2 4.26Å; N566-I573 HydrophobicContact CB-CD1 3.85Å; N566-I573 VanDerWaalsContact O-CD1 3.28Å; N566-I573 WeakPolarHBondContact O-CD1 3.29Å; A569-I573 HydrophobicContact CB-CD1 4.35Å; A569-I573 WeakPolarHBondContact O-CD1 3.24Å; A569-I573 VanDerWaalsContact O-CG1 3.26Å; A569-I573 WeakPolarHBondContact O-CG1 3.4Å; A569-I573 PolarHBondContact O-N 3.11Å; E571-I573 VanDerWaalsContact C-N 3.31Å; E571-I573 PolarHBondContact O-N 3.19Å; I573-I577 HydrophobicContact CG2-CD1 3.93Å; I573-I577 WeakPolarHBondContact O-CD1 3.26Å; I573-I577 VanDerWaalsContact O-CG1 3.23Å; I573-I577 WeakPolarHBondContact O-CG1 3.36Å; I573-I577 PolarHBondContact O-N 3.49Å; I573-Y615 HydrophobicContact CB-CE1 4.16Å; I573-Y615 WeakPolarHBondContact CD1-OH 3.46Å; I573-Y615 HydrophobicContact CG2-CE1 3.9Å
574	V	97.4	Very high	95.4	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-64.8	-40.8	175.6	167.3	0	0	0	0	111.3	A570 E571 I577 T578 Y615 F618 F619 K622	A570-V574 WeakPolarHBondContact O-CB 3.48Å; A570-V574 VanDerWaalsContact O-CG2 3.25Å; A570-V574 WeakPolarHBondContact O-CG2 3.29Å; A570-V574 PolarHBondContact O-N 3.32Å; E571-V574 PolarHBondContact O-N 2.83Å; V574-I577 PolarHBondContact O-N 3.48Å; V574-T578 WeakPolarHBondContact O-CB 3.43Å; V574-T578 PolarHBondContact O-N 2.78Å; V574-T578 PolarHBondContact O-OG1 2.77Å; V574-Y615 HydrophobicContact CG2-CD1 3.77Å; V574-Y615 HydrophobicContact CG2-CE1 4.22Å; V574-F618 HydrophobicContact CB-CB 4.17Å; V574-F618 HydrophobicContact CG1-CB 4.29Å; V574-F618 HydrophobicContact CG2-CB 3.89Å; V574-F619 HydrophobicContact CB-CD1 4.42Å; V574-F619 HydrophobicContact CB-CE1 4.25Å; V574-F619 HydrophobicContact CG1-CD1 3.69Å; V574-F619 HydrophobicContact CG1-CE1 3.87Å; V574-F619 HydrophobicContact CG1-CG 4.28Å; V574-F619 HydrophobicContact CG2-CD1 3.97Å; V574-F619 HydrophobicContact CG2-CD2 3.97Å; V574-F619 HydrophobicContact CG2-CE1 3.82Å; V574-F619 HydrophobicContact CG2-CE2 3.83Å; V574-F619 HydrophobicContact CG2-CG 4.03Å; V574-F619 HydrophobicContact CG2-CZ 3.76Å; V574-K622 HydrophobicContact CG1-CB 4.27Å; V574-K622 HydrophobicContact CG1-CG 3.92Å
575	D	96.6	Very high	95.4	Very high	50 Å²	50	50.3 Å²	50.3	27%	0.267	25%	0.252	S	S	.	.	H	α-helix	trans	-67.6	-44.4	177.6	-86.7	-18.1	0	0	0	112.4	E571 E572 I577 T578 E579 K622	E571-D575 PolarHBondContact O-N 3.18Å; E572-D575 PolarHBondContact O-N 3.1Å; D575-I577 VanDerWaalsContact C-N 3.27Å; D575-I577 PolarHBondContact O-N 2.97Å; D575-T578 PolarHBondContact O-N 3.15Å; D575-T578 VanDerWaalsContact O-N 3.07Å; D575-E579 WeakPolarHBondContact O-CG 3.42Å; D575-E579 PolarHBondContact O-N 3.08Å; D575-K622 VanDerWaalsContact CG-NZ 3.28Å; D575-K622 WeakPolarHBondContact OD1-CD 3.45Å; D575-K622 WeakPolarHBondContact OD1-CE 3.41Å; D575-K622 IonicContact OD1-NZ 2.69Å; D575-K622 PolarHBondContact OD1-NZ 3.39Å; D575-K622 IonicContact OD2-NZ 2.68Å; D575-K622 PolarHBondContact OD2-NZ 3.03Å; D575-K622 VanDerWaalsContact OD2-NZ 3.13Å
576	C	96	Very high	95.3	Very high	12 Å²	12	45.3 Å²	45.3	8%	0.081	23%	0.225	C	C	.	.	H	α-helix	trans	-57.6	-38.8	172.6	-74.2	0	0	0	0	112.4	L542 E572 S580	L542-C576 HydrophobicContact CD2-CB 3.67Å; L542-C576 HydrophobicContact CG-CB 4.47Å; E572-C576 WeakPolarHBondContact O-CB 3.49Å; E572-C576 PolarHBondContact O-N 3.02Å; E572-C576 PolarHBondContact O-SG 3.45Å; C576-S580 VanDerWaalsContact O-CB 3.3Å; C576-S580 WeakPolarHBondContact O-CB 3.36Å; C576-S580 PolarHBondContact O-N 3.45Å; C576-S580 VanDerWaalsContact O-N 3.1Å
577	I	97.5	Very high	95.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.7	-42.4	174.9	-68.8	166.1	0	0	0	110.9	L546 I573 V574 D575 S580 L581 L597 V598 F619	L546-I577 HydrophobicContact CD1-CG1 4.17Å; L546-I577 HydrophobicContact CD2-CG1 4.11Å; I573-I577 HydrophobicContact CG2-CD1 3.93Å; I573-I577 WeakPolarHBondContact O-CD1 3.26Å; I573-I577 VanDerWaalsContact O-CG1 3.23Å; I573-I577 WeakPolarHBondContact O-CG1 3.36Å; I573-I577 PolarHBondContact O-N 3.49Å; V574-I577 PolarHBondContact O-N 3.48Å; D575-I577 VanDerWaalsContact C-N 3.27Å; D575-I577 PolarHBondContact O-N 2.97Å; I577-S580 PolarHBondContact O-N 3.09Å; I577-S580 PolarHBondContact O-OG 2.96Å; I577-L581 HydrophobicContact CG2-CD1 4.08Å; I577-L581 WeakPolarHBondContact O-CG 3.46Å; I577-L581 PolarHBondContact O-N 3.15Å; I577-L597 HydrophobicContact CD1-CD2 4.29Å; I577-V598 HydrophobicContact CG2-CG2 3.53Å; I577-F619 HydrophobicContact CD1-CZ 4.19Å; I577-F619 HydrophobicContact CG2-CE1 4.37Å
578	T	97.2	Very high	95.4	Very high	11 Å²	11	50.5 Å²	50.5	7%	0.067	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-50	179.6	-58.5	0	0	0	0	111.7	V574 D575 S580 L581 S582 K622 Q625 I626	V574-T578 WeakPolarHBondContact O-CB 3.43Å; V574-T578 PolarHBondContact O-N 2.78Å; V574-T578 PolarHBondContact O-OG1 2.77Å; D575-T578 PolarHBondContact O-N 3.15Å; D575-T578 VanDerWaalsContact O-N 3.07Å; T578-S580 VanDerWaalsContact C-N 3.27Å; T578-S580 PolarHBondContact O-N 3.44Å; T578-L581 WeakPolarHBondContact O-CA 3.21Å; T578-L581 WeakPolarHBondContact O-CB 3.46Å; T578-L581 PolarHBondContact O-N 2.88Å; T578-S582 PolarHBondContact O-N 3.27Å; T578-K622 HydrophobicContact CG2-CB 4.45Å; T578-Q625 HydrophobicContact CG2-CG 4.5Å; T578-I626 HydrophobicContact CG2-CG1 3.95Å
579	E	96.6	Very high	95.5	Very high	116 Å²	116	48.5 Å²	48.5	54%	0.542	25%	0.254	S	S	.	.	H	α-helix	trans	-57.9	-39.7	172.7	-71	-176.6	-180	0	0	111.6	D575 L581 S582 I583	D575-E579 WeakPolarHBondContact O-CG 3.42Å; D575-E579 PolarHBondContact O-N 3.08Å; E579-L581 PolarHBondContact O-N 3.38Å; E579-S582 PolarHBondContact O-N 3.5Å; E579-S582 PolarHBondContact O-OG 3.3Å; E579-S582 VanDerWaalsContact O-OG 3.06Å; E579-I583 WeakPolarHBondContact O-CG1 3.32Å
580	S	96.5	Very high	95.7	Very high	11 Å²	11	51.8 Å²	51.8	8%	0.077	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-27.9	175.4	88.7	0	0	0	0	112.6	C576 I577 T578 R594	C576-S580 VanDerWaalsContact O-CB 3.3Å; C576-S580 WeakPolarHBondContact O-CB 3.36Å; C576-S580 PolarHBondContact O-N 3.45Å; C576-S580 VanDerWaalsContact O-N 3.1Å; I577-S580 PolarHBondContact O-N 3.09Å; I577-S580 PolarHBondContact O-OG 2.96Å; T578-S580 VanDerWaalsContact C-N 3.27Å; T578-S580 PolarHBondContact O-N 3.44Å; S580-R594 PolarHBondContact O-NH1 3.43Å; S580-R594 WeakPolarHBondContact OG-CD 3.47Å
581	L	96.7	Very high	95.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-81.1	-34.5	177.8	-77.3	165.2	0	0	0	112.3	I577 T578 E579 I583 K591 R594 V598 I626	I577-L581 HydrophobicContact CG2-CD1 4.08Å; I577-L581 WeakPolarHBondContact O-CG 3.46Å; I577-L581 PolarHBondContact O-N 3.15Å; T578-L581 WeakPolarHBondContact O-CA 3.21Å; T578-L581 WeakPolarHBondContact O-CB 3.46Å; T578-L581 PolarHBondContact O-N 2.88Å; E579-L581 PolarHBondContact O-N 3.38Å; L581-I583 VanDerWaalsContact C-N 3.35Å; L581-I583 PolarHBondContact O-N 3.01Å; L581-K591 PolarHBondContact O-NZ 2.64Å; L581-R594 HydrophobicContact CD2-CB 3.61Å; L581-R594 HydrophobicContact CG-CB 4.07Å; L581-V598 HydrophobicContact CD1-CG2 4.15Å; L581-I626 HydrophobicContact CD1-CD1 4.44Å; L581-I626 HydrophobicContact CD1-CG1 4.3Å; L581-I626 HydrophobicContact CD1-CG2 3.88Å
582	S	95.9	Very high	95.8	Very high	45 Å²	45	46.8 Å²	46.8	32%	0.315	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-32.9	180	74.6	0	0	0	0	113.6	T578 E579 L584 D629	T578-S582 PolarHBondContact O-N 3.27Å; E579-S582 PolarHBondContact O-N 3.5Å; E579-S582 PolarHBondContact O-OG 3.3Å; E579-S582 VanDerWaalsContact O-OG 3.06Å; S582-L584 PolarHBondContact O-N 3.17Å; S582-D629 VanDerWaalsContact CA-CG 3.5Å; S582-D629 WeakPolarHBondContact CB-OD2 3.3Å
583	I	95.4	Very high	95.9	Very high	90 Å²	90	44.5 Å²	44.5	46%	0.462	24%	0.235	S	C	.	.			trans	-57.7	97.7	-179.5	-61.1	163.2	0	0	0	111.5	E579 L581 K585 T586 K591	E579-I583 WeakPolarHBondContact O-CG1 3.32Å; L581-I583 VanDerWaalsContact C-N 3.35Å; L581-I583 PolarHBondContact O-N 3.01Å; I583-K585 HydrophobicContact CG2-CB 4.27Å; I583-K585 PolarHBondContact O-N 3.1Å; I583-T586 VanDerWaalsContact O-CB 3.3Å; I583-T586 WeakPolarHBondContact O-CB 3.48Å; I583-T586 PolarHBondContact O-N 3.16Å; I583-T586 PolarHBondContact O-OG1 2.79Å; I583-T586 VanDerWaalsContact O-OG1 3.09Å; I583-K591 WeakPolarHBondContact O-CE 3.41Å; I583-K591 PolarHBondContact O-NZ 2.99Å
584	L	92.6	Very high	96	Very high	98 Å²	98	45.2 Å²	45.2	51%	0.513	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-31.3	-179.1	-66.4	176.1	0	0	0	113.1	S582 T586 A632	S582-L584 PolarHBondContact O-N 3.17Å; L584-T586 PolarHBondContact O-N 3.03Å; L584-A632 HydrophobicContact CD2-CB 4Å
585	K	93.8	Very high	96	Very high	202 Å²	202	45.2 Å²	45.2	88%	0.878	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-7	177.6	-64.8	176.2	-178.5	170.9	0	114	I583	I583-K585 HydrophobicContact CG2-CB 4.27Å; I583-K585 PolarHBondContact O-N 3.1Å
586	T	93.5	Very high	96.1	Very high	17 Å²	17	45 Å²	45	10%	0.104	23%	0.233	C	C	.	.	S	Bend	trans	-72.4	127.3	178	-60.1	0	0	0	0	110.9	I583 L584 K590 K591 R594	I583-T586 VanDerWaalsContact O-CB 3.3Å; I583-T586 WeakPolarHBondContact O-CB 3.48Å; I583-T586 PolarHBondContact O-N 3.16Å; I583-T586 PolarHBondContact O-OG1 2.79Å; I583-T586 VanDerWaalsContact O-OG1 3.09Å; L584-T586 PolarHBondContact O-N 3.03Å; T586-K590 HydrophobicContact CG2-CB 3.75Å; T586-K591 HydrophobicContact CG2-CG 3.87Å; T586-R594 VanDerWaalsContact CG2-NH1 3.33Å; T586-R594 PolarHBondContact OG1-NH1 3.45Å
587	P	94.6	Very high	96.2	Very high	80 Å²	80	44.5 Å²	44.5	52%	0.519	23%	0.229	S	C	.	.			trans	-56.1	140.5	178.2	-27.1	35.2	0	0	0	113.9	P589 K590 K591	P587-P589 VanDerWaalsContact C-CD 3.44Å; P587-P589 VanDerWaalsContact O-N 3.16Å; P587-K590 WeakPolarHBondContact O-CA 3.34Å; P587-K590 WeakPolarHBondContact O-CB 3.44Å; P587-K590 PolarHBondContact O-N 3.09Å; P587-K591 PolarHBondContact O-N 2.9Å; P587-K591 VanDerWaalsContact O-N 3.17Å
588	L	94.7	Very high	96.2	Very high	48 Å²	48	44.5 Å²	44.5	25%	0.251	23%	0.229	S	C	.	.	H	α-helix	trans	-49.1	-43.5	-176.1	-53.9	177	0	0	0	114.5	K590 K591 I592 T633 I637 F646	L588-K590 PolarHBondContact O-N 3.29Å; L588-K591 PolarHBondContact O-N 3.02Å; L588-I592 WeakPolarHBondContact O-CG1 3.47Å; L588-I592 PolarHBondContact O-N 3.46Å; L588-T633 HydrophobicContact CD2-CG2 3.68Å; L588-I637 HydrophobicContact CD1-CD1 3.76Å; L588-I637 HydrophobicContact CD1-CG1 3.88Å; L588-I637 HydrophobicContact CD1-CG2 4.2Å; L588-I637 HydrophobicContact CD2-CD1 3.77Å; L588-I637 HydrophobicContact CD2-CG1 3.89Å; L588-I637 HydrophobicContact CG-CD1 4.41Å; L588-F646 HydrophobicContact CB-CD2 4.32Å; L588-F646 HydrophobicContact CD2-CD2 4.23Å; L588-F646 HydrophobicContact CD2-CE2 4.22Å
589	P	94.9	Very high	96.2	Very high	79 Å²	79	44.3 Å²	44.3	51%	0.513	23%	0.229	S	C	.	.	H	α-helix	trans	-63.2	-27.5	178.3	-22.7	35.3	0	0	0	113.7	P551 P587 A593	P551-P589 HydrophobicContact CG-CB 4.47Å; P587-P589 VanDerWaalsContact C-CD 3.44Å; P587-P589 VanDerWaalsContact O-N 3.16Å; P589-A593 WeakPolarHBondContact O-CB 3.46Å; P589-A593 PolarHBondContact O-N 3.42Å
590	K	96.5	Very high	96.2	Very high	70 Å²	70	41 Å²	41	30%	0.304	21%	0.214	S	C	.	.	H	α-helix	trans	-81.3	-37.4	176.4	-65.5	-164	172.5	-175.3	0	112.3	R547 T586 P587 L588 I592 A593 R594	R547-K590 PolarHBondContact O-NZ 2.73Å; T586-K590 HydrophobicContact CG2-CB 3.75Å; P587-K590 WeakPolarHBondContact O-CA 3.34Å; P587-K590 WeakPolarHBondContact O-CB 3.44Å; P587-K590 PolarHBondContact O-N 3.09Å; L588-K590 PolarHBondContact O-N 3.29Å; K590-I592 VanDerWaalsContact C-N 3.33Å; K590-A593 PolarHBondContact O-N 2.9Å; K590-R594 WeakPolarHBondContact O-CB 3.34Å; K590-R594 VanDerWaalsContact O-CG 3.28Å; K590-R594 WeakPolarHBondContact O-CG 3.3Å; K590-R594 PolarHBondContact O-N 3.39Å
591	K	96.5	Very high	96.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.5	-43.3	170	-76.7	-179	175.4	-100.4	0	111.1	L581 I583 T586 P587 L588 R594 L595 T633 F646	L581-K591 PolarHBondContact O-NZ 2.64Å; I583-K591 WeakPolarHBondContact O-CE 3.41Å; I583-K591 PolarHBondContact O-NZ 2.99Å; T586-K591 HydrophobicContact CG2-CG 3.87Å; P587-K591 PolarHBondContact O-N 2.9Å; P587-K591 VanDerWaalsContact O-N 3.17Å; L588-K591 PolarHBondContact O-N 3.02Å; K591-R594 PolarHBondContact O-N 2.79Å; K591-L595 PolarHBondContact O-N 3.5Å; K591-T633 HydrophobicContact CD-CG2 3.43Å; K591-T633 VanDerWaalsContact CD-CG2 3.43Å; K591-T633 WeakPolarHBondContact CE-OG1 3.46Å; K591-T633 PolarHBondContact NZ-OG1 3.05Å; K591-F646 HydrophobicContact CB-CE2 4.38Å
592	I	97.2	Very high	96.3	Very high	5 Å²	5	40.5 Å²	40.5	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-45.1	172	-69.7	-58.7	0	0	0	112.1	P551 L588 K590 R594 L595 Y596 F646 R649 V650	P551-I592 HydrophobicContact CB-CG2 4.41Å; L588-I592 WeakPolarHBondContact O-CG1 3.47Å; L588-I592 PolarHBondContact O-N 3.46Å; K590-I592 VanDerWaalsContact C-N 3.33Å; I592-R594 VanDerWaalsContact C-N 3.32Å; I592-R594 PolarHBondContact O-N 3.35Å; I592-L595 PolarHBondContact O-N 3.09Å; I592-Y596 HydrophobicContact CG2-CD2 4.03Å; I592-Y596 HydrophobicContact CG2-CE1 4.14Å; I592-Y596 HydrophobicContact CG2-CE2 3.53Å; I592-Y596 PolarHBondContact O-N 2.86Å; I592-F646 HydrophobicContact CD1-CD2 3.65Å; I592-F646 HydrophobicContact CD1-CE2 3.71Å; I592-F646 HydrophobicContact CD1-CG 4.41Å; I592-F646 HydrophobicContact CG1-CD2 3.81Å; I592-F646 HydrophobicContact CG1-CE2 3.93Å; I592-R649 HydrophobicContact CD1-CB 3.78Å; I592-V650 HydrophobicContact CD1-CG2 4.2Å
593	A	97.8	Very high	96.3	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-61.9	-38.8	177.9	0	0	0	0	0	112.7	L549 T550 P551 P589 K590 Y596 L597	L549-A593 HydrophobicContact CD2-CB 3.97Å; L549-A593 WeakPolarHBondContact CD2-O 3.34Å; L549-A593 HydrophobicContact CG-CB 3.95Å; T550-A593 VanDerWaalsContact C-CB 3.48Å; P551-A593 HydrophobicContact CB-CB 4.11Å; P589-A593 WeakPolarHBondContact O-CB 3.46Å; P589-A593 PolarHBondContact O-N 3.42Å; K590-A593 PolarHBondContact O-N 2.9Å; A593-Y596 PolarHBondContact O-N 2.74Å; A593-L597 PolarHBondContact O-N 3.41Å
594	R	97.8	Very high	96.3	Very high	15 Å²	15	41.8 Å²	41.8	6%	0.057	21%	0.207	C	C	.	.	H	α-helix	trans	-66.4	-39.3	174.7	-71.4	164.6	179.4	-178.7	1.1	111.9	L546 L549 S580 L581 T586 K590 K591 I592 L597 V598	L546-R594 HydrophobicContact CD2-CG 4.26Å; L546-R594 PolarHBondContact O-NE 3.19Å; L546-R594 VanDerWaalsContact O-NE 3.12Å; L546-R594 PolarHBondContact O-NH2 3.29Å; L549-R594 HydrophobicContact CD2-CG 4.14Å; S580-R594 PolarHBondContact O-NH1 3.43Å; S580-R594 WeakPolarHBondContact OG-CD 3.47Å; L581-R594 HydrophobicContact CD2-CB 3.61Å; L581-R594 HydrophobicContact CG-CB 4.07Å; T586-R594 VanDerWaalsContact CG2-NH1 3.33Å; T586-R594 PolarHBondContact OG1-NH1 3.45Å; K590-R594 WeakPolarHBondContact O-CB 3.34Å; K590-R594 VanDerWaalsContact O-CG 3.28Å; K590-R594 WeakPolarHBondContact O-CG 3.3Å; K590-R594 PolarHBondContact O-N 3.39Å; K591-R594 PolarHBondContact O-N 2.79Å; I592-R594 VanDerWaalsContact C-N 3.32Å; I592-R594 PolarHBondContact O-N 3.35Å; R594-L597 WeakPolarHBondContact O-CB 3.38Å; R594-L597 PolarHBondContact O-N 3Å; R594-V598 WeakPolarHBondContact O-CG2 3.45Å; R594-V598 PolarHBondContact O-N 3.35Å
595	L	97.6	Very high	96.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.4	-38.2	172.4	-179.5	61.8	0	0	0	112.3	K591 I592 L597 V598 S599 F627 L630 V650 C653 W657	K591-L595 PolarHBondContact O-N 3.5Å; I592-L595 PolarHBondContact O-N 3.09Å; L595-L597 VanDerWaalsContact C-N 3.33Å; L595-V598 WeakPolarHBondContact O-CB 3.24Å; L595-V598 PolarHBondContact O-N 2.92Å; L595-S599 PolarHBondContact O-N 2.94Å; L595-F627 HydrophobicContact CD1-CE1 4.49Å; L595-F627 HydrophobicContact CD1-CZ 4.38Å; L595-L630 HydrophobicContact CD1-CD1 4.18Å; L595-L630 HydrophobicContact CD2-CD1 4.09Å; L595-V650 HydrophobicContact CD2-CB 4.25Å; L595-V650 HydrophobicContact CD2-CG1 4.13Å; L595-V650 HydrophobicContact CD2-CG2 3.84Å; L595-C653 HydrophobicContact CD2-CB 4.47Å; L595-W657 HydrophobicContact CD1-CH2 4.39Å; L595-W657 HydrophobicContact CD1-CZ2 4.42Å
596	Y	98.1	Very high	96.2	Very high	47 Å²	47	33 Å²	33	18%	0.184	18%	0.179	C	C	.	.	H	α-helix	trans	-66.8	-33.4	172.8	-64.5	-18	0	0	0	112.2	P551 I556 I592 A593 S599 D600 R649	P551-Y596 HydrophobicContact CB-CD2 4.36Å; P551-Y596 HydrophobicContact CB-CE2 4.35Å; I556-Y596 HydrophobicContact CD1-CD2 3.87Å; I556-Y596 HydrophobicContact CD1-CG 4.31Å; I592-Y596 HydrophobicContact CG2-CD2 4.03Å; I592-Y596 HydrophobicContact CG2-CE1 4.14Å; I592-Y596 HydrophobicContact CG2-CE2 3.53Å; I592-Y596 PolarHBondContact O-N 2.86Å; A593-Y596 PolarHBondContact O-N 2.74Å; Y596-S599 WeakPolarHBondContact O-CB 3.11Å; Y596-S599 PolarHBondContact O-N 3Å; Y596-D600 WeakPolarHBondContact O-CB 3.49Å; Y596-D600 PolarHBondContact O-N 3.05Å; Y596-R649 WeakPolarHBondContact OH-CG 3.32Å
597	L	98.3	Very high	96	Very high	1 Å²	1	34 Å²	34	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-63.5	-43.2	170.1	176.1	61.4	0	0	0	112.2	L546 L549 I556 A559 M560 I577 A593 R594 L595 S599 D600 V601	L546-L597 HydrophobicContact CD2-CD2 3.71Å; L549-L597 HydrophobicContact CD2-CB 4.11Å; L549-L597 HydrophobicContact CD2-CD2 4.12Å; I556-L597 HydrophobicContact CG2-CB 4.5Å; A559-L597 HydrophobicContact CB-CD1 3.73Å; A559-L597 HydrophobicContact CB-CD2 4.04Å; M560-L597 HydrophobicContact CB-CD1 3.96Å; I577-L597 HydrophobicContact CD1-CD2 4.29Å; A593-L597 PolarHBondContact O-N 3.41Å; R594-L597 WeakPolarHBondContact O-CB 3.38Å; R594-L597 PolarHBondContact O-N 3Å; L595-L597 VanDerWaalsContact C-N 3.33Å; L597-S599 VanDerWaalsContact C-N 3.3Å; L597-S599 PolarHBondContact O-N 3.03Å; L597-D600 PolarHBondContact O-N 3.08Å; L597-V601 HydrophobicContact CD1-CG2 3.86Å; L597-V601 HydrophobicContact CG-CG2 4.45Å; L597-V601 WeakPolarHBondContact O-CB 3.27Å; L597-V601 VanDerWaalsContact O-CG2 3.28Å; L597-V601 WeakPolarHBondContact O-CG2 3.27Å; L597-V601 PolarHBondContact O-N 3.17Å
598	V	98	Very high	95.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-56.6	-46.8	171.4	174.3	0	0	0	0	110.3	I577 L581 R594 L595 V601 L602 F619 L623 W657	I577-V598 HydrophobicContact CG2-CG2 3.53Å; L581-V598 HydrophobicContact CD1-CG2 4.15Å; R594-V598 WeakPolarHBondContact O-CG2 3.45Å; R594-V598 PolarHBondContact O-N 3.35Å; L595-V598 WeakPolarHBondContact O-CB 3.24Å; L595-V598 PolarHBondContact O-N 2.92Å; V598-V601 PolarHBondContact O-N 3.12Å; V598-L602 HydrophobicContact CG1-CD1 3.8Å; V598-L602 HydrophobicContact CG1-CG 4.33Å; V598-L602 VanDerWaalsContact O-CB 3.29Å; V598-L602 WeakPolarHBondContact O-CB 3.34Å; V598-L602 VanDerWaalsContact O-CG 3.3Å; V598-L602 WeakPolarHBondContact O-CG 3.26Å; V598-L602 PolarHBondContact O-N 3.32Å; V598-F619 HydrophobicContact CB-CE1 4.28Å; V598-F619 HydrophobicContact CB-CZ 4.24Å; V598-F619 HydrophobicContact CG1-CD1 3.97Å; V598-F619 HydrophobicContact CG1-CD2 4.46Å; V598-F619 HydrophobicContact CG1-CE1 3.81Å; V598-F619 HydrophobicContact CG1-CE2 4.31Å; V598-F619 HydrophobicContact CG1-CG 4.31Å; V598-F619 HydrophobicContact CG1-CZ 3.99Å; V598-F619 HydrophobicContact CG2-CE1 3.71Å; V598-F619 HydrophobicContact CG2-CZ 3.92Å; V598-L623 HydrophobicContact CG1-CD2 4.42Å; V598-W657 HydrophobicContact CG1-CH2 4.18Å; V598-W657 HydrophobicContact CG1-CZ2 4.15Å
599	S	97	Very high	95.5	Very high	7 Å²	7	41.5 Å²	41.5	5%	0.049	22%	0.217	C	C	.	.	H	α-helix	trans	-61.4	-46.4	179.4	-168.4	0	0	0	0	113.3	L595 Y596 L597 L602 Y603 W657 W660	L595-S599 PolarHBondContact O-N 2.94Å; Y596-S599 WeakPolarHBondContact O-CB 3.11Å; Y596-S599 PolarHBondContact O-N 3Å; L597-S599 VanDerWaalsContact C-N 3.3Å; L597-S599 PolarHBondContact O-N 3.03Å; S599-L602 PolarHBondContact O-N 2.93Å; S599-Y603 WeakPolarHBondContact O-CB 3.49Å; S599-Y603 PolarHBondContact O-N 3.15Å; S599-W657 PolarHBondContact OG-NE1 3.03Å; S599-W660 WeakPolarHBondContact OG-CZ3 3.38Å
600	D	97.2	Very high	95.2	Very high	46 Å²	46	41.4 Å²	41.4	25%	0.246	22%	0.223	C	C	.	.	H	α-helix	trans	-70.8	-35.5	-179.6	-82.3	22.8	0	0	0	111.7	I556 M560 Y596 L597 N604	I556-D600 HydrophobicContact CG2-CB 4.12Å; I556-D600 WeakPolarHBondContact CG2-OD2 3.49Å; M560-D600 HydrophobicContact CB-CB 4.2Å; M560-D600 HydrophobicContact CG-CB 4.08Å; Y596-D600 WeakPolarHBondContact O-CB 3.49Å; Y596-D600 PolarHBondContact O-N 3.05Å; L597-D600 PolarHBondContact O-N 3.08Å; D600-N604 PolarHBondContact O-N 2.99Å; D600-N604 VanDerWaalsContact O-N 3.14Å; D600-N604 PolarHBondContact O-ND2 2.83Å
601	V	97.4	Very high	94.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-69.6	-40.1	173.3	173.8	0	0	0	0	111.2	M560 C563 L597 V598 N604 S605 Y615 F619	M560-V601 HydrophobicContact CB-CG2 4.08Å; M560-V601 HydrophobicContact CG-CG2 3.94Å; C563-V601 HydrophobicContact CB-CG1 4.47Å; C563-V601 HydrophobicContact CB-CG2 3.74Å; L597-V601 HydrophobicContact CD1-CG2 3.86Å; L597-V601 HydrophobicContact CG-CG2 4.45Å; L597-V601 WeakPolarHBondContact O-CB 3.27Å; L597-V601 VanDerWaalsContact O-CG2 3.28Å; L597-V601 WeakPolarHBondContact O-CG2 3.27Å; L597-V601 PolarHBondContact O-N 3.17Å; V598-V601 PolarHBondContact O-N 3.12Å; V601-N604 CarbonylContact O-C 3.58Å; V601-N604 PolarHBondContact O-N 3.1Å; V601-S605 PolarHBondContact O-N 2.94Å; V601-Y615 HydrophobicContact CG1-CD1 3.74Å; V601-Y615 HydrophobicContact CG1-CD2 3.67Å; V601-Y615 HydrophobicContact CG1-CE1 4.1Å; V601-Y615 HydrophobicContact CG1-CE2 4.03Å; V601-Y615 HydrophobicContact CG1-CG 3.53Å; V601-F619 HydrophobicContact CB-CE2 4.35Å; V601-F619 HydrophobicContact CG1-CE2 3.96Å
602	L	97	Very high	94.8	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-46.7	174.8	-81.8	174	0	0	0	111.9	V598 S599 N604 S605 F619 W657 I662 Y663	V598-L602 HydrophobicContact CG1-CD1 3.8Å; V598-L602 HydrophobicContact CG1-CG 4.33Å; V598-L602 VanDerWaalsContact O-CB 3.29Å; V598-L602 WeakPolarHBondContact O-CB 3.34Å; V598-L602 VanDerWaalsContact O-CG 3.3Å; V598-L602 WeakPolarHBondContact O-CG 3.26Å; V598-L602 PolarHBondContact O-N 3.32Å; S599-L602 PolarHBondContact O-N 2.93Å; L602-N604 VanDerWaalsContact C-N 3.33Å; L602-N604 PolarHBondContact O-N 3.24Å; L602-S605 VanDerWaalsContact O-CB 3.3Å; L602-S605 WeakPolarHBondContact O-CB 3.34Å; L602-S605 PolarHBondContact O-N 3.15Å; L602-S605 VanDerWaalsContact O-N 3.13Å; L602-S605 PolarHBondContact O-OG 2.89Å; L602-F619 HydrophobicContact CD2-CB 3.97Å; L602-F619 HydrophobicContact CD2-CD2 3.67Å; L602-F619 HydrophobicContact CD2-CG 4.19Å; L602-F619 HydrophobicContact CG-CD2 3.83Å; L602-F619 HydrophobicContact CG-CE2 4.38Å; L602-F619 HydrophobicContact CG-CG 4.41Å; L602-W657 HydrophobicContact CD1-CD2 4.31Å; L602-W657 HydrophobicContact CD1-CE3 4.45Å; L602-W657 HydrophobicContact CD1-CH2 3.93Å; L602-W657 HydrophobicContact CD1-CZ2 3.77Å; L602-W657 HydrophobicContact CD1-CZ3 4.26Å; L602-I662 HydrophobicContact CB-CD1 4.07Å; L602-I662 HydrophobicContact CB-CG2 4.27Å; L602-I662 HydrophobicContact CD2-CG2 4.17Å; L602-Y663 HydrophobicContact CD1-CE2 4.15Å; L602-Y663 HydrophobicContact CD2-CE2 4.13Å; L602-Y663 WeakPolarHBondContact CD2-OH 3.28Å
603	Y	96.1	Very high	94.6	Very high	118 Å²	118	44.2 Å²	44.2	46%	0.463	25%	0.247	S	C	.	.	H	α-helix	trans	-56.7	-47.5	175.6	-178.1	-104.2	0	0	0	111.8	S599 S605 S606 W660	S599-Y603 WeakPolarHBondContact O-CB 3.49Å; S599-Y603 PolarHBondContact O-N 3.15Å; Y603-S605 VanDerWaalsContact C-N 3.29Å; Y603-S605 PolarHBondContact O-N 3.33Å; Y603-S606 PolarHBondContact O-OG 3.03Å; Y603-W660 HydrophobicContact CD2-CB 4.45Å; Y603-W660 AromaticContact CD2-CD2 3.42Å; Y603-W660 HydrophobicContact CD2-CD2 3.42Å; Y603-W660 VanDerWaalsContact CD2-CD2 3.42Å; Y603-W660 AromaticContact CD2-CE2 3.67Å; Y603-W660 AromaticContact CD2-CE3 3.67Å; Y603-W660 HydrophobicContact CD2-CE3 3.67Å; Y603-W660 AromaticContact CD2-CG 3.8Å; Y603-W660 HydrophobicContact CD2-CG 3.8Å; Y603-W660 HydrophobicContact CD2-CH2 4.23Å; Y603-W660 HydrophobicContact CD2-CZ2 4.07Å; Y603-W660 HydrophobicContact CD2-CZ3 4.05Å; Y603-W660 AromaticContact CE2-CD1 3.99Å; Y603-W660 AromaticContact CE2-CD2 3.93Å; Y603-W660 HydrophobicContact CE2-CD2 3.93Å; Y603-W660 AromaticContact CE2-CE2 3.86Å; Y603-W660 AromaticContact CE2-CG 3.99Å; Y603-W660 HydrophobicContact CE2-CG 3.99Å; Y603-W660 HydrophobicContact CE2-CZ2 4.4Å; Y603-W660 AromaticContact CE2-NE1 3.92Å; Y603-W660 HydrophobicContact CG-CD2 4.4Å; Y603-W660 HydrophobicContact CG-CE3 4.28Å; Y603-W660 HydrophobicContact CG-CH2 4.41Å; Y603-W660 HydrophobicContact CG-CZ3 4.27Å
604	N	95.6	Very high	94.4	Very high	44 Å²	44	49.8 Å²	49.8	24%	0.235	27%	0.269	C	S	.	.	H	α-helix	trans	-81	0.7	179.6	-66.8	-84.2	0	0	0	114.3	M560 L564 D600 V601 L602 S606 A607	M560-N604 HydrophobicContact SD-CB 4.26Å; L564-N604 HydrophobicContact CD1-CB 3.76Å; L564-N604 HydrophobicContact CD2-CB 4.29Å; D600-N604 PolarHBondContact O-N 2.99Å; D600-N604 VanDerWaalsContact O-N 3.14Å; D600-N604 PolarHBondContact O-ND2 2.83Å; V601-N604 CarbonylContact O-C 3.58Å; V601-N604 PolarHBondContact O-N 3.1Å; L602-N604 VanDerWaalsContact C-N 3.33Å; L602-N604 PolarHBondContact O-N 3.24Å; N604-S606 PolarHBondContact O-N 3.08Å; N604-A607 WeakPolarHBondContact O-CB 3.49Å; N604-A607 PolarHBondContact O-N 2.69Å
605	S	93.7	Very high	94.4	Very high	11 Å²	11	49 Å²	49	8%	0.077	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.3	172.3	71.3	0	0	0	0	112.6	V601 L602 Y603 A607 A612 S613	V601-S605 PolarHBondContact O-N 2.94Å; L602-S605 VanDerWaalsContact O-CB 3.3Å; L602-S605 WeakPolarHBondContact O-CB 3.34Å; L602-S605 PolarHBondContact O-N 3.15Å; L602-S605 VanDerWaalsContact O-N 3.13Å; L602-S605 PolarHBondContact O-OG 2.89Å; Y603-S605 VanDerWaalsContact C-N 3.29Å; Y603-S605 PolarHBondContact O-N 3.33Å; S605-A607 VanDerWaalsContact C-N 3.33Å; S605-A612 WeakPolarHBondContact CA-O 3.4Å; S605-A612 WeakPolarHBondContact CB-O 3.21Å; S605-A612 CarbonylContact O-C 3.59Å; S605-S613 WeakPolarHBondContact O-CA 3.41Å; S605-S613 PolarHBondContact O-N 2.88Å
606	S	89.9	Confident	94.3	Very high	104 Å²	104	54.3 Å²	54.3	73%	0.727	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-6.8	172.4	66.4	0	0	0	0	114.5	Y603 N604	Y603-S606 PolarHBondContact O-OG 3.03Å; N604-S606 PolarHBondContact O-N 3.08Å
607	A	89.1	Confident	94.1	Very high	37 Å²	37	58.5 Å²	58.5	31%	0.306	31%	0.305	S	S	.	.	S	Bend	trans	-68.5	157.5	-177.9	0	0	0	0	0	112.2	N604 S605 V609	N604-A607 WeakPolarHBondContact O-CB 3.49Å; N604-A607 PolarHBondContact O-N 2.69Å; S605-A607 VanDerWaalsContact C-N 3.33Å; A607-V609 HydrophobicContact CB-CG2 4.31Å; A607-V609 PolarHBondContact O-N 3.37Å
608	K	90.1	Very high	94.1	Very high	223 Å²	223	60.3 Å²	60.3	97%	0.97	31%	0.313	S	S	*	.	S	Bend	trans	-77.4	47	178.7	-61.7	-175.6	179.3	-178.6	0	112.8
609	V	88.8	Confident	94	Very high	63 Å²	63	60.3 Å²	60.3	38%	0.382	31%	0.313	S	S	.	.	S	Bend	trans	-109.5	134.1	176.2	179	0	0	0	0	107.8	A607 N611 A612	A607-V609 HydrophobicContact CB-CG2 4.31Å; A607-V609 PolarHBondContact O-N 3.37Å; V609-N611 PolarHBondContact O-N 3.29Å; V609-A612 HydrophobicContact CB-CB 3.92Å; V609-A612 HydrophobicContact CG1-CB 4.29Å; V609-A612 WeakPolarHBondContact O-CB 3.43Å; V609-A612 PolarHBondContact O-N 3.08Å
610	A	88.6	Confident	94	Very high	78 Å²	78	63.7 Å²	63.7	65%	0.645	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	140.6	178.6	0	0	0	0	0	110.7	A612	A610-A612 PolarHBondContact O-N 3.03Å
611	N	90.4	Very high	93.9	Very high	59 Å²	59	66.3 Å²	66.3	32%	0.316	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	-7.3	179.2	-51.9	-24	0	0	0	116.4	A567 V609 S613 Y614	A567-N611 HydrophobicContact CB-CB 4.3Å; A567-N611 WeakPolarHBondContact O-CB 3.49Å; V609-N611 PolarHBondContact O-N 3.29Å; N611-S613 PolarHBondContact O-N 3.44Å; N611-Y614 HydrophobicContact CB-CD2 3.68Å; N611-Y614 HydrophobicContact CB-CE2 3.81Å; N611-Y614 VanDerWaalsContact O-CB 3.31Å; N611-Y614 WeakPolarHBondContact O-CB 3.4Å; N611-Y614 WeakPolarHBondContact O-CD2 3.44Å; N611-Y614 PolarHBondContact O-N 2.85Å
612	A	94.2	Very high	93.9	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-28.4	-178.8	0	0	0	0	0	113.6	L564 A567 S605 V609 A610 Y614 Y615	L564-A612 HydrophobicContact CD2-CB 3.97Å; A567-A612 HydrophobicContact CB-CB 4.46Å; S605-A612 WeakPolarHBondContact CA-O 3.4Å; S605-A612 WeakPolarHBondContact CB-O 3.21Å; S605-A612 CarbonylContact O-C 3.59Å; V609-A612 HydrophobicContact CB-CB 3.92Å; V609-A612 HydrophobicContact CG1-CB 4.29Å; V609-A612 WeakPolarHBondContact O-CB 3.43Å; V609-A612 PolarHBondContact O-N 3.08Å; A610-A612 PolarHBondContact O-N 3.03Å; A612-Y614 PolarHBondContact O-N 2.83Å; A612-Y615 WeakPolarHBondContact O-CB 3.45Å; A612-Y615 WeakPolarHBondContact O-CD2 3.33Å; A612-Y615 PolarHBondContact O-N 2.97Å
613	S	93.7	Very high	93.9	Very high	75 Å²	75	69.2 Å²	69.2	52%	0.524	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.9	174.1	54.1	0	0	0	0	113.6	S605 N611 Y615 R616	S605-S613 WeakPolarHBondContact O-CA 3.41Å; S605-S613 PolarHBondContact O-N 2.88Å; N611-S613 PolarHBondContact O-N 3.44Å; S613-Y615 PolarHBondContact O-N 3.33Å; S613-R616 PolarHBondContact O-N 2.95Å
614	Y	94.5	Very high	93.9	Very high	116 Å²	116	65 Å²	65	46%	0.455	35%	0.346	S	S	.	.	H	α-helix	trans	-67.6	-23.7	176.3	-58.9	-34.6	0	0	0	112.8	N611 A612 R616 K617 F618	N611-Y614 HydrophobicContact CB-CD2 3.68Å; N611-Y614 HydrophobicContact CB-CE2 3.81Å; N611-Y614 VanDerWaalsContact O-CB 3.31Å; N611-Y614 WeakPolarHBondContact O-CB 3.4Å; N611-Y614 WeakPolarHBondContact O-CD2 3.44Å; N611-Y614 PolarHBondContact O-N 2.85Å; A612-Y614 PolarHBondContact O-N 2.83Å; Y614-R616 PolarHBondContact O-N 2.94Å; Y614-K617 PolarHBondContact O-N 3.27Å; Y614-K617 VanDerWaalsContact O-N 3.14Å; Y614-F618 HydrophobicContact CG-CE2 4.38Å; Y614-F618 WeakPolarHBondContact O-CD2 3.31Å; Y614-F618 PolarHBondContact O-N 3.47Å
615	Y	97.3	Very high	93.9	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-57.1	-38.1	174.1	-77.2	-61.3	0	0	0	112.4	C563 L564 A567 A570 I573 V574 V601 A612 S613 K617 F618 F619	C563-Y615 VanDerWaalsContact C-OH 3.27Å; C563-Y615 PolarHBondContact O-OH 3.36Å; L564-Y615 HydrophobicContact CD2-CD2 4.46Å; L564-Y615 HydrophobicContact CD2-CE2 4.32Å; A567-Y615 HydrophobicContact CB-CE2 3.79Å; A570-Y615 HydrophobicContact CB-CD1 3.91Å; A570-Y615 HydrophobicContact CB-CD2 4.49Å; A570-Y615 HydrophobicContact CB-CE1 3.69Å; A570-Y615 HydrophobicContact CB-CE2 4.31Å; A570-Y615 HydrophobicContact CB-CG 4.29Å; I573-Y615 HydrophobicContact CB-CE1 4.16Å; I573-Y615 WeakPolarHBondContact CD1-OH 3.46Å; I573-Y615 HydrophobicContact CG2-CE1 3.9Å; V574-Y615 HydrophobicContact CG2-CD1 3.77Å; V574-Y615 HydrophobicContact CG2-CE1 4.22Å; V601-Y615 HydrophobicContact CG1-CD1 3.74Å; V601-Y615 HydrophobicContact CG1-CD2 3.67Å; V601-Y615 HydrophobicContact CG1-CE1 4.1Å; V601-Y615 HydrophobicContact CG1-CE2 4.03Å; V601-Y615 HydrophobicContact CG1-CG 3.53Å; A612-Y615 WeakPolarHBondContact O-CB 3.45Å; A612-Y615 WeakPolarHBondContact O-CD2 3.33Å; A612-Y615 PolarHBondContact O-N 2.97Å; S613-Y615 PolarHBondContact O-N 3.33Å; Y615-K617 PolarHBondContact O-N 3.36Å; Y615-F618 PolarHBondContact O-N 3.05Å; Y615-F619 HydrophobicContact CD1-CE2 4.14Å; Y615-F619 WeakPolarHBondContact O-CB 3.28Å; Y615-F619 VanDerWaalsContact O-CD2 3.25Å; Y615-F619 WeakPolarHBondContact O-CD2 3.25Å; Y615-F619 PolarHBondContact O-N 2.93Å
616	R	95.5	Very high	94.1	Very high	110 Å²	110	66.7 Å²	66.7	42%	0.415	35%	0.351	S	S	.	.	H	α-helix	trans	-60	-48	176.5	-168.5	-177.3	-172.8	-170.7	5.8	110.9	S613 Y614 E620 A661 I662 Y663	S613-R616 PolarHBondContact O-N 2.95Å; Y614-R616 PolarHBondContact O-N 2.94Å; R616-E620 WeakPolarHBondContact O-CB 3.32Å; R616-E620 PolarHBondContact O-N 2.87Å; R616-E620 VanDerWaalsContact O-N 3.1Å; R616-A661 PolarHBondContact NH2-O 2.9Å; R616-I662 PolarHBondContact NE-O 3.43Å; R616-I662 PolarHBondContact NH2-O 2.93Å; R616-Y663 HydrophobicContact CG-CE1 3.92Å; R616-Y663 PolarHBondContact O-OH 3.46Å
617	K	94.6	Very high	94.4	Very high	136 Å²	136	61.8 Å²	61.8	59%	0.591	32%	0.317	S	S	*	.	H	α-helix	trans	-65.4	-44.9	178.8	-175.7	-174.4	177.1	-172.9	0	112.6	Y614 Y615 E620	Y614-K617 PolarHBondContact O-N 3.27Å; Y614-K617 VanDerWaalsContact O-N 3.14Å; Y615-K617 PolarHBondContact O-N 3.36Å; K617-E620 WeakPolarHBondContact O-CB 3.45Å; K617-E620 PolarHBondContact O-N 3.46Å
618	F	96.5	Very high	94.7	Very high	38 Å²	38	62.1 Å²	62.1	17%	0.167	32%	0.317	C	S	.	.	H	α-helix	trans	-74.2	-34.9	-176.7	-68.6	-53.4	0	0	0	112.7	A570 E571 V574 Y614 Y615 T621 K622	A570-F618 HydrophobicContact CB-CD2 3.88Å; A570-F618 HydrophobicContact CB-CE2 4.11Å; E571-F618 HydrophobicContact CB-CD1 4Å; E571-F618 HydrophobicContact CB-CD2 4.04Å; E571-F618 HydrophobicContact CB-CE1 3.77Å; E571-F618 HydrophobicContact CB-CE2 3.8Å; E571-F618 HydrophobicContact CB-CG 4.15Å; E571-F618 HydrophobicContact CB-CZ 3.67Å; E571-F618 HydrophobicContact CG-CD1 3.77Å; E571-F618 HydrophobicContact CG-CE1 3.62Å; E571-F618 HydrophobicContact CG-CG 4.34Å; E571-F618 HydrophobicContact CG-CZ 4.05Å; E571-F618 WeakPolarHBondContact OE1-CE1 3.42Å; V574-F618 HydrophobicContact CB-CB 4.17Å; V574-F618 HydrophobicContact CG1-CB 4.29Å; V574-F618 HydrophobicContact CG2-CB 3.89Å; Y614-F618 HydrophobicContact CG-CE2 4.38Å; Y614-F618 WeakPolarHBondContact O-CD2 3.31Å; Y614-F618 PolarHBondContact O-N 3.47Å; Y615-F618 PolarHBondContact O-N 3.05Å; F618-T621 PolarHBondContact O-OG1 3.04Å; F618-K622 WeakPolarHBondContact O-CG 3.39Å
619	F	97.7	Very high	95	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-67.2	-38.7	170.4	-81	-57.5	0	0	0	111.5	V574 I577 V598 V601 L602 Y615 T621 K622 L623 I626	V574-F619 HydrophobicContact CB-CD1 4.42Å; V574-F619 HydrophobicContact CB-CE1 4.25Å; V574-F619 HydrophobicContact CG1-CD1 3.69Å; V574-F619 HydrophobicContact CG1-CE1 3.87Å; V574-F619 HydrophobicContact CG1-CG 4.28Å; V574-F619 HydrophobicContact CG2-CD1 3.97Å; V574-F619 HydrophobicContact CG2-CD2 3.97Å; V574-F619 HydrophobicContact CG2-CE1 3.82Å; V574-F619 HydrophobicContact CG2-CE2 3.83Å; V574-F619 HydrophobicContact CG2-CG 4.03Å; V574-F619 HydrophobicContact CG2-CZ 3.76Å; I577-F619 HydrophobicContact CD1-CZ 4.19Å; I577-F619 HydrophobicContact CG2-CE1 4.37Å; V598-F619 HydrophobicContact CB-CE1 4.28Å; V598-F619 HydrophobicContact CB-CZ 4.24Å; V598-F619 HydrophobicContact CG1-CD1 3.97Å; V598-F619 HydrophobicContact CG1-CD2 4.46Å; V598-F619 HydrophobicContact CG1-CE1 3.81Å; V598-F619 HydrophobicContact CG1-CE2 4.31Å; V598-F619 HydrophobicContact CG1-CG 4.31Å; V598-F619 HydrophobicContact CG1-CZ 3.99Å; V598-F619 HydrophobicContact CG2-CE1 3.71Å; V598-F619 HydrophobicContact CG2-CZ 3.92Å; V601-F619 HydrophobicContact CB-CE2 4.35Å; V601-F619 HydrophobicContact CG1-CE2 3.96Å; L602-F619 HydrophobicContact CD2-CB 3.97Å; L602-F619 HydrophobicContact CD2-CD2 3.67Å; L602-F619 HydrophobicContact CD2-CG 4.19Å; L602-F619 HydrophobicContact CG-CD2 3.83Å; L602-F619 HydrophobicContact CG-CE2 4.38Å; L602-F619 HydrophobicContact CG-CG 4.41Å; Y615-F619 HydrophobicContact CD1-CE2 4.14Å; Y615-F619 WeakPolarHBondContact O-CB 3.28Å; Y615-F619 VanDerWaalsContact O-CD2 3.25Å; Y615-F619 WeakPolarHBondContact O-CD2 3.25Å; Y615-F619 PolarHBondContact O-N 2.93Å; F619-T621 VanDerWaalsContact C-N 3.27Å; F619-T621 PolarHBondContact O-N 3.1Å; F619-K622 CarbonylContact O-C 3.57Å; F619-K622 WeakPolarHBondContact O-CA 3.39Å; F619-K622 PolarHBondContact O-N 3.43Å; F619-L623 HydrophobicContact CB-CD1 4.27Å; F619-L623 HydrophobicContact CB-CG 4.22Å; F619-L623 WeakPolarHBondContact O-CB 3.49Å; F619-L623 WeakPolarHBondContact O-CG 3.41Å; F619-L623 PolarHBondContact O-N 3.49Å; F619-I626 HydrophobicContact CD1-CD1 4.23Å
620	E	96.1	Very high	95.4	Very high	78 Å²	78	49.5 Å²	49.5	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-51.5	-43.8	-179.1	-163.9	161.5	-162.2	0	0	112.9	R616 K617 K622 Y663 F667	R616-E620 WeakPolarHBondContact O-CB 3.32Å; R616-E620 PolarHBondContact O-N 2.87Å; R616-E620 VanDerWaalsContact O-N 3.1Å; K617-E620 WeakPolarHBondContact O-CB 3.45Å; K617-E620 PolarHBondContact O-N 3.46Å; E620-K622 VanDerWaalsContact C-N 3.3Å; E620-K622 PolarHBondContact O-N 2.9Å; E620-Y663 HydrophobicContact CB-CE1 3.77Å; E620-Y663 HydrophobicContact CG-CD1 4.25Å; E620-Y663 HydrophobicContact CG-CE1 3.76Å; E620-Y663 PolarHBondContact N-OH 2.94Å; E620-F667 HydrophobicContact CG-CE1 4.4Å; E620-F667 HydrophobicContact CG-CE2 4.48Å; E620-F667 HydrophobicContact CG-CZ 3.98Å
621	T	96	Very high	95.7	Very high	102 Å²	102	46.5 Å²	46.5	63%	0.626	23%	0.231	S	C	*	.	H	α-helix	trans	-74.6	-14.1	178	64.4	0	0	0	0	114.5	F618 F619	F618-T621 PolarHBondContact O-OG1 3.04Å; F619-T621 VanDerWaalsContact C-N 3.27Å; F619-T621 PolarHBondContact O-N 3.1Å
622	K	96.5	Very high	95.9	Very high	61 Å²	61	45.5 Å²	45.5	27%	0.265	23%	0.231	S	C	.	.	H	α-helix	trans	-112	-17.3	-176	-55.9	-75.3	171.4	151.6	0	113.1	V574 D575 T578 F618 F619 E620 C624 Q625 I626	V574-K622 HydrophobicContact CG1-CB 4.27Å; V574-K622 HydrophobicContact CG1-CG 3.92Å; D575-K622 VanDerWaalsContact CG-NZ 3.28Å; D575-K622 WeakPolarHBondContact OD1-CD 3.45Å; D575-K622 WeakPolarHBondContact OD1-CE 3.41Å; D575-K622 IonicContact OD1-NZ 2.69Å; D575-K622 PolarHBondContact OD1-NZ 3.39Å; D575-K622 IonicContact OD2-NZ 2.68Å; D575-K622 PolarHBondContact OD2-NZ 3.03Å; D575-K622 VanDerWaalsContact OD2-NZ 3.13Å; T578-K622 HydrophobicContact CG2-CB 4.45Å; F618-K622 WeakPolarHBondContact O-CG 3.39Å; F619-K622 CarbonylContact O-C 3.57Å; F619-K622 WeakPolarHBondContact O-CA 3.39Å; F619-K622 PolarHBondContact O-N 3.43Å; E620-K622 VanDerWaalsContact C-N 3.3Å; E620-K622 PolarHBondContact O-N 2.9Å; K622-C624 VanDerWaalsContact C-N 3.34Å; K622-C624 PolarHBondContact O-N 2.96Å; K622-Q625 WeakPolarHBondContact O-CB 3.45Å; K622-Q625 PolarHBondContact O-N 3.42Å; K622-Q625 VanDerWaalsContact O-N 3.1Å; K622-I626 HydrophobicContact CB-CD1 4.38Å; K622-I626 WeakPolarHBondContact O-CG1 3.32Å; K622-I626 PolarHBondContact O-N 3.1Å
623	L	96.9	Very high	95.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62.4	-36.6	-175.2	-81.4	168.8	0	0	0	112.9	V598 F619 Q625 I626 F627 W657 Y663 F667 L671	V598-L623 HydrophobicContact CG1-CD2 4.42Å; F619-L623 HydrophobicContact CB-CD1 4.27Å; F619-L623 HydrophobicContact CB-CG 4.22Å; F619-L623 WeakPolarHBondContact O-CB 3.49Å; F619-L623 WeakPolarHBondContact O-CG 3.41Å; F619-L623 PolarHBondContact O-N 3.49Å; L623-Q625 VanDerWaalsContact C-N 3.33Å; L623-Q625 PolarHBondContact O-N 3.47Å; L623-I626 HydrophobicContact CD2-CD1 4.26Å; L623-I626 PolarHBondContact O-N 2.9Å; L623-F627 HydrophobicContact CD2-CD2 4.46Å; L623-F627 HydrophobicContact CD2-CE2 3.9Å; L623-F627 VanDerWaalsContact O-CD2 3.26Å; L623-F627 WeakPolarHBondContact O-CD2 3.34Å; L623-F627 PolarHBondContact O-N 3.12Å; L623-W657 HydrophobicContact CD1-CZ3 4.16Å; L623-W657 HydrophobicContact CD2-CH2 3.68Å; L623-W657 HydrophobicContact CD2-CZ3 3.75Å; L623-Y663 HydrophobicContact CD1-CD2 4.19Å; L623-Y663 HydrophobicContact CD1-CE2 3.42Å; L623-Y663 VanDerWaalsContact CD1-CE2 3.42Å; L623-F667 HydrophobicContact CB-CZ 4.49Å; L623-F667 HydrophobicContact CD1-CE1 4.15Å; L623-L671 HydrophobicContact CB-CD1 3.79Å; L623-L671 HydrophobicContact CB-CD2 4.05Å; L623-L671 HydrophobicContact CD1-CD1 4.1Å; L623-L671 HydrophobicContact CG-CD1 4.44Å
624	C	96.2	Very high	96	Very high	30 Å²	30	44.9 Å²	44.9	20%	0.203	22%	0.218	C	C	.	.	H	α-helix	trans	-57.3	-46.9	173	-63.4	0	0	0	0	111.4	K622 F627 S628 L671 I674 I681	K622-C624 VanDerWaalsContact C-N 3.34Å; K622-C624 PolarHBondContact O-N 2.96Å; C624-F627 PolarHBondContact O-N 3.4Å; C624-S628 PolarHBondContact O-N 2.88Å; C624-L671 HydrophobicContact CB-CD2 4.35Å; C624-I674 HydrophobicContact CB-CD1 4.1Å; C624-I681 HydrophobicContact CB-CD1 4.19Å; C624-I681 VanDerWaalsContact O-CD1 3.29Å; C624-I681 WeakPolarHBondContact O-CD1 3.42Å
625	Q	95.4	Very high	96	Very high	91 Å²	91	47 Å²	47	43%	0.425	23%	0.225	S	C	.	.	H	α-helix	trans	-64	-46.9	176	179.7	57.3	42.6	0	0	111.5	T578 K622 L623 F627 S628 D629	T578-Q625 HydrophobicContact CG2-CG 4.5Å; K622-Q625 WeakPolarHBondContact O-CB 3.45Å; K622-Q625 PolarHBondContact O-N 3.42Å; K622-Q625 VanDerWaalsContact O-N 3.1Å; L623-Q625 VanDerWaalsContact C-N 3.33Å; L623-Q625 PolarHBondContact O-N 3.47Å; Q625-F627 VanDerWaalsContact C-N 3.3Å; Q625-F627 PolarHBondContact O-N 3.38Å; Q625-S628 VanDerWaalsContact O-CB 3.3Å; Q625-S628 WeakPolarHBondContact O-CB 3.39Å; Q625-S628 PolarHBondContact O-N 2.87Å; Q625-S628 VanDerWaalsContact O-N 3.11Å; Q625-D629 VanDerWaalsContact NE2-CG 3.26Å; Q625-D629 PolarHBondContact NE2-OD1 2.99Å; Q625-D629 PolarHBondContact NE2-OD2 2.84Å; Q625-D629 PolarHBondContact O-N 2.92Å
626	I	97.3	Very high	95.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-54.9	-45	177.8	-70.5	167	0	0	0	111.3	T578 L581 F619 K622 L623 D629 L630	T578-I626 HydrophobicContact CG2-CG1 3.95Å; L581-I626 HydrophobicContact CD1-CD1 4.44Å; L581-I626 HydrophobicContact CD1-CG1 4.3Å; L581-I626 HydrophobicContact CD1-CG2 3.88Å; F619-I626 HydrophobicContact CD1-CD1 4.23Å; K622-I626 HydrophobicContact CB-CD1 4.38Å; K622-I626 WeakPolarHBondContact O-CG1 3.32Å; K622-I626 PolarHBondContact O-N 3.1Å; L623-I626 HydrophobicContact CD2-CD1 4.26Å; L623-I626 PolarHBondContact O-N 2.9Å; I626-D629 PolarHBondContact O-N 3.17Å; I626-L630 HydrophobicContact CG2-CD1 3.88Å; I626-L630 HydrophobicContact CG2-CG 4.49Å; I626-L630 WeakPolarHBondContact O-CB 3.46Å; I626-L630 VanDerWaalsContact O-CG 3.24Å; I626-L630 WeakPolarHBondContact O-CG 3.5Å; I626-L630 PolarHBondContact O-N 3.12Å
627	F	97.3	Very high	95.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-75.2	-25.9	179.8	-76.3	-64.8	0	0	0	113.8	L595 L623 C624 Q625 L630 N631 V650 F654 W657 L671 I674 F675	L595-F627 HydrophobicContact CD1-CE1 4.49Å; L595-F627 HydrophobicContact CD1-CZ 4.38Å; L623-F627 HydrophobicContact CD2-CD2 4.46Å; L623-F627 HydrophobicContact CD2-CE2 3.9Å; L623-F627 VanDerWaalsContact O-CD2 3.26Å; L623-F627 WeakPolarHBondContact O-CD2 3.34Å; L623-F627 PolarHBondContact O-N 3.12Å; C624-F627 PolarHBondContact O-N 3.4Å; Q625-F627 VanDerWaalsContact C-N 3.3Å; Q625-F627 PolarHBondContact O-N 3.38Å; F627-L630 HydrophobicContact CD1-CD1 3.69Å; F627-L630 HydrophobicContact CE1-CD1 3.8Å; F627-L630 PolarHBondContact O-N 3.45Å; F627-N631 WeakPolarHBondContact O-CB 2.99Å; F627-N631 PolarHBondContact O-N 3.43Å; F627-V650 HydrophobicContact CD1-CG1 4.26Å; F627-V650 HydrophobicContact CE1-CG1 3.74Å; F627-F654 HydrophobicContact CD1-CE2 4.02Å; F627-F654 AromaticContact CD1-CZ 3.61Å; F627-F654 HydrophobicContact CD1-CZ 3.61Å; F627-F654 HydrophobicContact CD2-CE1 4.25Å; F627-F654 AromaticContact CD2-CZ 3.88Å; F627-F654 HydrophobicContact CD2-CZ 3.88Å; F627-F654 HydrophobicContact CE1-CE1 4.08Å; F627-F654 AromaticContact CE1-CE2 3.59Å; F627-F654 HydrophobicContact CE1-CE2 3.59Å; F627-F654 AromaticContact CE1-CZ 3.3Å; F627-F654 HydrophobicContact CE1-CZ 3.3Å; F627-F654 AromaticContact CE2-CE1 3.64Å; F627-F654 HydrophobicContact CE2-CE1 3.64Å; F627-F654 AromaticContact CE2-CZ 3.56Å; F627-F654 HydrophobicContact CE2-CZ 3.56Å; F627-F654 AromaticContact CG-CZ 3.9Å; F627-F654 HydrophobicContact CG-CZ 3.9Å; F627-F654 HydrophobicContact CZ-CD1 4.42Å; F627-F654 AromaticContact CZ-CE1 3.55Å; F627-F654 HydrophobicContact CZ-CE1 3.55Å; F627-F654 AromaticContact CZ-CE2 3.92Å; F627-F654 HydrophobicContact CZ-CE2 3.92Å; F627-F654 AromaticContact CZ-CZ 3.27Å; F627-F654 HydrophobicContact CZ-CZ 3.27Å; F627-W657 HydrophobicContact CE2-CH2 4.06Å; F627-W657 AromaticContact CE2-CZ3 3.77Å; F627-W657 HydrophobicContact CE2-CZ3 3.77Å; F627-W657 AromaticContact CZ-CH2 3.87Å; F627-W657 HydrophobicContact CZ-CH2 3.87Å; F627-W657 AromaticContact CZ-CZ3 3.86Å; F627-W657 HydrophobicContact CZ-CZ3 3.86Å; F627-L671 HydrophobicContact CD2-CB 3.89Å; F627-L671 HydrophobicContact CD2-CD1 4.05Å; F627-L671 HydrophobicContact CD2-CD2 4.07Å; F627-L671 HydrophobicContact CD2-CG 4.23Å; F627-L671 HydrophobicContact CE2-CB 4.23Å; F627-L671 HydrophobicContact CE2-CD1 3.96Å; F627-I674 HydrophobicContact CB-CG2 4.04Å; F627-F675 HydrophobicContact CB-CB 4.14Å; F627-F675 HydrophobicContact CD1-CB 3.84Å; F627-F675 HydrophobicContact CD1-CD2 4.26Å; F627-F675 HydrophobicContact CD1-CG 4.17Å; F627-F675 HydrophobicContact CG-CB 4.3Å
628	S	96.1	Very high	95.6	Very high	44 Å²	44	50.3 Å²	50.3	31%	0.308	26%	0.255	S	S	.	.	H	α-helix	trans	-63.7	-47.6	166.8	-164.2	0	0	0	0	111.6	C624 Q625 L630 N631 A632	C624-S628 PolarHBondContact O-N 2.88Å; Q625-S628 VanDerWaalsContact O-CB 3.3Å; Q625-S628 WeakPolarHBondContact O-CB 3.39Å; Q625-S628 PolarHBondContact O-N 2.87Å; Q625-S628 VanDerWaalsContact O-N 3.11Å; S628-L630 VanDerWaalsContact C-N 3.3Å; S628-L630 PolarHBondContact O-N 3.46Å; S628-N631 WeakPolarHBondContact O-CA 3.49Å; S628-N631 WeakPolarHBondContact O-CB 3.42Å; S628-N631 PolarHBondContact O-N 2.96Å; S628-A632 PolarHBondContact O-N 3.14Å
629	D	95.3	Very high	95.4	Very high	22 Å²	22	50 Å²	50	12%	0.118	26%	0.261	C	S	.	.	H	α-helix	trans	-64.8	-33.3	176.7	-74.3	-44.4	0	0	0	112.6	S582 Q625 I626 T633	S582-D629 VanDerWaalsContact CA-CG 3.5Å; S582-D629 WeakPolarHBondContact CB-OD2 3.3Å; Q625-D629 VanDerWaalsContact NE2-CG 3.26Å; Q625-D629 PolarHBondContact NE2-OD1 2.99Å; Q625-D629 PolarHBondContact NE2-OD2 2.84Å; Q625-D629 PolarHBondContact O-N 2.92Å; I626-D629 PolarHBondContact O-N 3.17Å; D629-T633 WeakPolarHBondContact O-CB 3.48Å; D629-T633 PolarHBondContact O-N 3.16Å; D629-T633 PolarHBondContact O-OG1 3.31Å
630	L	96.5	Very high	95.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-71.7	-33.3	171.1	-69.1	169	0	0	0	112.3	L595 I626 F627 S628 T633 Y634 F646 F675	L595-L630 HydrophobicContact CD1-CD1 4.18Å; L595-L630 HydrophobicContact CD2-CD1 4.09Å; I626-L630 HydrophobicContact CG2-CD1 3.88Å; I626-L630 HydrophobicContact CG2-CG 4.49Å; I626-L630 WeakPolarHBondContact O-CB 3.46Å; I626-L630 VanDerWaalsContact O-CG 3.24Å; I626-L630 WeakPolarHBondContact O-CG 3.5Å; I626-L630 PolarHBondContact O-N 3.12Å; F627-L630 HydrophobicContact CD1-CD1 3.69Å; F627-L630 HydrophobicContact CE1-CD1 3.8Å; F627-L630 PolarHBondContact O-N 3.45Å; S628-L630 VanDerWaalsContact C-N 3.3Å; S628-L630 PolarHBondContact O-N 3.46Å; L630-T633 WeakPolarHBondContact O-CB 3.4Å; L630-T633 PolarHBondContact O-N 3Å; L630-Y634 VanDerWaalsContact O-CB 3.32Å; L630-Y634 WeakPolarHBondContact O-CB 3.32Å; L630-Y634 PolarHBondContact O-N 3.45Å; L630-F646 HydrophobicContact CD2-CE1 4.47Å; L630-F646 HydrophobicContact CD2-CZ 3.77Å; L630-F675 HydrophobicContact CB-CD2 3.84Å; L630-F675 HydrophobicContact CB-CE2 3.94Å
631	N	95.5	Very high	95.1	Very high	15 Å²	15	59.8 Å²	59.8	8%	0.08	31%	0.311	C	S	.	.	H	α-helix	trans	-66	-48	171.2	-177.9	-100.6	0	0	0	111.2	F627 S628 T633 Y634 R635 F675 G677	F627-N631 WeakPolarHBondContact O-CB 2.99Å; F627-N631 PolarHBondContact O-N 3.43Å; S628-N631 WeakPolarHBondContact O-CA 3.49Å; S628-N631 WeakPolarHBondContact O-CB 3.42Å; S628-N631 PolarHBondContact O-N 2.96Å; N631-T633 VanDerWaalsContact C-N 3.27Å; N631-T633 PolarHBondContact O-N 2.96Å; N631-Y634 WeakPolarHBondContact O-CB 3.46Å; N631-Y634 PolarHBondContact O-N 2.96Å; N631-Y634 VanDerWaalsContact O-N 3.08Å; N631-R635 WeakPolarHBondContact O-CG 3.3Å; N631-R635 PolarHBondContact O-N 3.14Å; N631-R635 PolarHBondContact OD1-NE 3.23Å; N631-R635 PolarHBondContact OD1-NH2 3.26Å; N631-R635 VanDerWaalsContact OD1-NH2 3.15Å; N631-F675 WeakPolarHBondContact CB-O 3.32Å; N631-F675 PolarHBondContact ND2-O 3.46Å; N631-G677 PolarHBondContact ND2-N 3.39Å
632	A	94.9	Very high	95	Very high	37 Å²	37	60.9 Å²	60.9	31%	0.306	31%	0.308	S	S	.	.	H	α-helix	trans	-58.7	-39.9	174.4	0	0	0	0	0	111.7	L584 S628 T636	L584-A632 HydrophobicContact CD2-CB 4Å; S628-A632 PolarHBondContact O-N 3.14Å; A632-T636 PolarHBondContact O-N 3.31Å; A632-T636 PolarHBondContact O-OG1 2.86Å
633	T	94.6	Very high	94.9	Very high	5 Å²	5	58.7 Å²	58.7	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-60.1	-51.7	170.8	-56.5	0	0	0	0	111.2	L588 K591 D629 L630 N631 R635 T636 I637 F646	L588-T633 HydrophobicContact CD2-CG2 3.68Å; K591-T633 HydrophobicContact CD-CG2 3.43Å; K591-T633 VanDerWaalsContact CD-CG2 3.43Å; K591-T633 WeakPolarHBondContact CE-OG1 3.46Å; K591-T633 PolarHBondContact NZ-OG1 3.05Å; D629-T633 WeakPolarHBondContact O-CB 3.48Å; D629-T633 PolarHBondContact O-N 3.16Å; D629-T633 PolarHBondContact O-OG1 3.31Å; L630-T633 WeakPolarHBondContact O-CB 3.4Å; L630-T633 PolarHBondContact O-N 3Å; N631-T633 VanDerWaalsContact C-N 3.27Å; N631-T633 PolarHBondContact O-N 2.96Å; T633-R635 PolarHBondContact O-N 3.01Å; T633-T636 WeakPolarHBondContact O-CB 3.44Å; T633-T636 PolarHBondContact O-N 2.93Å; T633-I637 WeakPolarHBondContact O-CG1 3.38Å; T633-F646 HydrophobicContact CG2-CE1 4.23Å; T633-F646 HydrophobicContact CG2-CE2 4.19Å; T633-F646 HydrophobicContact CG2-CZ 3.7Å
634	Y	95.6	Very high	94.8	Very high	58 Å²	58	61.3 Å²	61.3	23%	0.227	31%	0.313	C	S	.	.	H	α-helix	trans	-59.2	-44.2	-177.8	170.3	-108.8	0	0	0	112.3	L630 N631 T636 I637 S643 F646 K647	L630-Y634 VanDerWaalsContact O-CB 3.32Å; L630-Y634 WeakPolarHBondContact O-CB 3.32Å; L630-Y634 PolarHBondContact O-N 3.45Å; N631-Y634 WeakPolarHBondContact O-CB 3.46Å; N631-Y634 PolarHBondContact O-N 2.96Å; N631-Y634 VanDerWaalsContact O-N 3.08Å; Y634-T636 PolarHBondContact O-N 3.04Å; Y634-I637 PolarHBondContact O-N 3.31Å; Y634-I637 VanDerWaalsContact O-N 3.13Å; Y634-S643 WeakPolarHBondContact CE2-O 3.42Å; Y634-F646 HydrophobicContact CD2-CD1 4.24Å; Y634-K647 HydrophobicContact CD2-CB 4.27Å; Y634-K647 HydrophobicContact CE2-CB 3.82Å; Y634-K647 HydrophobicContact CE2-CD 4.21Å; Y634-K647 HydrophobicContact CE2-CG 4.45Å
635	R	94.1	Very high	94.8	Very high	161 Å²	161	63.3 Å²	63.3	61%	0.608	32%	0.322	S	S	*	.	H	α-helix	trans	-61.6	-23.8	174.5	-67.1	-175	-162.6	-99.6	6.3	113.7	N631 T633 I637	N631-R635 WeakPolarHBondContact O-CG 3.3Å; N631-R635 PolarHBondContact O-N 3.14Å; N631-R635 PolarHBondContact OD1-NE 3.23Å; N631-R635 PolarHBondContact OD1-NH2 3.26Å; N631-R635 VanDerWaalsContact OD1-NH2 3.15Å; T633-R635 PolarHBondContact O-N 3.01Å; R635-I637 VanDerWaalsContact C-N 3.35Å
636	T	93.8	Very high	94.9	Very high	95 Å²	95	59.2 Å²	59.2	58%	0.583	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-13.6	178.7	-54.8	0	0	0	0	112.7	A632 T633 Y634 Q638	A632-T636 PolarHBondContact O-N 3.31Å; A632-T636 PolarHBondContact O-OG1 2.86Å; T633-T636 WeakPolarHBondContact O-CB 3.44Å; T633-T636 PolarHBondContact O-N 2.93Å; Y634-T636 PolarHBondContact O-N 3.04Å; T636-Q638 PolarHBondContact O-N 3.23Å
637	I	94.2	Very high	94.9	Very high	20 Å²	20	61.9 Å²	61.9	10%	0.103	31%	0.314	C	S	.	.			trans	-82.4	100.1	-174.8	-53	169.7	0	0	0	111.1	L588 T633 Y634 R635 G639 Q642 F646	L588-I637 HydrophobicContact CD1-CD1 3.76Å; L588-I637 HydrophobicContact CD1-CG1 3.88Å; L588-I637 HydrophobicContact CD1-CG2 4.2Å; L588-I637 HydrophobicContact CD2-CD1 3.77Å; L588-I637 HydrophobicContact CD2-CG1 3.89Å; L588-I637 HydrophobicContact CG-CD1 4.41Å; T633-I637 WeakPolarHBondContact O-CG1 3.38Å; Y634-I637 PolarHBondContact O-N 3.31Å; Y634-I637 VanDerWaalsContact O-N 3.13Å; R635-I637 VanDerWaalsContact C-N 3.35Å; I637-G639 VanDerWaalsContact C-N 3.32Å; I637-G639 PolarHBondContact O-N 3.16Å; I637-Q642 HydrophobicContact CG2-CB 3.67Å; I637-F646 HydrophobicContact CD1-CB 3.72Å; I637-F646 HydrophobicContact CD1-CD1 3.88Å; I637-F646 HydrophobicContact CD1-CD2 4.27Å; I637-F646 HydrophobicContact CD1-CG 3.71Å
638	Q	90.8	Very high	94.8	Very high	200 Å²	200	66.5 Å²	66.5	94%	0.935	34%	0.336	S	S	*	.			trans	-64.6	-28.8	179.8	-64.9	179.7	-15.8	0	0	114.6	T636	T636-Q638 PolarHBondContact O-N 3.23Å
639	G	92.5	Very high	94.9	Very high	30 Å²	30	69.3 Å²	69.3	31%	0.309	34%	0.34	S	S	.	.			trans	-88.4	109.6	-176.3	0	0	0	0	0	112.7	I637 L641 Q642 S643	I637-G639 VanDerWaalsContact C-N 3.32Å; I637-G639 PolarHBondContact O-N 3.16Å; G639-L641 VanDerWaalsContact C-N 3.28Å; G639-L641 PolarHBondContact O-N 3.31Å; G639-L641 VanDerWaalsContact O-N 3.13Å; G639-Q642 WeakPolarHBondContact O-CA 3.37Å; G639-Q642 WeakPolarHBondContact O-CB 3.46Å; G639-Q642 PolarHBondContact O-N 3.01Å; G639-S643 PolarHBondContact O-N 3.05Å
640	H	93.3	Very high	95	Very high	153 Å²	153	68.2 Å²	68.2	71%	0.708	33%	0.334	S	S	*	.	H	α-helix	trans	-47.4	-44.1	-179.1	-178.5	-80.6	0	0	0	114.4	Q642 S643 E644	H640-Q642 VanDerWaalsContact C-N 3.3Å; H640-Q642 PolarHBondContact O-N 3.47Å; H640-S643 WeakPolarHBondContact CA-OG 3.5Å; H640-S643 PolarHBondContact O-N 2.96Å; H640-S643 PolarHBondContact O-OG 3.36Å; H640-E644 WeakPolarHBondContact O-CB 3.35Å; H640-E644 PolarHBondContact O-N 2.87Å
641	L	93.6	Very high	95	Very high	132 Å²	132	70.2 Å²	70.2	69%	0.691	34%	0.344	S	S	*	.	H	α-helix	trans	-65.3	-34.4	177.9	-176.9	62.8	0	0	0	112.2	G639 N645	G639-L641 VanDerWaalsContact C-N 3.28Å; G639-L641 PolarHBondContact O-N 3.31Å; G639-L641 VanDerWaalsContact O-N 3.13Å; L641-N645 VanDerWaalsContact O-CB 3.28Å; L641-N645 WeakPolarHBondContact O-CB 3.46Å; L641-N645 PolarHBondContact O-N 2.88Å; L641-N645 VanDerWaalsContact O-N 3.13Å; L641-N645 PolarHBondContact O-ND2 3.44Å
642	Q	93.6	Very high	95.1	Very high	124 Å²	124	73.5 Å²	73.5	58%	0.579	36%	0.364	S	S	*	.	H	α-helix	trans	-76.3	-39	177.9	-65.7	-178.3	-13.1	0	0	112	I637 G639 H640 F646	I637-Q642 HydrophobicContact CG2-CB 3.67Å; G639-Q642 WeakPolarHBondContact O-CA 3.37Å; G639-Q642 WeakPolarHBondContact O-CB 3.46Å; G639-Q642 PolarHBondContact O-N 3.01Å; H640-Q642 VanDerWaalsContact C-N 3.3Å; H640-Q642 PolarHBondContact O-N 3.47Å; Q642-F646 VanDerWaalsContact O-CB 3.3Å; Q642-F646 WeakPolarHBondContact O-CB 3.33Å; Q642-F646 PolarHBondContact O-N 2.76Å
643	S	95.1	Very high	95.1	Very high	16 Å²	16	71.9 Å²	71.9	11%	0.112	35%	0.351	C	S	.	.	H	α-helix	trans	-67.4	-45.4	178.6	60.5	0	0	0	0	111	Y634 G639 H640 F646 K647	Y634-S643 WeakPolarHBondContact CE2-O 3.42Å; G639-S643 PolarHBondContact O-N 3.05Å; H640-S643 WeakPolarHBondContact CA-OG 3.5Å; H640-S643 PolarHBondContact O-N 2.96Å; H640-S643 PolarHBondContact O-OG 3.36Å; S643-F646 WeakPolarHBondContact O-CB 3.13Å; S643-F646 PolarHBondContact O-N 3.17Å; S643-K647 WeakPolarHBondContact O-CB 3.45Å; S643-K647 PolarHBondContact O-N 2.95Å
644	E	95.8	Very high	95.3	Very high	55 Å²	55	71.7 Å²	71.7	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-66.4	-39.2	175.9	-176.9	56	-149.1	0	0	111.7	H640 F646 K647 Q648	H640-E644 WeakPolarHBondContact O-CB 3.35Å; H640-E644 PolarHBondContact O-N 2.87Å; E644-F646 VanDerWaalsContact C-N 3.34Å; E644-F646 PolarHBondContact O-N 3.08Å; E644-K647 PolarHBondContact O-N 2.88Å; E644-K647 WeakPolarHBondContact OE2-CD 3.49Å; E644-K647 IonicContact OE2-NZ 3.83Å; E644-K647 PolarHBondContact OE2-NZ 3.46Å; E644-K647 VanDerWaalsContact OE2-NZ 3.11Å; E644-Q648 WeakPolarHBondContact O-CB 3.29Å; E644-Q648 VanDerWaalsContact O-CG 3.25Å; E644-Q648 WeakPolarHBondContact O-CG 3.36Å; E644-Q648 PolarHBondContact O-N 3.38Å; E644-Q648 WeakPolarHBondContact OE1-CG 3.37Å; E644-Q648 PolarHBondContact OE1-NE2 2.72Å
645	N	95.6	Very high	95.3	Very high	71 Å²	71	77 Å²	77	38%	0.38	37%	0.37	S	S	.	.	H	α-helix	trans	-62.5	-37.7	171.4	-93.6	-99.9	0	0	0	113	L641 R649	L641-N645 VanDerWaalsContact O-CB 3.28Å; L641-N645 WeakPolarHBondContact O-CB 3.46Å; L641-N645 PolarHBondContact O-N 2.88Å; L641-N645 VanDerWaalsContact O-N 3.13Å; L641-N645 PolarHBondContact O-ND2 3.44Å; N645-R649 WeakPolarHBondContact O-CG 3.44Å; N645-R649 PolarHBondContact O-N 2.93Å
646	F	96.9	Very high	95.4	Very high	6 Å²	6	70.2 Å²	70.2	3%	0.026	35%	0.347	C	S	.	.	H	α-helix	trans	-66	-51.3	176.6	-178.4	-96.8	0	0	0	110.3	L588 K591 I592 L630 T633 Y634 I637 Q642 S643 E644 Q648 R649 V650 F675	L588-F646 HydrophobicContact CB-CD2 4.32Å; L588-F646 HydrophobicContact CD2-CD2 4.23Å; L588-F646 HydrophobicContact CD2-CE2 4.22Å; K591-F646 HydrophobicContact CB-CE2 4.38Å; I592-F646 HydrophobicContact CD1-CD2 3.65Å; I592-F646 HydrophobicContact CD1-CE2 3.71Å; I592-F646 HydrophobicContact CD1-CG 4.41Å; I592-F646 HydrophobicContact CG1-CD2 3.81Å; I592-F646 HydrophobicContact CG1-CE2 3.93Å; L630-F646 HydrophobicContact CD2-CE1 4.47Å; L630-F646 HydrophobicContact CD2-CZ 3.77Å; T633-F646 HydrophobicContact CG2-CE1 4.23Å; T633-F646 HydrophobicContact CG2-CE2 4.19Å; T633-F646 HydrophobicContact CG2-CZ 3.7Å; Y634-F646 HydrophobicContact CD2-CD1 4.24Å; I637-F646 HydrophobicContact CD1-CB 3.72Å; I637-F646 HydrophobicContact CD1-CD1 3.88Å; I637-F646 HydrophobicContact CD1-CD2 4.27Å; I637-F646 HydrophobicContact CD1-CG 3.71Å; Q642-F646 VanDerWaalsContact O-CB 3.3Å; Q642-F646 WeakPolarHBondContact O-CB 3.33Å; Q642-F646 PolarHBondContact O-N 2.76Å; S643-F646 WeakPolarHBondContact O-CB 3.13Å; S643-F646 PolarHBondContact O-N 3.17Å; E644-F646 VanDerWaalsContact C-N 3.34Å; E644-F646 PolarHBondContact O-N 3.08Å; F646-Q648 PolarHBondContact O-N 3.3Å; F646-R649 PolarHBondContact O-N 3.05Å; F646-R649 VanDerWaalsContact O-N 3.16Å; F646-V650 HydrophobicContact CD1-CG2 4.31Å; F646-V650 HydrophobicContact CE1-CG2 4.1Å; F646-V650 HydrophobicContact CZ-CG2 4.42Å; F646-V650 WeakPolarHBondContact O-CG2 3.48Å; F646-V650 PolarHBondContact O-N 3.24Å; F646-F675 HydrophobicContact CE1-CE2 4.24Å; F646-F675 HydrophobicContact CE1-CZ 4.47Å
647	K	97	Very high	95.6	Very high	55 Å²	55	65.7 Å²	65.7	24%	0.239	32%	0.32	C	S	.	.	H	α-helix	trans	-54.5	-49.9	175.5	179.4	-172.3	166.2	-157.4	0	112.1	Y634 S643 E644 R649 V650 M651 F675	Y634-K647 HydrophobicContact CD2-CB 4.27Å; Y634-K647 HydrophobicContact CE2-CB 3.82Å; Y634-K647 HydrophobicContact CE2-CD 4.21Å; Y634-K647 HydrophobicContact CE2-CG 4.45Å; S643-K647 WeakPolarHBondContact O-CB 3.45Å; S643-K647 PolarHBondContact O-N 2.95Å; E644-K647 PolarHBondContact O-N 2.88Å; E644-K647 WeakPolarHBondContact OE2-CD 3.49Å; E644-K647 IonicContact OE2-NZ 3.83Å; E644-K647 PolarHBondContact OE2-NZ 3.46Å; E644-K647 VanDerWaalsContact OE2-NZ 3.11Å; K647-R649 VanDerWaalsContact C-N 3.28Å; K647-R649 PolarHBondContact O-N 2.99Å; K647-V650 PolarHBondContact O-N 3.37Å; K647-V650 VanDerWaalsContact O-N 3.08Å; K647-M651 HydrophobicContact CG-CG 4.28Å; K647-M651 WeakPolarHBondContact O-CG 3.39Å; K647-M651 PolarHBondContact O-N 3Å; K647-F675 HydrophobicContact CG-CE1 4.15Å
648	Q	97	Very high	95.6	Very high	97 Å²	97	69.6 Å²	69.6	45%	0.453	34%	0.337	S	S	.	.	H	α-helix	trans	-57.2	-39.7	178.4	-74	173.6	8.9	0	0	112.6	E644 F646 T652	E644-Q648 WeakPolarHBondContact O-CB 3.29Å; E644-Q648 VanDerWaalsContact O-CG 3.25Å; E644-Q648 WeakPolarHBondContact O-CG 3.36Å; E644-Q648 PolarHBondContact O-N 3.38Å; E644-Q648 WeakPolarHBondContact OE1-CG 3.37Å; E644-Q648 PolarHBondContact OE1-NE2 2.72Å; F646-Q648 PolarHBondContact O-N 3.3Å; Q648-T652 PolarHBondContact O-N 3.38Å; Q648-T652 PolarHBondContact O-OG1 3.33Å
649	R	96.9	Very high	95.9	Very high	103 Å²	103	66.6 Å²	66.6	39%	0.389	33%	0.328	S	S	.	.	H	α-helix	trans	-69.2	-35.3	176.2	-70.5	176.5	179.4	-115	4.1	113.2	I592 Y596 N645 F646 K647 T652 C653	I592-R649 HydrophobicContact CD1-CB 3.78Å; Y596-R649 WeakPolarHBondContact OH-CG 3.32Å; N645-R649 WeakPolarHBondContact O-CG 3.44Å; N645-R649 PolarHBondContact O-N 2.93Å; F646-R649 PolarHBondContact O-N 3.05Å; F646-R649 VanDerWaalsContact O-N 3.16Å; K647-R649 VanDerWaalsContact C-N 3.28Å; K647-R649 PolarHBondContact O-N 2.99Å; R649-T652 WeakPolarHBondContact O-CB 3.24Å; R649-C653 PolarHBondContact O-SG 3.37Å
650	V	97.4	Very high	96	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-68.2	-47.7	173.5	179.5	0	0	0	0	110.7	I592 L595 F627 F646 K647 T652 C653 F654 F675	I592-V650 HydrophobicContact CD1-CG2 4.2Å; L595-V650 HydrophobicContact CD2-CB 4.25Å; L595-V650 HydrophobicContact CD2-CG1 4.13Å; L595-V650 HydrophobicContact CD2-CG2 3.84Å; F627-V650 HydrophobicContact CD1-CG1 4.26Å; F627-V650 HydrophobicContact CE1-CG1 3.74Å; F646-V650 HydrophobicContact CD1-CG2 4.31Å; F646-V650 HydrophobicContact CE1-CG2 4.1Å; F646-V650 HydrophobicContact CZ-CG2 4.42Å; F646-V650 WeakPolarHBondContact O-CG2 3.48Å; F646-V650 PolarHBondContact O-N 3.24Å; K647-V650 PolarHBondContact O-N 3.37Å; K647-V650 VanDerWaalsContact O-N 3.08Å; V650-T652 PolarHBondContact O-N 3.19Å; V650-C653 WeakPolarHBondContact O-CB 3.35Å; V650-C653 PolarHBondContact O-N 2.98Å; V650-F654 HydrophobicContact CG1-CD2 4.43Å; V650-F654 HydrophobicContact CG1-CE2 4.06Å; V650-F654 PolarHBondContact O-N 3.1Å; V650-F675 HydrophobicContact CB-CD1 4.32Å; V650-F675 HydrophobicContact CB-CE1 3.68Å; V650-F675 HydrophobicContact CB-CE2 4.21Å; V650-F675 HydrophobicContact CB-CZ 3.64Å; V650-F675 HydrophobicContact CG1-CD1 3.66Å; V650-F675 HydrophobicContact CG1-CD2 3.99Å; V650-F675 HydrophobicContact CG1-CE1 3.54Å; V650-F675 HydrophobicContact CG1-CE2 3.9Å; V650-F675 HydrophobicContact CG1-CG 3.89Å; V650-F675 HydrophobicContact CG1-CZ 3.68Å; V650-F675 HydrophobicContact CG2-CE1 4.34Å; V650-F675 HydrophobicContact CG2-CE2 4.06Å; V650-F675 HydrophobicContact CG2-CZ 3.77Å
651	M	96.8	Very high	96.1	Very high	41 Å²	41	66 Å²	66	20%	0.202	33%	0.326	C	S	.	.	H	α-helix	trans	-61.6	-26.8	176	-61	-52.4	-64.7	0	0	113.2	K647 C653 F654 R655 Q672 F675	K647-M651 HydrophobicContact CG-CG 4.28Å; K647-M651 WeakPolarHBondContact O-CG 3.39Å; K647-M651 PolarHBondContact O-N 3Å; M651-C653 VanDerWaalsContact C-N 3.3Å; M651-C653 PolarHBondContact O-N 2.84Å; M651-F654 PolarHBondContact O-N 3.33Å; M651-F654 HydrophobicContact SD-CD2 4.1Å; M651-R655 PolarHBondContact O-N 2.66Å; M651-Q672 HydrophobicContact CE-CG 4.07Å; M651-F675 HydrophobicContact SD-CD1 4.08Å; M651-F675 HydrophobicContact SD-CE1 4.24Å
652	T	96.7	Very high	96	Very high	84 Å²	84	60.4 Å²	60.4	52%	0.515	30%	0.296	S	S	.	.	H	α-helix	trans	-65.7	-33.2	172.9	-55.5	0	0	0	0	111.8	Q648 R649 V650 A656	Q648-T652 PolarHBondContact O-N 3.38Å; Q648-T652 PolarHBondContact O-OG1 3.33Å; R649-T652 WeakPolarHBondContact O-CB 3.24Å; V650-T652 PolarHBondContact O-N 3.19Å; T652-A656 PolarHBondContact O-N 3.23Å
653	C	96.8	Very high	96.1	Very high	4 Å²	4	54.9 Å²	54.9	3%	0.027	27%	0.27	C	S	.	.	H	α-helix	trans	-70.5	-41.9	177.1	-55.4	0	0	0	0	111.1	L595 R649 V650 M651 R655 A656 W657	L595-C653 HydrophobicContact CD2-CB 4.47Å; R649-C653 PolarHBondContact O-SG 3.37Å; V650-C653 WeakPolarHBondContact O-CB 3.35Å; V650-C653 PolarHBondContact O-N 2.98Å; M651-C653 VanDerWaalsContact C-N 3.3Å; M651-C653 PolarHBondContact O-N 2.84Å; C653-R655 PolarHBondContact O-N 3.29Å; C653-A656 PolarHBondContact O-N 2.68Å; C653-W657 HydrophobicContact CB-CZ2 4.42Å; C653-W657 VanDerWaalsContact O-CG 3.24Å; C653-W657 PolarHBondContact O-N 3.28Å
654	F	97.2	Very high	96.2	Very high	1 Å²	1	57.9 Å²	57.9	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-57.8	-49.3	176	-76.7	-60.3	0	0	0	112.5	F627 V650 M651 A656 W657 E658 L668 L671 Q672 F675	F627-F654 HydrophobicContact CD1-CE2 4.02Å; F627-F654 AromaticContact CD1-CZ 3.61Å; F627-F654 HydrophobicContact CD1-CZ 3.61Å; F627-F654 HydrophobicContact CD2-CE1 4.25Å; F627-F654 AromaticContact CD2-CZ 3.88Å; F627-F654 HydrophobicContact CD2-CZ 3.88Å; F627-F654 HydrophobicContact CE1-CE1 4.08Å; F627-F654 AromaticContact CE1-CE2 3.59Å; F627-F654 HydrophobicContact CE1-CE2 3.59Å; F627-F654 AromaticContact CE1-CZ 3.3Å; F627-F654 HydrophobicContact CE1-CZ 3.3Å; F627-F654 AromaticContact CE2-CE1 3.64Å; F627-F654 HydrophobicContact CE2-CE1 3.64Å; F627-F654 AromaticContact CE2-CZ 3.56Å; F627-F654 HydrophobicContact CE2-CZ 3.56Å; F627-F654 AromaticContact CG-CZ 3.9Å; F627-F654 HydrophobicContact CG-CZ 3.9Å; F627-F654 HydrophobicContact CZ-CD1 4.42Å; F627-F654 AromaticContact CZ-CE1 3.55Å; F627-F654 HydrophobicContact CZ-CE1 3.55Å; F627-F654 AromaticContact CZ-CE2 3.92Å; F627-F654 HydrophobicContact CZ-CE2 3.92Å; F627-F654 AromaticContact CZ-CZ 3.27Å; F627-F654 HydrophobicContact CZ-CZ 3.27Å; V650-F654 HydrophobicContact CG1-CD2 4.43Å; V650-F654 HydrophobicContact CG1-CE2 4.06Å; V650-F654 PolarHBondContact O-N 3.1Å; M651-F654 PolarHBondContact O-N 3.33Å; M651-F654 HydrophobicContact SD-CD2 4.1Å; F654-A656 VanDerWaalsContact C-N 3.31Å; F654-A656 PolarHBondContact O-N 3.42Å; F654-W657 PolarHBondContact O-N 2.92Å; F654-W657 VanDerWaalsContact O-N 3.11Å; F654-E658 WeakPolarHBondContact O-CB 3.44Å; F654-E658 PolarHBondContact O-N 3.48Å; F654-L668 HydrophobicContact CD1-CD2 4.44Å; F654-L671 HydrophobicContact CE1-CB 3.55Å; F654-L671 HydrophobicContact CE1-CD1 4.41Å; F654-L671 HydrophobicContact CZ-CB 3.86Å; F654-Q672 HydrophobicContact CB-CG 4.12Å; F654-Q672 HydrophobicContact CD1-CG 3.78Å; F654-Q672 HydrophobicContact CD2-CG 3.48Å; F654-Q672 VanDerWaalsContact CD2-CG 3.48Å; F654-Q672 HydrophobicContact CE1-CG 3.99Å; F654-Q672 HydrophobicContact CE2-CB 4.43Å; F654-Q672 HydrophobicContact CE2-CG 3.67Å; F654-Q672 HydrophobicContact CG-CG 3.52Å; F654-Q672 HydrophobicContact CZ-CG 3.91Å; F654-F675 HydrophobicContact CE2-CB 4.17Å; F654-F675 HydrophobicContact CE2-CD1 4.29Å; F654-F675 HydrophobicContact CE2-CG 4.43Å; F654-F675 HydrophobicContact CZ-CB 4.42Å
655	R	96.5	Very high	96.1	Very high	170 Å²	170	61.3 Å²	61.3	64%	0.642	31%	0.305	S	S	*	.	H	α-helix	trans	-58.4	-41.5	175.5	-68.4	-179.8	-176.2	177	-0.4	112.6	M651 C653 W657 E658 D659	M651-R655 PolarHBondContact O-N 2.66Å; C653-R655 PolarHBondContact O-N 3.29Å; R655-W657 VanDerWaalsContact C-N 3.35Å; R655-W657 PolarHBondContact O-N 3.04Å; R655-E658 WeakPolarHBondContact O-CB 3.44Å; R655-E658 PolarHBondContact O-N 3.31Å; R655-D659 WeakPolarHBondContact O-CB 3.3Å; R655-D659 VanDerWaalsContact O-CG 3.23Å; R655-D659 PolarHBondContact O-N 3.43Å
656	A	96.3	Very high	96.1	Very high	17 Å²	17	62.7 Å²	62.7	14%	0.14	32%	0.318	C	S	.	.	H	α-helix	trans	-63.2	-40.4	176.3	0	0	0	0	0	111.9	T652 C653 F654 E658 D659 W660	T652-A656 PolarHBondContact O-N 3.23Å; C653-A656 PolarHBondContact O-N 2.68Å; F654-A656 VanDerWaalsContact C-N 3.31Å; F654-A656 PolarHBondContact O-N 3.42Å; A656-E658 VanDerWaalsContact C-N 3.32Å; A656-E658 PolarHBondContact O-N 2.98Å; A656-D659 PolarHBondContact O-N 3.29Å; A656-W660 HydrophobicContact CB-CD2 4.26Å; A656-W660 HydrophobicContact CB-CE3 4.12Å; A656-W660 HydrophobicContact CB-CH2 3.87Å; A656-W660 HydrophobicContact CB-CZ2 3.94Å; A656-W660 HydrophobicContact CB-CZ3 3.95Å; A656-W660 WeakPolarHBondContact O-CB 3.48Å; A656-W660 PolarHBondContact O-N 3.18Å
657	W	96.9	Very high	96	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-72.8	-26.9	-180	-59	-3.2	0	0	0	113.1	L595 V598 S599 L602 L623 F627 C653 F654 R655 W660 A661 I662 L668	L595-W657 HydrophobicContact CD1-CH2 4.39Å; L595-W657 HydrophobicContact CD1-CZ2 4.42Å; V598-W657 HydrophobicContact CG1-CH2 4.18Å; V598-W657 HydrophobicContact CG1-CZ2 4.15Å; S599-W657 PolarHBondContact OG-NE1 3.03Å; L602-W657 HydrophobicContact CD1-CD2 4.31Å; L602-W657 HydrophobicContact CD1-CE3 4.45Å; L602-W657 HydrophobicContact CD1-CH2 3.93Å; L602-W657 HydrophobicContact CD1-CZ2 3.77Å; L602-W657 HydrophobicContact CD1-CZ3 4.26Å; L623-W657 HydrophobicContact CD1-CZ3 4.16Å; L623-W657 HydrophobicContact CD2-CH2 3.68Å; L623-W657 HydrophobicContact CD2-CZ3 3.75Å; F627-W657 HydrophobicContact CE2-CH2 4.06Å; F627-W657 AromaticContact CE2-CZ3 3.77Å; F627-W657 HydrophobicContact CE2-CZ3 3.77Å; F627-W657 AromaticContact CZ-CH2 3.87Å; F627-W657 HydrophobicContact CZ-CH2 3.87Å; F627-W657 AromaticContact CZ-CZ3 3.86Å; F627-W657 HydrophobicContact CZ-CZ3 3.86Å; C653-W657 HydrophobicContact CB-CZ2 4.42Å; C653-W657 VanDerWaalsContact O-CG 3.24Å; C653-W657 PolarHBondContact O-N 3.28Å; F654-W657 PolarHBondContact O-N 2.92Å; F654-W657 VanDerWaalsContact O-N 3.11Å; R655-W657 VanDerWaalsContact C-N 3.35Å; R655-W657 PolarHBondContact O-N 3.04Å; W657-W660 AromaticContact CD1-CE3 3.9Å; W657-W660 AromaticContact CD1-CZ3 3.92Å; W657-A661 PolarHBondContact O-N 3.29Å; W657-A661 VanDerWaalsContact O-N 3.14Å; W657-I662 HydrophobicContact CB-CB 4.46Å; W657-I662 PolarHBondContact O-N 3.01Å; W657-L668 HydrophobicContact CB-CD1 4.43Å; W657-L668 HydrophobicContact CB-CD2 4.13Å; W657-L668 HydrophobicContact CE3-CD2 4.1Å
658	E	95.8	Very high	96	Very high	102 Å²	102	61.8 Å²	61.8	48%	0.477	31%	0.314	S	S	.	.	H	α-helix	trans	-69.1	-55.5	169.4	-171.7	-176.3	165.5	0	0	110.5	F654 R655 A656 W660 A661 L668	F654-E658 WeakPolarHBondContact O-CB 3.44Å; F654-E658 PolarHBondContact O-N 3.48Å; R655-E658 WeakPolarHBondContact O-CB 3.44Å; R655-E658 PolarHBondContact O-N 3.31Å; A656-E658 VanDerWaalsContact C-N 3.32Å; A656-E658 PolarHBondContact O-N 2.98Å; E658-W660 PolarHBondContact O-N 3.27Å; E658-W660 VanDerWaalsContact O-N 3.14Å; E658-A661 PolarHBondContact O-N 3.08Å; E658-L668 HydrophobicContact CB-CD1 3.92Å
659	D	96.1	Very high	96	Very high	137 Å²	137	60.6 Å²	60.6	73%	0.733	31%	0.31	S	S	*	.	H	α-helix	trans	-53.9	-32.5	173.8	-73.7	-30.6	0	0	0	112.8	R655 A656	R655-D659 WeakPolarHBondContact O-CB 3.3Å; R655-D659 VanDerWaalsContact O-CG 3.23Å; R655-D659 PolarHBondContact O-N 3.43Å; A656-D659 PolarHBondContact O-N 3.29Å
660	W	95.3	Very high	95.9	Very high	100 Å²	100	58.9 Å²	58.9	38%	0.379	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-0.5	-179.6	-58.5	-20.3	0	0	0	114	S599 Y603 A656 W657 E658 I662	S599-W660 WeakPolarHBondContact OG-CZ3 3.38Å; Y603-W660 HydrophobicContact CD2-CB 4.45Å; Y603-W660 AromaticContact CD2-CD2 3.42Å; Y603-W660 HydrophobicContact CD2-CD2 3.42Å; Y603-W660 VanDerWaalsContact CD2-CD2 3.42Å; Y603-W660 AromaticContact CD2-CE2 3.67Å; Y603-W660 AromaticContact CD2-CE3 3.67Å; Y603-W660 HydrophobicContact CD2-CE3 3.67Å; Y603-W660 AromaticContact CD2-CG 3.8Å; Y603-W660 HydrophobicContact CD2-CG 3.8Å; Y603-W660 HydrophobicContact CD2-CH2 4.23Å; Y603-W660 HydrophobicContact CD2-CZ2 4.07Å; Y603-W660 HydrophobicContact CD2-CZ3 4.05Å; Y603-W660 AromaticContact CE2-CD1 3.99Å; Y603-W660 AromaticContact CE2-CD2 3.93Å; Y603-W660 HydrophobicContact CE2-CD2 3.93Å; Y603-W660 AromaticContact CE2-CE2 3.86Å; Y603-W660 AromaticContact CE2-CG 3.99Å; Y603-W660 HydrophobicContact CE2-CG 3.99Å; Y603-W660 HydrophobicContact CE2-CZ2 4.4Å; Y603-W660 AromaticContact CE2-NE1 3.92Å; Y603-W660 HydrophobicContact CG-CD2 4.4Å; Y603-W660 HydrophobicContact CG-CE3 4.28Å; Y603-W660 HydrophobicContact CG-CH2 4.41Å; Y603-W660 HydrophobicContact CG-CZ3 4.27Å; A656-W660 HydrophobicContact CB-CD2 4.26Å; A656-W660 HydrophobicContact CB-CE3 4.12Å; A656-W660 HydrophobicContact CB-CH2 3.87Å; A656-W660 HydrophobicContact CB-CZ2 3.94Å; A656-W660 HydrophobicContact CB-CZ3 3.95Å; A656-W660 WeakPolarHBondContact O-CB 3.48Å; A656-W660 PolarHBondContact O-N 3.18Å; W657-W660 AromaticContact CD1-CE3 3.9Å; W657-W660 AromaticContact CD1-CZ3 3.92Å; E658-W660 PolarHBondContact O-N 3.27Å; E658-W660 VanDerWaalsContact O-N 3.14Å; W660-I662 HydrophobicContact CB-CD1 4.03Å; W660-I662 HydrophobicContact CB-CG1 3.77Å; W660-I662 HydrophobicContact CD2-CD1 4.44Å; W660-I662 HydrophobicContact CE3-CD1 3.64Å; W660-I662 HydrophobicContact CZ3-CD1 4.47Å; W660-I662 PolarHBondContact O-N 3.35Å
661	A	94.4	Very high	95.8	Very high	72 Å²	72	58.9 Å²	58.9	60%	0.595	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	36.1	-177.3	0	0	0	0	0	114.9	R616 W657 E658 Y663	R616-A661 PolarHBondContact NH2-O 2.9Å; W657-A661 PolarHBondContact O-N 3.29Å; W657-A661 VanDerWaalsContact O-N 3.14Å; E658-A661 PolarHBondContact O-N 3.08Å; A661-Y663 PolarHBondContact O-N 3.14Å
662	I	92.8	Very high	95.8	Very high	13 Å²	13	59 Å²	59	7%	0.067	31%	0.306	C	S	.	.	S	Bend	trans	-72.3	-30.3	-175.4	-62.6	-175	0	0	0	111.7	L602 R616 W657 W660	L602-I662 HydrophobicContact CB-CD1 4.07Å; L602-I662 HydrophobicContact CB-CG2 4.27Å; L602-I662 HydrophobicContact CD2-CG2 4.17Å; R616-I662 PolarHBondContact NE-O 3.43Å; R616-I662 PolarHBondContact NH2-O 2.93Å; W657-I662 HydrophobicContact CB-CB 4.46Å; W657-I662 PolarHBondContact O-N 3.01Å; W660-I662 HydrophobicContact CB-CD1 4.03Å; W660-I662 HydrophobicContact CB-CG1 3.77Å; W660-I662 HydrophobicContact CD2-CD1 4.44Å; W660-I662 HydrophobicContact CE3-CD1 3.64Å; W660-I662 HydrophobicContact CZ3-CD1 4.47Å; W660-I662 PolarHBondContact O-N 3.35Å
663	Y	95.4	Very high	95.8	Very high	8 Å²	8	57.4 Å²	57.4	3%	0.031	29%	0.294	C	S	.	.	S	Bend	trans	-140	158.6	169.9	-63.3	-75.3	0	0	0	110.5	L602 R616 E620 L623 A661 F667 L668	L602-Y663 HydrophobicContact CD1-CE2 4.15Å; L602-Y663 HydrophobicContact CD2-CE2 4.13Å; L602-Y663 WeakPolarHBondContact CD2-OH 3.28Å; R616-Y663 HydrophobicContact CG-CE1 3.92Å; R616-Y663 PolarHBondContact O-OH 3.46Å; E620-Y663 HydrophobicContact CB-CE1 3.77Å; E620-Y663 HydrophobicContact CG-CD1 4.25Å; E620-Y663 HydrophobicContact CG-CE1 3.76Å; E620-Y663 PolarHBondContact N-OH 2.94Å; L623-Y663 HydrophobicContact CD1-CD2 4.19Å; L623-Y663 HydrophobicContact CD1-CE2 3.42Å; L623-Y663 VanDerWaalsContact CD1-CE2 3.42Å; A661-Y663 PolarHBondContact O-N 3.14Å; Y663-F667 HydrophobicContact CD1-CD1 4.06Å; Y663-F667 AromaticContact CD1-CE1 3.93Å; Y663-F667 HydrophobicContact CD1-CE1 3.93Å; Y663-F667 HydrophobicContact CD2-CD1 4.34Å; Y663-F667 HydrophobicContact CD2-CE1 4.17Å; Y663-F667 HydrophobicContact CE1-CE1 4.34Å; Y663-F667 AromaticContact CG-CD1 3.75Å; Y663-F667 HydrophobicContact CG-CD1 3.75Å; Y663-F667 AromaticContact CG-CE1 3.84Å; Y663-F667 HydrophobicContact CG-CE1 3.84Å; Y663-L668 HydrophobicContact CD2-CD2 4.33Å
664	P	95.5	Very high	95.7	Very high	80 Å²	80	57.4 Å²	57.4	52%	0.519	29%	0.294	S	S	.	.			trans	-58.2	144.5	175	-23.8	35	0	0	0	112.5	P666 F667 L668	P664-P666 VanDerWaalsContact C-CD 3.48Å; P664-F667 WeakPolarHBondContact O-CB 3.3Å; P664-F667 PolarHBondContact O-N 3.29Å; P664-L668 PolarHBondContact O-N 3.25Å; P664-L668 VanDerWaalsContact O-N 3.11Å
665	E	94.4	Very high	95.7	Very high	126 Å²	126	57.4 Å²	57.4	59%	0.589	29%	0.294	S	S	*	.	H	α-helix	trans	-50.9	-44.1	179.1	-171.4	-168	157.4	0	0	113.5	F667 L668 I669	E665-F667 VanDerWaalsContact C-N 3.28Å; E665-F667 PolarHBondContact O-N 2.83Å; E665-L668 PolarHBondContact O-N 3.29Å; E665-L668 VanDerWaalsContact O-N 3.14Å; E665-I669 HydrophobicContact CG-CD1 3.91Å; E665-I669 HydrophobicContact CG-CG1 4.43Å; E665-I669 WeakPolarHBondContact O-CG1 3.46Å; E665-I669 PolarHBondContact O-N 3.22Å
666	P	95.4	Very high	95.7	Very high	100 Å²	100	52.3 Å²	52.3	65%	0.649	28%	0.279	S	S	*	.	H	α-helix	trans	-60.6	-34.3	177.7	-24.6	35.8	0	0	0	113.8	P664 K670	P664-P666 VanDerWaalsContact C-CD 3.48Å; P666-K670 WeakPolarHBondContact O-CB 3.47Å; P666-K670 PolarHBondContact O-N 3.17Å
667	F	96.3	Very high	95.4	Very high	38 Å²	38	52.6 Å²	52.6	17%	0.167	28%	0.283	C	S	.	.	H	α-helix	trans	-72	-41.8	176.2	-178.6	-102.7	0	0	0	111.1	E620 L623 Y663 P664 E665 I669 K670 L671	E620-F667 HydrophobicContact CG-CE1 4.4Å; E620-F667 HydrophobicContact CG-CE2 4.48Å; E620-F667 HydrophobicContact CG-CZ 3.98Å; L623-F667 HydrophobicContact CB-CZ 4.49Å; L623-F667 HydrophobicContact CD1-CE1 4.15Å; Y663-F667 HydrophobicContact CD1-CD1 4.06Å; Y663-F667 AromaticContact CD1-CE1 3.93Å; Y663-F667 HydrophobicContact CD1-CE1 3.93Å; Y663-F667 HydrophobicContact CD2-CD1 4.34Å; Y663-F667 HydrophobicContact CD2-CE1 4.17Å; Y663-F667 HydrophobicContact CE1-CE1 4.34Å; Y663-F667 AromaticContact CG-CD1 3.75Å; Y663-F667 HydrophobicContact CG-CD1 3.75Å; Y663-F667 AromaticContact CG-CE1 3.84Å; Y663-F667 HydrophobicContact CG-CE1 3.84Å; P664-F667 WeakPolarHBondContact O-CB 3.3Å; P664-F667 PolarHBondContact O-N 3.29Å; E665-F667 VanDerWaalsContact C-N 3.28Å; E665-F667 PolarHBondContact O-N 2.83Å; F667-I669 VanDerWaalsContact C-N 3.31Å; F667-I669 PolarHBondContact O-N 3.39Å; F667-K670 PolarHBondContact O-N 3.36Å; F667-L671 HydrophobicContact CD1-CD1 3.86Å; F667-L671 HydrophobicContact CD1-CG 4.3Å; F667-L671 HydrophobicContact CE1-CD1 3.44Å; F667-L671 VanDerWaalsContact CE1-CD1 3.44Å; F667-L671 HydrophobicContact CE1-CG 4.09Å; F667-L671 HydrophobicContact CZ-CD1 3.93Å; F667-L671 HydrophobicContact CZ-CD2 4.29Å; F667-L671 HydrophobicContact CZ-CG 4.24Å; F667-L671 WeakPolarHBondContact O-CG 3.39Å; F667-L671 PolarHBondContact O-N 2.58Å
668	L	96.7	Very high	95.1	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.021	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-36.9	173.9	-63.9	178.8	0	0	0	111.9	F654 W657 E658 Y663 P664 E665 Q672	F654-L668 HydrophobicContact CD1-CD2 4.44Å; W657-L668 HydrophobicContact CB-CD1 4.43Å; W657-L668 HydrophobicContact CB-CD2 4.13Å; W657-L668 HydrophobicContact CE3-CD2 4.1Å; E658-L668 HydrophobicContact CB-CD1 3.92Å; Y663-L668 HydrophobicContact CD2-CD2 4.33Å; P664-L668 PolarHBondContact O-N 3.25Å; P664-L668 VanDerWaalsContact O-N 3.11Å; E665-L668 PolarHBondContact O-N 3.29Å; E665-L668 VanDerWaalsContact O-N 3.14Å; L668-Q672 WeakPolarHBondContact O-CB 3.39Å; L668-Q672 VanDerWaalsContact O-CG 3.29Å; L668-Q672 WeakPolarHBondContact O-CG 3.29Å; L668-Q672 PolarHBondContact O-N 2.74Å; L668-Q672 PolarHBondContact O-NE2 3.36Å
669	I	95.5	Very high	94.4	Very high	73 Å²	73	55.9 Å²	55.9	37%	0.374	31%	0.305	S	S	.	.	H	α-helix	trans	-65.6	-45.2	172.9	-68.8	167.5	0	0	0	111	E665 F667 L671 Q672 N673	E665-I669 HydrophobicContact CG-CD1 3.91Å; E665-I669 HydrophobicContact CG-CG1 4.43Å; E665-I669 WeakPolarHBondContact O-CG1 3.46Å; E665-I669 PolarHBondContact O-N 3.22Å; F667-I669 VanDerWaalsContact C-N 3.31Å; F667-I669 PolarHBondContact O-N 3.39Å; I669-L671 PolarHBondContact O-N 3.02Å; I669-Q672 WeakPolarHBondContact O-CB 3.27Å; I669-Q672 PolarHBondContact O-N 2.92Å; I669-N673 PolarHBondContact O-N 3.48Å; I669-N673 PolarHBondContact O-ND2 2.8Å
670	K	95.7	Very high	93.1	Very high	67 Å²	67	53.6 Å²	53.6	29%	0.291	29%	0.293	S	S	.	.	H	α-helix	trans	-57	-46.3	174.9	175.2	166.3	170.7	159.5	0	111.7	P666 F667 N673 I674 E684	P666-K670 WeakPolarHBondContact O-CB 3.47Å; P666-K670 PolarHBondContact O-N 3.17Å; F667-K670 PolarHBondContact O-N 3.36Å; K670-N673 PolarHBondContact O-N 3Å; K670-I674 HydrophobicContact CG-CD1 4.26Å; K670-I674 WeakPolarHBondContact O-CG1 3.35Å; K670-I674 PolarHBondContact O-N 3.33Å; K670-E684 VanDerWaalsContact CE-OE1 3.24Å; K670-E684 WeakPolarHBondContact CE-OE1 3.46Å; K670-E684 WeakPolarHBondContact CE-OE2 3.38Å; K670-E684 IonicContact NZ-OE1 3.23Å; K670-E684 PolarHBondContact NZ-OE1 2.84Å; K670-E684 IonicContact NZ-OE2 3.19Å; K670-E684 PolarHBondContact NZ-OE2 3.17Å
671	L	96.4	Very high	91.8	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66	-36.9	175.9	-66.1	-177.4	0	0	0	113.2	L623 C624 F627 F654 F667 I669 I674 F675	L623-L671 HydrophobicContact CB-CD1 3.79Å; L623-L671 HydrophobicContact CB-CD2 4.05Å; L623-L671 HydrophobicContact CD1-CD1 4.1Å; L623-L671 HydrophobicContact CG-CD1 4.44Å; C624-L671 HydrophobicContact CB-CD2 4.35Å; F627-L671 HydrophobicContact CD2-CB 3.89Å; F627-L671 HydrophobicContact CD2-CD1 4.05Å; F627-L671 HydrophobicContact CD2-CD2 4.07Å; F627-L671 HydrophobicContact CD2-CG 4.23Å; F627-L671 HydrophobicContact CE2-CB 4.23Å; F627-L671 HydrophobicContact CE2-CD1 3.96Å; F654-L671 HydrophobicContact CE1-CB 3.55Å; F654-L671 HydrophobicContact CE1-CD1 4.41Å; F654-L671 HydrophobicContact CZ-CB 3.86Å; F667-L671 HydrophobicContact CD1-CD1 3.86Å; F667-L671 HydrophobicContact CD1-CG 4.3Å; F667-L671 HydrophobicContact CE1-CD1 3.44Å; F667-L671 VanDerWaalsContact CE1-CD1 3.44Å; F667-L671 HydrophobicContact CE1-CG 4.09Å; F667-L671 HydrophobicContact CZ-CD1 3.93Å; F667-L671 HydrophobicContact CZ-CD2 4.29Å; F667-L671 HydrophobicContact CZ-CG 4.24Å; F667-L671 WeakPolarHBondContact O-CG 3.39Å; F667-L671 PolarHBondContact O-N 2.58Å; I669-L671 PolarHBondContact O-N 3.02Å; L671-I674 HydrophobicContact CD2-CD1 4.45Å; L671-I674 PolarHBondContact O-N 3.04Å; L671-F675 WeakPolarHBondContact O-CB 3.39Å; L671-F675 PolarHBondContact O-N 2.92Å
672	Q	96.2	Very high	90.1	Very high	42 Å²	42	55 Å²	55	20%	0.196	30%	0.296	C	S	.	.	H	α-helix	trans	-62.5	-43.7	172.1	-78.2	175.6	68.8	0	0	111.5	M651 F654 L668 I669 F675 L676	M651-Q672 HydrophobicContact CE-CG 4.07Å; F654-Q672 HydrophobicContact CB-CG 4.12Å; F654-Q672 HydrophobicContact CD1-CG 3.78Å; F654-Q672 HydrophobicContact CD2-CG 3.48Å; F654-Q672 VanDerWaalsContact CD2-CG 3.48Å; F654-Q672 HydrophobicContact CE1-CG 3.99Å; F654-Q672 HydrophobicContact CE2-CB 4.43Å; F654-Q672 HydrophobicContact CE2-CG 3.67Å; F654-Q672 HydrophobicContact CG-CG 3.52Å; F654-Q672 HydrophobicContact CZ-CG 3.91Å; L668-Q672 WeakPolarHBondContact O-CB 3.39Å; L668-Q672 VanDerWaalsContact O-CG 3.29Å; L668-Q672 WeakPolarHBondContact O-CG 3.29Å; L668-Q672 PolarHBondContact O-N 2.74Å; L668-Q672 PolarHBondContact O-NE2 3.36Å; I669-Q672 WeakPolarHBondContact O-CB 3.27Å; I669-Q672 PolarHBondContact O-N 2.92Å; Q672-F675 PolarHBondContact O-N 2.77Å; Q672-L676 WeakPolarHBondContact O-CB 3.35Å; Q672-L676 VanDerWaalsContact O-CG 3.31Å; Q672-L676 WeakPolarHBondContact O-CG 3.26Å; Q672-L676 PolarHBondContact O-N 2.86Å
673	N	96	Very high	88	Confident	52 Å²	52	60.7 Å²	60.7	28%	0.278	32%	0.322	S	S	.	.	H	α-helix	trans	-64.2	-40.2	177.7	-71.8	-20.4	0	0	0	112	I669 K670 L676 G677 L678 V679	I669-N673 PolarHBondContact O-N 3.48Å; I669-N673 PolarHBondContact O-ND2 2.8Å; K670-N673 PolarHBondContact O-N 3Å; N673-L676 PolarHBondContact O-N 3.17Å; N673-G677 PolarHBondContact O-N 2.71Å; N673-L678 HydrophobicContact CB-CB 4.25Å; N673-L678 PolarHBondContact O-N 3.47Å; N673-V679 HydrophobicContact CB-CB 4.44Å; N673-V679 HydrophobicContact CB-CG2 3.87Å
674	I	95.9	Very high	85.9	Confident	4 Å²	4	64 Å²	64	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-61.2	-48.6	170.9	-69.2	166.1	0	0	0	110.7	C624 F627 K670 L671 L676 G677 V679 I681	C624-I674 HydrophobicContact CB-CD1 4.1Å; F627-I674 HydrophobicContact CB-CG2 4.04Å; K670-I674 HydrophobicContact CG-CD1 4.26Å; K670-I674 WeakPolarHBondContact O-CG1 3.35Å; K670-I674 PolarHBondContact O-N 3.33Å; L671-I674 HydrophobicContact CD2-CD1 4.45Å; L671-I674 PolarHBondContact O-N 3.04Å; I674-L676 VanDerWaalsContact C-N 3.32Å; I674-L676 PolarHBondContact O-N 3.35Å; I674-G677 WeakPolarHBondContact O-CA 3.33Å; I674-G677 PolarHBondContact O-N 2.74Å; I674-V679 HydrophobicContact CG1-CB 4.27Å; I674-V679 HydrophobicContact CG1-CG1 4.27Å; I674-I681 HydrophobicContact CD1-CD1 4.28Å; I674-I681 HydrophobicContact CD1-CG1 4.02Å; I674-I681 HydrophobicContact CG1-CG1 4.25Å; I674-I681 HydrophobicContact CG2-CD1 3.94Å; I674-I681 HydrophobicContact CG2-CG1 4.39Å
675	F	96.6	Very high	83.5	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-62.7	-36.3	179.6	174.4	-116.1	0	0	0	113.3	F627 L630 N631 F646 K647 V650 M651 F654 L671 Q672 G677	F627-F675 HydrophobicContact CB-CB 4.14Å; F627-F675 HydrophobicContact CD1-CB 3.84Å; F627-F675 HydrophobicContact CD1-CD2 4.26Å; F627-F675 HydrophobicContact CD1-CG 4.17Å; F627-F675 HydrophobicContact CG-CB 4.3Å; L630-F675 HydrophobicContact CB-CD2 3.84Å; L630-F675 HydrophobicContact CB-CE2 3.94Å; N631-F675 WeakPolarHBondContact CB-O 3.32Å; N631-F675 PolarHBondContact ND2-O 3.46Å; F646-F675 HydrophobicContact CE1-CE2 4.24Å; F646-F675 HydrophobicContact CE1-CZ 4.47Å; K647-F675 HydrophobicContact CG-CE1 4.15Å; V650-F675 HydrophobicContact CB-CD1 4.32Å; V650-F675 HydrophobicContact CB-CE1 3.68Å; V650-F675 HydrophobicContact CB-CE2 4.21Å; V650-F675 HydrophobicContact CB-CZ 3.64Å; V650-F675 HydrophobicContact CG1-CD1 3.66Å; V650-F675 HydrophobicContact CG1-CD2 3.99Å; V650-F675 HydrophobicContact CG1-CE1 3.54Å; V650-F675 HydrophobicContact CG1-CE2 3.9Å; V650-F675 HydrophobicContact CG1-CG 3.89Å; V650-F675 HydrophobicContact CG1-CZ 3.68Å; V650-F675 HydrophobicContact CG2-CE1 4.34Å; V650-F675 HydrophobicContact CG2-CE2 4.06Å; V650-F675 HydrophobicContact CG2-CZ 3.77Å; M651-F675 HydrophobicContact SD-CD1 4.08Å; M651-F675 HydrophobicContact SD-CE1 4.24Å; F654-F675 HydrophobicContact CE2-CB 4.17Å; F654-F675 HydrophobicContact CE2-CD1 4.29Å; F654-F675 HydrophobicContact CE2-CG 4.43Å; F654-F675 HydrophobicContact CZ-CB 4.42Å; L671-F675 WeakPolarHBondContact O-CB 3.39Å; L671-F675 PolarHBondContact O-N 2.92Å; Q672-F675 PolarHBondContact O-N 2.77Å; F675-G677 VanDerWaalsContact C-N 3.28Å
676	L	95.5	Very high	81	Confident	64 Å²	64	72 Å²	72	34%	0.335	37%	0.366	S	S	.	.	H	α-helix	trans	-76.9	-16.1	174.1	-66.1	174.5	0	0	0	112.5	Q672 N673 I674 L678	Q672-L676 WeakPolarHBondContact O-CB 3.35Å; Q672-L676 VanDerWaalsContact O-CG 3.31Å; Q672-L676 WeakPolarHBondContact O-CG 3.26Å; Q672-L676 PolarHBondContact O-N 2.86Å; N673-L676 PolarHBondContact O-N 3.17Å; I674-L676 VanDerWaalsContact C-N 3.32Å; I674-L676 PolarHBondContact O-N 3.35Å; L676-L678 HydrophobicContact CB-CD1 4.12Å; L676-L678 HydrophobicContact CB-CG 4.03Å; L676-L678 HydrophobicContact CD1-CD1 4.27Å
677	G	91.1	Very high	78.4	Confident	22 Å²	22	72.4 Å²	72.4	23%	0.227	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	35.5	-180	0	0	0	0	0	113.3	N631 N673 I674 F675	N631-G677 PolarHBondContact ND2-N 3.39Å; N673-G677 PolarHBondContact O-N 2.71Å; I674-G677 WeakPolarHBondContact O-CA 3.33Å; I674-G677 PolarHBondContact O-N 2.74Å; F675-G677 VanDerWaalsContact C-N 3.28Å
678	L	89.4	Confident	75.7	Confident	124 Å²	124	79.2 Å²	79.2	65%	0.649	40%	0.398	S	S	*	.	S	Bend	trans	-95.6	-14.5	176.1	-59.3	175.7	0	0	0	112.8	N673 L676	N673-L678 HydrophobicContact CB-CB 4.25Å; N673-L678 PolarHBondContact O-N 3.47Å; L676-L678 HydrophobicContact CB-CD1 4.12Å; L676-L678 HydrophobicContact CB-CG 4.03Å; L676-L678 HydrophobicContact CD1-CD1 4.27Å
679	V	81.4	Confident	72.9	Confident	47 Å²	47	86.7 Å²	86.7	29%	0.285	44%	0.439	S	S	.	.	S	Bend	trans	-131.1	132.8	177.1	169.9	0	0	0	0	108.8	N673 I674	N673-V679 HydrophobicContact CB-CB 4.44Å; N673-V679 HydrophobicContact CB-CG2 3.87Å; I674-V679 HydrophobicContact CG1-CB 4.27Å; I674-V679 HydrophobicContact CG1-CG1 4.27Å
680	N	68.7	Low	70.3	Confident	90 Å²	90	88.7 Å²	88.7	48%	0.481	45%	0.454	S	S	.	.			trans	-96.2	125.5	173.5	-61.5	-41.5	0	0	0	109.6	I682 E683	N680-I682 PolarHBondContact O-N 2.96Å; N680-E683 PolarHBondContact ND2-OE1 3.04Å; N680-E683 PolarHBondContact O-N 3.21Å
681	I	68.7	Low	67.8	Low	57 Å²	57	90.6 Å²	90.6	29%	0.292	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-12.7	-179.4	-67.1	168	0	0	0	113.2	C624 I674	C624-I681 HydrophobicContact CB-CD1 4.19Å; C624-I681 VanDerWaalsContact O-CD1 3.29Å; C624-I681 WeakPolarHBondContact O-CD1 3.42Å; I674-I681 HydrophobicContact CD1-CD1 4.28Å; I674-I681 HydrophobicContact CD1-CG1 4.02Å; I674-I681 HydrophobicContact CG1-CG1 4.25Å; I674-I681 HydrophobicContact CG2-CD1 3.94Å; I674-I681 HydrophobicContact CG2-CG1 4.39Å
682	I	58.2	Low	65.1	Low	145 Å²	145	96.9 Å²	96.9	74%	0.744	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-34.2	-176.5	-57.2	175.8	0	0	0	111.7	N680	N680-I682 PolarHBondContact O-N 2.96Å
683	E	49.8	Very low	62.6	Low	131 Å²	131	102.5 Å²	102.5	61%	0.612	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-83.1	-24.3	-167.2	-69.4	161.3	-144.4	0	0	113.8	N680 K685	N680-E683 PolarHBondContact ND2-OE1 3.04Å; N680-E683 PolarHBondContact O-N 3.21Å; E683-K685 VanDerWaalsContact C-N 3.3Å; E683-K685 PolarHBondContact O-N 2.94Å
684	E	50.2	Low	60.4	Low	77 Å²	77	107.5 Å²	107.5	36%	0.36	56%	0.564	S	S	.	*	G	3₁₀ helix	trans	-78.2	-11.5	-177.6	-61.7	-174.8	132.9	0	0	113.8	K670 T687	K670-E684 VanDerWaalsContact CE-OE1 3.24Å; K670-E684 WeakPolarHBondContact CE-OE1 3.46Å; K670-E684 WeakPolarHBondContact CE-OE2 3.38Å; K670-E684 IonicContact NZ-OE1 3.23Å; K670-E684 PolarHBondContact NZ-OE1 2.84Å; K670-E684 IonicContact NZ-OE2 3.19Å; K670-E684 PolarHBondContact NZ-OE2 3.17Å; E684-T687 PolarHBondContact O-OG1 2.68Å
685	K	45.2	Very low	58.1	Low	195 Å²	195	115.1 Å²	115.1	85%	0.848	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-93.1	6.7	-171.4	-142.7	-174.9	179.1	-174.8	0	114.8	E683	E683-K685 VanDerWaalsContact C-N 3.3Å; E683-K685 PolarHBondContact O-N 2.94Å
686	E	42.6	Very low	55.7	Low	181 Å²	181	118.1 Å²	118.1	85%	0.846	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-112.6	6	177	-62	-169.5	147.5	0	0	112.9
687	T	40.5	Very low	53.3	Low	108 Å²	108	119.5 Å²	119.5	66%	0.663	66%	0.656	S	S	*	*	S	Bend	trans	-127.7	-2.8	-170.5	45.1	0	0	0	0	116.6	E684	E684-T687 PolarHBondContact O-OG1 2.68Å
688	E	39.7	Very low	50.8	Low	180 Å²	180	124 Å²	124	84%	0.841	68%	0.681	S	S	*	*	S	Bend	trans	-111.5	61.4	176	-69.3	-170.8	162.1	0	0	112.3
689	D	38.1	Very low	48.6	Very low	162 Å²	162	126.2 Å²	126.2	87%	0.866	69%	0.692	S	S	*	*			trans	-149.4	49.7	172	-112	-33.4	0	0	0	111.5
690	V	40.7	Very low	46.5	Very low	114 Å²	114	132.2 Å²	132.2	69%	0.691	72%	0.717	S	S	*	*			trans	-121.6	110.4	169.2	-179.4	0	0	0	0	108.9	D692	V690-D692 PolarHBondContact O-N 3.47Å
691	P	42.8	Very low	45.1	Very low	107 Å²	107	136.5 Å²	136.5	70%	0.695	73%	0.734	S	S	*	*			trans	-81.8	104.6	171.4	31.1	-30.3	0	0	0	109.8	D693	P691-D693 PolarHBondContact O-N 3.17Å
692	D	39.5	Very low	43.8	Very low	132 Å²	132	142.1 Å²	142.1	71%	0.706	76%	0.759	S	S	*	*			trans	-73.3	71.3	169.8	-77.4	-35.7	0	0	0	110.9	V690 L694	V690-D692 PolarHBondContact O-N 3.47Å; D692-L694 PolarHBondContact O-N 3.14Å
693	D	43.6	Very low	43.3	Very low	161 Å²	161	142.5 Å²	142.5	86%	0.861	76%	0.762	S	S	*	*			trans	-68.3	78.6	158.4	-87.4	-33.9	0	0	0	108.4	P691	P691-D693 PolarHBondContact O-N 3.17Å
694	L	50.5	Low	42.8	Very low	156 Å²	156	143.8 Å²	143.8	82%	0.817	77%	0.773	S	S	*	*			trans	-93.3	117.2	173.9	-93.8	171.9	0	0	0	111.2	D692	D692-L694 PolarHBondContact O-N 3.14Å
695	D	48.3	Very low	42.3	Very low	164 Å²	164	143.1 Å²	143.1	88%	0.877	79%	0.787	S	S	*	*			trans	-69	158.6	-172.6	-160.6	5.8	0	0	0	113.6
696	G	44.6	Very low	42.5	Very low	63 Å²	63	138.7 Å²	138.7	65%	0.649	79%	0.787	S	S	*	*			trans	-89.7	112.5	-169.1	0	0	0	0	0	115.1
697	A	45.4	Very low	42.3	Very low	94 Å²	94	136 Å²	136	78%	0.777	79%	0.785	S	S	*	*			trans	70.3	172.2	155.8	0	0	0	0	0	117.1
698	P	39.6	Very low	42.5	Very low	115 Å²	115	138 Å²	138	75%	0.747	79%	0.791	S	S	*	*			cis	-129	153.7	-43.6	30.3	-15.7	0	0	0	112.9
699	I	43	Very low	42.6	Very low	171 Å²	171	136.7 Å²	136.7	88%	0.877	79%	0.785	S	S	*	*			trans	-133.4	142.7	156.6	-70.8	-173.8	0	0	0	109
700	E	36.4	Very low	43.1	Very low	174 Å²	174	135.9 Å²	135.9	81%	0.813	78%	0.78	S	S	*	*			trans	-90.6	148.4	-175	-58.8	164.3	125.8	0	0	111.4
701	E	40.2	Very low	43.7	Very low	180 Å²	180	137.1 Å²	137.1	84%	0.841	79%	0.788	S	S	*	*				168.3	140.7	116.1	-88.8	-177	156.4	0	0	111.4
702	E	41.7	Very low	43.8	Very low	175 Å²	175	139.5 Å²	139.5	82%	0.818	80%	0.795	S	S	*	*			trans	7.9	141.5	158.4	-45.8	-170.3	150.9	0	0	119.7
703	L	46.5	Very low	44.1	Very low	152 Å²	152	136.2 Å²	136.2	80%	0.796	79%	0.792	S	S	*	*				-176.2	140.8	61.4	-171.5	67.6	0	0	0	113
704	D	40.1	Very low	44.3	Very low	158 Å²	158	136.6 Å²	136.6	85%	0.845	79%	0.793	S	S	*	*			trans	31.6	133.7	148.9	-153.8	40.8	0	0	0	121.7
705	G	40.3	Very low	43.9	Very low	64 Å²	64	134.4 Å²	134.4	66%	0.66	79%	0.788	S	S	*	*			cis	165.3	-160.6	0.5	0	0	0	0	0	114.2
706	A	48	Very low	43.8	Very low	102 Å²	102	134 Å²	134	84%	0.843	78%	0.784	S	S	*	*			trans	76.4	108.6	175.5	0	0	0	0	0	120
707	P	39.4	Very low	43.6	Very low	123 Å²	123	137.3 Å²	137.3	80%	0.799	79%	0.786	S	S	*	*			trans	-117.4	155.6	175.1	40.3	-30.6	0	0	0	115.8
708	L	43.8	Very low	43.1	Very low	152 Å²	152	137.5 Å²	137.5	80%	0.796	79%	0.788	S	S	*	*			trans	-161.9	153.6	165.3	-93.4	110.5	0	0	0	108
709	E	42.1	Very low	43.3	Very low	152 Å²	152	137.7 Å²	137.7	71%	0.71	79%	0.787	S	S	*	*			cis	-161.1	146.4	-24.8	-123.5	172.2	-154.2	0	0	107.3
710	D	48	Very low	43.2	Very low	144 Å²	144	134.7 Å²	134.7	77%	0.77	78%	0.779	S	S	*	*			trans	29.4	131.8	153.3	-52.8	-12.7	0	0	0	123.4
711	V	54.3	Low	43.3	Very low	140 Å²	140	133.4 Å²	133.4	85%	0.848	78%	0.776	S	S	*	*				-166.9	138.8	123.5	137.1	0	0	0	0	111.5
712	D	43.9	Very low	43.4	Very low	157 Å²	157	131.9 Å²	131.9	84%	0.84	77%	0.774	S	S	*	*			trans	-65.2	163.3	-179.7	-50.3	-84.7	0	0	0	114.4
713	G	46	Very low	43.7	Very low	63 Å²	63	129.7 Å²	129.7	65%	0.649	77%	0.768	S	S	*	*			cis	132.5	143.8	1.2	0	0	0	0	0	112.8
714	I	49.1	Very low	43.6	Very low	170 Å²	170	129.2 Å²	129.2	87%	0.872	77%	0.765	S	S	*	*			trans	161.4	126.1	154.4	-86.4	155.2	0	0	0	109.2
715	P	41.1	Very low	44	Very low	110 Å²	110	129.1 Å²	129.1	71%	0.714	77%	0.765	S	S	*	*			trans	-120.3	-144.5	-174.1	42.8	-29.6	0	0	0	113.4
716	I	47.5	Very low	44.4	Very low	156 Å²	156	128.8 Å²	128.8	80%	0.8	76%	0.762	S	S	*	*			trans	89	133	177.3	-52.4	159.7	0	0	0	112.6
717	D	40.1	Very low	44.4	Very low	131 Å²	131	130.8 Å²	130.8	70%	0.701	76%	0.763	S	S	*	*			cis	-134.5	157.4	11.6	-149.4	-13.6	0	0	0	113.7
718	A	33.2	Very low	44.5	Very low	99 Å²	99	130.2 Å²	130.2	82%	0.818	76%	0.759	S	S	*	*			trans	-156.3	113.8	168.1	0	0	0	0	0	110.6
719	T	45.4	Very low	44.5	Very low	118 Å²	118	131 Å²	131	72%	0.724	76%	0.762	S	S	*	*			trans	-123.7	151.8	-175.7	55.3	0	0	0	0	113.1
720	P	40	Very low	44.2	Very low	109 Å²	109	132.5 Å²	132.5	71%	0.708	77%	0.767	S	S	*	*			trans	-120.4	178.9	-157.4	34.5	-15.2	0	0	0	114.6
721	I	39.4	Very low	43.6	Very low	147 Å²	147	129.8 Å²	129.8	75%	0.754	76%	0.759	S	S	*	*			trans	44.8	113.4	151	-61.5	155.3	0	0	0	117.8
722	D	42.4	Very low	42.9	Very low	148 Å²	148	130.6 Å²	130.6	79%	0.791	76%	0.758	S	S	*	*				-164.2	-169.2	117.2	-105.4	-24.9	0	0	0	111.4
723	D	46.5	Very low	42.6	Very low	128 Å²	128	129.2 Å²	129.2	68%	0.684	75%	0.75	S	S	*	*			trans	-114.3	-164.8	-135.5	61	-15.8	0	0	0	117.6
724	L	45.9	Very low	42.4	Very low	142 Å²	142	133.2 Å²	133.2	74%	0.743	76%	0.757	S	S	*	*			trans	72.6	138.6	-179	-81.7	74	0	0	0	117.7
725	D	47.6	Very low	42.2	Very low	156 Å²	156	131.9 Å²	131.9	83%	0.834	75%	0.752	S	S	*	*			cis	-147.8	172	-0.5	-157.5	-7.3	0	0	0	111.4
726	G	47.9	Very low	42.5	Very low	58 Å²	58	135.1 Å²	135.1	60%	0.598	76%	0.762	S	S	*	*			trans	-71.5	-176.3	-171	0	0	0	0	0	117.5
727	V	49.8	Very low	42.1	Very low	143 Å²	143	135.6 Å²	135.6	87%	0.867	77%	0.766	S	S	*	*			cis	-147.5	144.6	27.8	177.2	0	0	0	0	112.4
728	P	40.6	Very low	42.1	Very low	111 Å²	111	131.7 Å²	131.7	72%	0.721	76%	0.757	S	S	*	*			trans	-110.8	164.5	178.4	40.9	-34.3	0	0	0	116
729	I	44.3	Very low	42.8	Very low	168 Å²	168	134.1 Å²	134.1	86%	0.862	76%	0.761	S	S	*	*			trans	171.2	134.9	154.2	-96.6	156.7	0	0	0	106.9
730	K	35	Very low	42.7	Very low	185 Å²	185	134.1 Å²	134.1	80%	0.804	76%	0.763	S	S	*	*			cis	94.5	95.1	-1.8	-126.6	-158.4	-176.5	-168.2	0	120.6
731	S	35.5	Very low	42.8	Very low	87 Å²	87	137.2 Å²	137.2	61%	0.608	77%	0.773	S	S	*	*			trans	52.6	114.3	139.3	61.7	0	0	0	0	122.9
732	L	40	Very low	42.6	Very low	156 Å²	156	137.6 Å²	137.6	82%	0.817	78%	0.777	S	S	*	*			trans	-174.4	123	135.1	-117.8	59.1	0	0	0	104.4
733	D	38.1	Very low	42.4	Very low	129 Å²	129	134.4 Å²	134.4	69%	0.69	77%	0.771	S	S	*	*				89	143.4	52.9	-58.7	-35.1	0	0	0	113.5
734	D	40.3	Very low	41.8	Very low	146 Å²	146	134 Å²	134	78%	0.781	77%	0.773	S	S	*	*			trans	69.9	126.5	165.9	-53.7	-21.8	0	0	0	123.3
735	D	45.6	Very low	41.2	Very low	143 Å²	143	135.8 Å²	135.8	77%	0.765	78%	0.777	S	S	*	*			trans	47.3	120	143.3	-56.6	-16.3	0	0	0	123.1
736	L	47	Very low	40.5	Very low	178 Å²	178	133.6 Å²	133.6	93%	0.932	77%	0.766	S	S	*	*				-175.9	158.3	94.9	-97	171.1	0	0	0	113.7
737	D	39.7	Very low	40	Very low	165 Å²	165	137 Å²	137	88%	0.882	78%	0.781	S	S	*	*			trans	-104.1	167	-172.1	-158.7	-5.9	0	0	0	112.8
738	G	40.8	Very low	39.2	Very low	50 Å²	50	138.1 Å²	138.1	52%	0.515	77%	0.774	S	S	.	*			trans	111.5	86.2	144.9	0	0	0	0	0	121.7
739	V	46.3	Very low	38.8	Very low	150 Å²	150	142.3 Å²	142.3	91%	0.909	78%	0.78	S	S	*	*			trans	62.6	160.9	138.1	-79.2	0	0	0	0	121.6
740	P	44.6	Very low	38.3	Very low	117 Å²	117	142.2 Å²	142.2	76%	0.76	78%	0.782	S	S	*	*			trans	-124.6	-176	-147.8	45.4	-34	0	0	0	116.2
741	L	42	Very low	38.2	Very low	174 Å²	174	140 Å²	140	91%	0.911	77%	0.774	S	S	*	*			trans	-153.2	152.2	160.2	-112.7	167.6	0	0	0	112.8
742	D	35.4	Very low	38.2	Very low	156 Å²	156	141.9 Å²	141.9	83%	0.834	78%	0.784	S	S	*	*			trans	-71.6	151.8	-179.5	-90	-62.1	0	0	0	114.8
743	A	36.8	Very low	37.8	Very low	81 Å²	81	142.1 Å²	142.1	67%	0.669	79%	0.785	S	S	*	*				174.7	118.2	112.2	0	0	0	0	0	115.5
744	T	34.6	Very low	37.7	Very low	119 Å²	119	144.7 Å²	144.7	73%	0.73	79%	0.79	S	S	*	*			trans	52.8	108.6	139.3	59.1	0	0	0	0	123.2
745	E	34.4	Very low	37.5	Very low	179 Å²	179	145.1 Å²	145.1	84%	0.836	79%	0.785	S	S	*	*				98.6	139.3	118.9	-69.7	-165.4	138.6	0	0	124.5
746	D	32.6	Very low	37.5	Very low	110 Å²	110	144.1 Å²	144.1	59%	0.588	78%	0.784	S	S	*	*			trans	56.7	100.7	159	-90.7	-12.7	0	0	0	123	K748	D746-K748 IonicContact OD1-NZ 2.73Å; D746-K748 PolarHBondContact OD1-NZ 3.07Å
747	S	37.1	Very low	37.3	Very low	130 Å²	130	139.7 Å²	139.7	91%	0.909	77%	0.773	S	S	*	*				-157.6	121.9	113.2	-87.2	0	0	0	0	113.5
748	K	32	Very low	37.3	Very low	166 Å²	166	137.1 Å²	137.1	72%	0.722	77%	0.765	S	S	*	*			trans	-101	141.2	-178.8	-62.1	166.1	-177.6	95.8	0	111.8	D746	D746-K748 IonicContact OD1-NZ 2.73Å; D746-K748 PolarHBondContact OD1-NZ 3.07Å
749	K	33.4	Very low	37.4	Very low	199 Å²	199	136.7 Å²	136.7	87%	0.865	75%	0.754	S	S	*	*			trans	175.5	104.2	141.4	-94.6	146.1	-167	167.5	0	113.3
750	N	32.2	Very low	37.4	Very low	167 Å²	167	138.2 Å²	138.2	89%	0.893	75%	0.749	S	S	*	*			trans	167	109.7	132.7	-86.6	-17.2	0	0	0	110.8
751	E	34.8	Very low	37.4	Very low	138 Å²	138	139 Å²	139	65%	0.645	74%	0.736	S	S	*	*			trans	-127.2	135.1	165.5	-83.1	-168.8	151.4	0	0	109.1	K755	E751-K755 IonicContact OE1-NZ 3.22Å; E751-K755 PolarHBondContact OE1-NZ 3.45Å; E751-K755 VanDerWaalsContact OE2-CE 3.27Å; E751-K755 WeakPolarHBondContact OE2-CE 3.27Å; E751-K755 IonicContact OE2-NZ 2.65Å; E751-K755 PolarHBondContact OE2-NZ 3.4Å
752	P	34.2	Very low	37.9	Very low	126 Å²	126	137.8 Å²	137.8	82%	0.818	73%	0.726	S	S	*	*			trans	-79.6	142.3	160	33	-31.5	0	0	0	110.7	F754	P752-F754 PolarHBondContact O-N 3.11Å
753	I	32.3	Very low	38.6	Very low	161 Å²	161	134.8 Å²	134.8	83%	0.826	72%	0.724	S	S	*	*	S	Bend	trans	-90.8	103.7	-167.4	-59.8	166	0	0	0	111.9
754	F	35.6	Very low	39	Very low	184 Å²	184	133.4 Å²	133.4	81%	0.807	71%	0.707	S	S	*	*			trans	-156	109.2	148.8	-143.1	-94.6	0	0	0	110.4	P752 V756	P752-F754 PolarHBondContact O-N 3.11Å; F754-V756 HydrophobicContact CD1-CG2 4.21Å; F754-V756 HydrophobicContact CE1-CG2 4.4Å
755	K	36.9	Very low	39.4	Very low	155 Å²	155	132.7 Å²	132.7	67%	0.674	70%	0.698	S	S	*	*			trans	-111.4	105.3	178.2	-62.1	-164.8	177.7	-169	0	109.6	E751	E751-K755 IonicContact OE1-NZ 3.22Å; E751-K755 PolarHBondContact OE1-NZ 3.45Å; E751-K755 VanDerWaalsContact OE2-CE 3.27Å; E751-K755 WeakPolarHBondContact OE2-CE 3.27Å; E751-K755 IonicContact OE2-NZ 2.65Å; E751-K755 PolarHBondContact OE2-NZ 3.4Å
756	V	44.4	Very low	40	Very low	122 Å²	122	131 Å²	131	74%	0.739	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-74	147	166.6	-177.3	0	0	0	0	107.6	F754	F754-V756 HydrophobicContact CD1-CG2 4.21Å; F754-V756 HydrophobicContact CE1-CG2 4.4Å
757	A	42.7	Very low	41	Very low	85 Å²	85	129.3 Å²	129.3	70%	0.702	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-71.9	138.9	175.3	0	0	0	0	0	110.1
758	P	40.6	Very low	41.9	Very low	110 Å²	110	128.4 Å²	128.4	71%	0.714	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-60.8	149.5	178.9	25.9	-34.4	0	0	0	111.4	E762	P758-E762 WeakPolarHBondContact CA-OE2 3.48Å; P758-E762 WeakPolarHBondContact CB-OE2 3.41Å
759	S	43.5	Very low	42.7	Very low	41 Å²	41	124 Å²	124	29%	0.287	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-81.2	156.1	-178.5	-163.6	0	0	0	0	111.4	R440 W761 E762	R440-S759 PolarHBondContact O-OG 2.68Å; S759-W761 PolarHBondContact O-N 2.94Å; S759-E762 PolarHBondContact N-OE2 3.27Å; S759-E762 PolarHBondContact O-N 2.98Å
760	K	45.2	Very low	43.5	Very low	182 Å²	182	121.7 Å²	121.7	79%	0.791	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-14.1	-179.4	-161.4	-168.3	170.1	-161.2	0	113
761	W	43.8	Very low	44.6	Very low	133 Å²	133	117.8 Å²	117.8	50%	0.504	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103	-4.9	-172.3	-58.6	105.1	0	0	0	114.5	E441 S759 A763 V764	E441-W761 VanDerWaalsContact O-CD1 3.32Å; S759-W761 PolarHBondContact O-N 2.94Å; W761-A763 PolarHBondContact O-N 3.03Å; W761-V764 HydrophobicContact CE3-CG2 3.8Å; W761-V764 HydrophobicContact CZ3-CG2 4.26Å; W761-V764 PolarHBondContact O-N 2.95Å
762	E	52.7	Low	45.3	Very low	149 Å²	149	116.4 Å²	116.4	70%	0.696	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	21.9	173.8	-67.6	175.1	102.7	0	0	113.2	P758 S759	P758-E762 WeakPolarHBondContact CA-OE2 3.48Å; P758-E762 WeakPolarHBondContact CB-OE2 3.41Å; S759-E762 PolarHBondContact N-OE2 3.27Å; S759-E762 PolarHBondContact O-N 2.98Å
763	A	51.1	Low	45.5	Very low	94 Å²	94	112.9 Å²	112.9	78%	0.777	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.3	22.1	-176.6	0	0	0	0	0	112.6	W761	W761-A763 PolarHBondContact O-N 3.03Å
764	V	45.5	Very low	45.8	Very low	52 Å²	52	109.8 Å²	109.8	32%	0.315	60%	0.599	S	S	.	*	S	Bend	trans	-103.2	143	172.1	175.3	0	0	0	0	108.9	W761 E768 L769	W761-V764 HydrophobicContact CE3-CG2 3.8Å; W761-V764 HydrophobicContact CZ3-CG2 4.26Å; W761-V764 PolarHBondContact O-N 2.95Å; V764-E768 HydrophobicContact CG1-CB 4.12Å; V764-L769 HydrophobicContact CG1-CD1 4.42Å
765	D	41.7	Very low	45.8	Very low	103 Å²	103	105.7 Å²	105.7	55%	0.551	59%	0.589	S	S	*	*			trans	-66.8	136.7	-175.1	-160.3	-55.2	0	0	0	111.2	S767 E768 L769	D765-S767 PolarHBondContact O-N 3.45Å; D765-S767 VanDerWaalsContact O-N 3.15Å; D765-S767 PolarHBondContact OD1-N 3.35Å; D765-S767 VanDerWaalsContact OD1-N 3.14Å; D765-S767 PolarHBondContact OD1-OG 2.89Å; D765-E768 PolarHBondContact O-N 2.81Å; D765-L769 PolarHBondContact O-N 3.48Å; D765-L769 VanDerWaalsContact O-N 3.1Å
766	E	48	Very low	45.8	Very low	145 Å²	145	102.4 Å²	102.4	68%	0.678	58%	0.582	S	S	*	*	H	α-helix	trans	-54.4	-35.4	-179.6	-159.2	95.5	-133.2	0	0	110.9	L769 E770	E766-L769 WeakPolarHBondContact O-CA 3.36Å; E766-L769 WeakPolarHBondContact O-CB 3.24Å; E766-L769 PolarHBondContact O-N 3.2Å; E766-L769 VanDerWaalsContact O-N 3.17Å; E766-E770 PolarHBondContact O-N 3.21Å
767	S	53.6	Low	45.8	Very low	73 Å²	73	101 Å²	101	51%	0.51	58%	0.578	S	S	.	*	H	α-helix	trans	-70.9	-32.1	178.7	60.9	0	0	0	0	114.4	D765 L769 A771	D765-S767 PolarHBondContact O-N 3.45Å; D765-S767 VanDerWaalsContact O-N 3.15Å; D765-S767 PolarHBondContact OD1-N 3.35Å; D765-S767 VanDerWaalsContact OD1-N 3.14Å; D765-S767 PolarHBondContact OD1-OG 2.89Å; S767-L769 VanDerWaalsContact C-N 3.31Å; S767-A771 WeakPolarHBondContact O-CB 3.45Å; S767-A771 PolarHBondContact O-N 3.05Å
768	E	54.8	Low	45.7	Very low	112 Å²	112	103 Å²	103	52%	0.523	57%	0.571	S	S	.	*	H	α-helix	trans	-73.4	-27.7	169.4	-100.7	-166.9	159.3	0	0	111.7	V764 D765 Q772	V764-E768 HydrophobicContact CG1-CB 4.12Å; D765-E768 PolarHBondContact O-N 2.81Å; E768-Q772 WeakPolarHBondContact O-CG 3.42Å; E768-Q772 PolarHBondContact O-N 3.23Å; E768-Q772 PolarHBondContact O-NE2 2.9Å; E768-Q772 VanDerWaalsContact O-NE2 3.15Å
769	L	49.2	Very low	45.6	Very low	73 Å²	73	104.7 Å²	104.7	38%	0.382	56%	0.563	S	S	.	*	H	α-helix	trans	-70.1	-49.9	177	-140.9	79.2	0	0	0	111	V764 D765 E766 S767 A771 Q772 A773	V764-L769 HydrophobicContact CG1-CD1 4.42Å; D765-L769 PolarHBondContact O-N 3.48Å; D765-L769 VanDerWaalsContact O-N 3.1Å; E766-L769 WeakPolarHBondContact O-CA 3.36Å; E766-L769 WeakPolarHBondContact O-CB 3.24Å; E766-L769 PolarHBondContact O-N 3.2Å; E766-L769 VanDerWaalsContact O-N 3.17Å; S767-L769 VanDerWaalsContact C-N 3.31Å; L769-A771 VanDerWaalsContact C-N 3.33Å; L769-A771 PolarHBondContact O-N 3.44Å; L769-Q772 PolarHBondContact O-N 3.11Å; L769-A773 VanDerWaalsContact O-CB 3.27Å; L769-A773 WeakPolarHBondContact O-CB 3.32Å; L769-A773 PolarHBondContact O-N 2.88Å
770	E	50.6	Low	45.5	Very low	151 Å²	151	109.6 Å²	109.6	71%	0.706	58%	0.582	S	S	*	*	H	α-helix	trans	-59.8	-41.3	176.6	-72.2	-171.3	144.9	0	0	112.1	E766 Q772 A773	E766-E770 PolarHBondContact O-N 3.21Å; E770-Q772 VanDerWaalsContact C-N 3.25Å; E770-Q772 PolarHBondContact O-N 3.26Å; E770-A773 PolarHBondContact O-N 3.33Å
771	A	54.7	Low	45.3	Very low	85 Å²	85	106.4 Å²	106.4	70%	0.702	57%	0.573	S	S	*	*	H	α-helix	trans	-65.8	-23.8	179.3	0	0	0	0	0	114.1	S767 L769	S767-A771 WeakPolarHBondContact O-CB 3.45Å; S767-A771 PolarHBondContact O-N 3.05Å; L769-A771 VanDerWaalsContact C-N 3.33Å; L769-A771 PolarHBondContact O-N 3.44Å
772	Q	49.5	Very low	44.8	Very low	108 Å²	108	104.9 Å²	104.9	51%	0.505	57%	0.57	S	S	.	*	H	α-helix	trans	-100.5	-17.4	179.2	-68.7	176.1	64.7	0	0	113.2	M444 E768 L769 E770 V774	M444-Q772 HydrophobicContact CE-CB 4.23Å; E768-Q772 WeakPolarHBondContact O-CG 3.42Å; E768-Q772 PolarHBondContact O-N 3.23Å; E768-Q772 PolarHBondContact O-NE2 2.9Å; E768-Q772 VanDerWaalsContact O-NE2 3.15Å; L769-Q772 PolarHBondContact O-N 3.11Å; E770-Q772 VanDerWaalsContact C-N 3.25Å; E770-Q772 PolarHBondContact O-N 3.26Å; Q772-V774 VanDerWaalsContact C-N 3.34Å; Q772-V774 PolarHBondContact O-N 2.92Å
773	A	39.5	Very low	44.3	Very low	53 Å²	53	102.8 Å²	102.8	44%	0.438	56%	0.563	S	S	.	*			trans	-80.5	70.2	-176.8	0	0	0	0	0	113.1	L769 E770 T775	L769-A773 VanDerWaalsContact O-CB 3.27Å; L769-A773 WeakPolarHBondContact O-CB 3.32Å; L769-A773 PolarHBondContact O-N 2.88Å; E770-A773 PolarHBondContact O-N 3.33Å; A773-T775 HydrophobicContact CB-CG2 4.46Å; A773-T775 PolarHBondContact O-N 2.94Å
774	V	38.7	Very low	43.7	Very low	96 Å²	96	104.4 Å²	104.4	58%	0.582	56%	0.555	S	S	*	*			trans	-69.3	81.8	166.9	-174.6	0	0	0	0	109.5	Q772 W779	Q772-V774 VanDerWaalsContact C-N 3.34Å; Q772-V774 PolarHBondContact O-N 2.92Å; V774-W779 HydrophobicContact CG1-CZ2 4.17Å
775	T	35	Very low	43.2	Very low	98 Å²	98	106.7 Å²	106.7	60%	0.601	56%	0.562	S	S	*	*			trans	-73.1	162.5	176.6	63	0	0	0	0	111.5	A773 S777 K778	A773-T775 HydrophobicContact CB-CG2 4.46Å; A773-T775 PolarHBondContact O-N 2.94Å; T775-S777 PolarHBondContact O-N 3.05Å; T775-K778 PolarHBondContact O-N 3.34Å
776	T	38.2	Very low	43	Very low	86 Å²	86	108.4 Å²	108.4	53%	0.528	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-63.7	-11.6	-165.7	52.8	0	0	0	0	115.6	K778	T776-K778 VanDerWaalsContact C-N 3.31Å; T776-K778 PolarHBondContact O-N 3.27Å
777	S	43.7	Very low	42.5	Very low	93 Å²	93	108.1 Å²	108.1	65%	0.65	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-77.5	-6.8	-176.5	-164.1	0	0	0	0	114.9	T775	T775-S777 PolarHBondContact O-N 3.05Å
778	K	39.5	Very low	41.7	Very low	125 Å²	125	106.9 Å²	106.9	54%	0.543	56%	0.556	S	S	.	*	G	3₁₀ helix	trans	-92.9	-15	-178.1	-161	173.9	-179.7	-178.2	0	114.1	T775 T776 L781 F782	T775-K778 PolarHBondContact O-N 3.34Å; T776-K778 VanDerWaalsContact C-N 3.31Å; T776-K778 PolarHBondContact O-N 3.27Å; K778-L781 WeakPolarHBondContact O-CB 3.26Å; K778-L781 PolarHBondContact O-N 3.29Å; K778-F782 HydrophobicContact CD-CE2 4.42Å; K778-F782 HydrophobicContact CG-CE2 4.26Å
779	W	38.8	Very low	40.9	Very low	146 Å²	146	106.4 Å²	106.4	55%	0.553	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-27.6	-170.7	-66.2	96.8	0	0	0	114.2	V774 L781 F782 D783	V774-W779 HydrophobicContact CG1-CZ2 4.17Å; W779-L781 PolarHBondContact O-N 3.33Å; W779-F782 HydrophobicContact CE3-CB 4.44Å; W779-F782 HydrophobicContact CE3-CD2 4.38Å; W779-F782 PolarHBondContact O-N 2.89Å; W779-D783 PolarHBondContact O-N 3.3Å
780	E	42.5	Very low	40.4	Very low	145 Å²	145	109.4 Å²	109.4	68%	0.678	57%	0.566	S	S	*	*	H	α-helix	trans	-60.3	-15.2	168.9	-67.2	176.7	139.4	0	0	112.9	Q784	E780-Q784 WeakPolarHBondContact O-CG 3.38Å
781	L	40.5	Very low	39.8	Very low	115 Å²	115	109 Å²	109	60%	0.602	56%	0.564	S	S	*	*	H	α-helix	trans	-97.2	-0.1	177.4	-116.2	159.4	0	0	0	113.5	K778 W779	K778-L781 WeakPolarHBondContact O-CB 3.26Å; K778-L781 PolarHBondContact O-N 3.29Å; W779-L781 PolarHBondContact O-N 3.33Å
782	F	34.1	Very low	39	Very low	101 Å²	101	111 Å²	111	44%	0.443	56%	0.559	S	S	.	*	H	α-helix	trans	-105.6	-42.4	172.8	-84.4	-80.8	0	0	0	111.7	K778 W779 Q784 H785 E786	K778-F782 HydrophobicContact CD-CE2 4.42Å; K778-F782 HydrophobicContact CG-CE2 4.26Å; W779-F782 HydrophobicContact CE3-CB 4.44Å; W779-F782 HydrophobicContact CE3-CD2 4.38Å; W779-F782 PolarHBondContact O-N 2.89Å; F782-Q784 PolarHBondContact O-N 3.21Å; F782-H785 PolarHBondContact O-N 2.64Å; F782-E786 PolarHBondContact O-N 2.98Å
783	D	41.8	Very low	38.4	Very low	104 Å²	104	111.2 Å²	111.2	56%	0.556	56%	0.564	S	S	*	*	H	α-helix	trans	-55.9	-42.8	173.4	-64.9	-16.3	0	0	0	110.6	W779 H785 E786 E787	W779-D783 PolarHBondContact O-N 3.3Å; D783-H785 VanDerWaalsContact C-N 3.27Å; D783-H785 PolarHBondContact O-N 3.18Å; D783-E786 PolarHBondContact O-N 3.11Å; D783-E787 WeakPolarHBondContact O-CG 3.49Å; D783-E787 PolarHBondContact O-N 2.85Å
784	Q	37.8	Very low	38.3	Very low	129 Å²	129	115.9 Å²	115.9	60%	0.603	58%	0.576	S	S	*	*	H	α-helix	trans	-66.1	-22.9	175.3	-71.2	-177.9	-0.6	0	0	114.4	E780 F782 S788	E780-Q784 WeakPolarHBondContact O-CG 3.38Å; F782-Q784 PolarHBondContact O-N 3.21Å; Q784-S788 WeakPolarHBondContact O-CB 3.38Å; Q784-S788 PolarHBondContact O-N 3.16Å; Q784-S788 PolarHBondContact O-OG 2.92Å
785	H	36	Very low	38.1	Very low	100 Å²	100	117.7 Å²	117.7	46%	0.463	58%	0.583	S	S	.	*	H	α-helix	trans	-83.8	-41.2	179.3	-135.3	-79.1	0	0	0	110.7	F782 D783 S788 E789	F782-H785 PolarHBondContact O-N 2.64Å; D783-H785 VanDerWaalsContact C-N 3.27Å; D783-H785 PolarHBondContact O-N 3.18Å; H785-S788 WeakPolarHBondContact CA-OG 3.14Å; H785-S788 PolarHBondContact O-N 2.99Å; H785-S788 PolarHBondContact O-OG 2.87Å; H785-E789 IonicContact CE1-OE1 3.22Å; H785-E789 PolarHBondContact CE1-OE1 3.09Å; H785-E789 IonicContact CG-OE1 3.09Å; H785-E789 IonicContact ND1-OE1 3.73Å; H785-E789 PolarHBondContact ND1-OE1 3.05Å; H785-E789 WeakPolarHBondContact O-CB 3.45Å; H785-E789 WeakPolarHBondContact O-CG 3.46Å; H785-E789 PolarHBondContact O-N 3.11Å
786	E	37.1	Very low	38	Very low	138 Å²	138	119.9 Å²	119.9	65%	0.645	59%	0.586	S	S	*	*	H	α-helix	trans	-66.2	-41.2	173.3	-67.2	-171.6	165.1	0	0	111.3	F782 D783 S788 E789 E790	F782-E786 PolarHBondContact O-N 2.98Å; D783-E786 PolarHBondContact O-N 3.11Å; E786-S788 PolarHBondContact O-N 2.88Å; E786-E789 PolarHBondContact O-N 3.07Å; E786-E790 PolarHBondContact O-N 3.08Å
787	E	37.5	Very low	37.7	Very low	140 Å²	140	124.5 Å²	124.5	65%	0.654	60%	0.602	S	S	*	*	H	α-helix	trans	-61.2	-41.3	172.4	-73.2	-175.9	154.6	0	0	112.1	D783 E791	D783-E787 WeakPolarHBondContact O-CG 3.49Å; D783-E787 PolarHBondContact O-N 2.85Å; E787-E791 PolarHBondContact O-N 3.37Å; E787-E791 VanDerWaalsContact O-N 3.09Å
788	S	37.3	Very low	37.1	Very low	47 Å²	47	129.4 Å²	129.4	33%	0.329	61%	0.614	S	S	.	*	H	α-helix	trans	-70	-36.1	176.5	65.6	0	0	0	0	113.9	Q784 H785 E786 E791 E792	Q784-S788 WeakPolarHBondContact O-CB 3.38Å; Q784-S788 PolarHBondContact O-N 3.16Å; Q784-S788 PolarHBondContact O-OG 2.92Å; H785-S788 WeakPolarHBondContact CA-OG 3.14Å; H785-S788 PolarHBondContact O-N 2.99Å; H785-S788 PolarHBondContact O-OG 2.87Å; E786-S788 PolarHBondContact O-N 2.88Å; S788-E791 PolarHBondContact O-N 3.16Å; S788-E792 WeakPolarHBondContact O-CB 3.44Å; S788-E792 PolarHBondContact O-N 2.97Å
789	E	37.4	Very low	36.8	Very low	101 Å²	101	132.8 Å²	132.8	47%	0.472	63%	0.632	S	S	.	*	H	α-helix	trans	-73.8	-31	178.1	-75.5	178.2	-141.9	0	0	111.5	H785 E786 N793	H785-E789 IonicContact CE1-OE1 3.22Å; H785-E789 PolarHBondContact CE1-OE1 3.09Å; H785-E789 IonicContact CG-OE1 3.09Å; H785-E789 IonicContact ND1-OE1 3.73Å; H785-E789 PolarHBondContact ND1-OE1 3.05Å; H785-E789 WeakPolarHBondContact O-CB 3.45Å; H785-E789 WeakPolarHBondContact O-CG 3.46Å; H785-E789 PolarHBondContact O-N 3.11Å; E786-E789 PolarHBondContact O-N 3.07Å; E789-N793 WeakPolarHBondContact O-CB 3.25Å; E789-N793 PolarHBondContact O-N 3.45Å; E789-N793 PolarHBondContact O-ND2 3.21Å
790	E	38.5	Very low	36.4	Very low	137 Å²	137	131 Å²	131	64%	0.64	64%	0.642	S	S	*	*	H	α-helix	trans	-74	-30.7	171.6	-70.7	-163.8	167.3	0	0	113	E786 Q794	E786-E790 PolarHBondContact O-N 3.08Å; E790-Q794 WeakPolarHBondContact O-CG 3.36Å; E790-Q794 PolarHBondContact O-N 2.96Å; E790-Q794 PolarHBondContact O-NE2 2.98Å
791	E	38.7	Very low	36.2	Very low	142 Å²	142	132.5 Å²	132.5	66%	0.664	65%	0.649	S	S	*	*	H	α-helix	trans	-76.5	-39.3	171.8	-73	-164.8	160.4	0	0	113.1	E787 S788 Q794 N795	E787-E791 PolarHBondContact O-N 3.37Å; E787-E791 VanDerWaalsContact O-N 3.09Å; S788-E791 PolarHBondContact O-N 3.16Å; E791-Q794 PolarHBondContact O-N 3.31Å; E791-N795 PolarHBondContact O-N 2.87Å; E791-N795 PolarHBondContact O-ND2 2.98Å
792	E	37.1	Very low	36	Very low	128 Å²	128	134.2 Å²	134.2	60%	0.598	66%	0.659	S	S	*	*	H	α-helix	trans	-70.1	-33.9	177.9	-76.3	-165.1	163.8	0	0	113.1	S788 N795 Q796	S788-E792 WeakPolarHBondContact O-CB 3.44Å; S788-E792 PolarHBondContact O-N 2.97Å; E792-N795 PolarHBondContact O-N 3.35Å; E792-Q796 WeakPolarHBondContact O-CG 3.01Å; E792-Q796 PolarHBondContact O-NE2 3.5Å; E792-Q796 VanDerWaalsContact O-NE2 3.08Å
793	N	36.8	Very low	36.1	Very low	111 Å²	111	137.3 Å²	137.3	59%	0.594	68%	0.675	S	S	*	*	H	α-helix	trans	-74.6	-23.2	176.2	-78.9	-75.8	0	0	0	113.4	E789	E789-N793 WeakPolarHBondContact O-CB 3.25Å; E789-N793 PolarHBondContact O-N 3.45Å; E789-N793 PolarHBondContact O-ND2 3.21Å
794	Q	36.8	Very low	35.8	Very low	151 Å²	151	140.2 Å²	140.2	71%	0.706	69%	0.685	S	S	*	*	H	α-helix	trans	-82.6	-11.5	174.9	-78	174.4	86.9	0	0	113.6	E790 E791	E790-Q794 WeakPolarHBondContact O-CG 3.36Å; E790-Q794 PolarHBondContact O-N 2.96Å; E790-Q794 PolarHBondContact O-NE2 2.98Å; E791-Q794 PolarHBondContact O-N 3.31Å
795	N	34.6	Very low	35.6	Very low	135 Å²	135	140.1 Å²	140.1	72%	0.722	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	13.8	178.9	-73.7	-75.9	0	0	0	113.7	E791 E792	E791-N795 PolarHBondContact O-N 2.87Å; E791-N795 PolarHBondContact O-ND2 2.98Å; E792-N795 PolarHBondContact O-N 3.35Å
796	Q	33	Very low	35.4	Very low	143 Å²	143	140.2 Å²	140.2	67%	0.668	70%	0.696	S	S	*	*	S	Bend	trans	-123.2	4	-176.8	-72.7	180	59.7	0	0	115.3	E792	E792-Q796 WeakPolarHBondContact O-CG 3.01Å; E792-Q796 PolarHBondContact O-NE2 3.5Å; E792-Q796 VanDerWaalsContact O-NE2 3.08Å
797	E	32.9	Very low	35.2	Very low	183 Å²	183	142.2 Å²	142.2	86%	0.855	71%	0.706	S	S	*	*	S	Bend	trans	-106.1	5.4	178.5	-65.5	-160.1	141.3	0	0	115
798	E	31.1	Very low	34.9	Very low	196 Å²	196	140.3 Å²	140.3	92%	0.916	71%	0.708	S	S	*	*	S	Bend	trans	-120.5	43.7	179.8	-65.9	-158.8	158.5	0	0	114.8
799	E	31.7	Very low	34.7	Very low	196 Å²	196	142.9 Å²	142.9	92%	0.916	73%	0.726	S	S	*	*			trans	-141.5	59.7	176.5	-146.9	174.6	-128	0	0	115.7
800	S	32	Very low	34.5	Very low	109 Å²	109	147.1 Å²	147.1	76%	0.762	74%	0.743	S	S	*	*			trans	-160	157	165	61.6	0	0	0	0	114.1
801	E	37.1	Very low	34.1	Very low	177 Å²	177	144.9 Å²	144.9	83%	0.827	74%	0.743	S	S	*	*			trans	80.9	64.6	171.8	-54.5	-166.6	173.2	0	0	117.9
802	D	35.9	Very low	33.9	Very low	151 Å²	151	147.1 Å²	147.1	81%	0.807	75%	0.753	S	S	*	*				54.7	129.7	113.2	-64.2	-13.9	0	0	0	123.7
803	E	36.8	Very low	33.7	Very low	166 Å²	166	149.9 Å²	149.9	78%	0.776	77%	0.766	S	S	*	*			trans	75.4	110.5	137.9	-61.2	-83.5	91.2	0	0	122.2
804	E	35.5	Very low	33.4	Very low	164 Å²	164	152.7 Å²	152.7	77%	0.766	78%	0.775	S	S	*	*			trans	77.4	137.3	140	-60.3	-151.8	134.9	0	0	125.1
805	D	34.5	Very low	33.1	Very low	127 Å²	127	152.5 Å²	152.5	68%	0.679	77%	0.774	S	S	*	*			trans	74.8	92.5	143.7	-93.1	17.9	0	0	0	125.2
806	T	31.8	Very low	32.9	Very low	102 Å²	102	152.7 Å²	152.7	63%	0.626	77%	0.774	S	S	*	*				89.5	125	122.2	62.9	0	0	0	0	122.3
807	Q	32.2	Very low	32.9	Very low	180 Å²	180	157 Å²	157	84%	0.841	79%	0.786	S	S	*	*			trans	44.7	120.2	135	-52.5	-177.7	16.9	0	0	117.8
808	S	31.5	Very low	32.7	Very low	101 Å²	101	153 Å²	153	71%	0.706	78%	0.778	S	S	*	*				176.3	136.5	55.9	-168.5	0	0	0	0	114.3
809	S	32.6	Very low	32.9	Very low	101 Å²	101	150.3 Å²	150.3	71%	0.706	77%	0.77	S	S	*	*			trans	69.7	132.6	143.1	74.1	0	0	0	0	123.1
810	K	32.7	Very low	33	Very low	189 Å²	189	146.7 Å²	146.7	82%	0.822	76%	0.763	S	S	*	*			trans	83.3	104.2	139.6	-88.1	-170	168.1	-170.1	0	121.7
811	S	31.1	Very low	32.9	Very low	91 Å²	91	148.8 Å²	148.8	64%	0.636	76%	0.764	S	S	*	*				52.7	138.4	112.7	70.1	0	0	0	0	119.2
812	E	34.1	Very low	32.5	Very low	188 Å²	188	148.1 Å²	148.1	88%	0.879	76%	0.759	S	S	*	*			cis	-148.9	168.9	40.8	-70.3	173.2	152.8	0	0	112.9
813	E	33.6	Very low	32.3	Very low	187 Å²	187	149.7 Å²	149.7	87%	0.874	76%	0.761	S	S	*	*			trans	-79.9	135.3	176.1	-56.6	168.5	108.8	0	0	112.4
814	H	30.3	Very low	32	Very low	170 Å²	170	149.4 Å²	149.4	79%	0.787	76%	0.76	S	S	*	*			trans	-161.1	106.3	145.2	-135.5	-98	0	0	0	116.6
815	H	29.9	Very low	31.7	Very low	146 Å²	146	149 Å²	149	68%	0.676	76%	0.76	S	S	*	*			trans	25.6	135.6	135.9	-78.6	-68.7	0	0	0	123.9
816	L	30.2	Very low	31.4	Very low	139 Å²	139	147 Å²	147	73%	0.728	75%	0.753	S	S	*	*			trans	75.8	109.2	133.2	-67.7	166.9	0	0	0	121.7
817	Y	32.9	Very low	31.3	Very low	234 Å²	234	150.8 Å²	150.8	92%	0.918	76%	0.763	S	S	*	*			trans	-141.5	125.4	133.8	-83.9	-87.6	0	0	0	107.2
818	S	28.5	Very low	31.4	Very low	99 Å²	99	147.6 Å²	147.6	69%	0.692	76%	0.76	S	S	*	*			cis	90.1	129.4	23	-155.9	0	0	0	0	115
819	N	36.7	Very low	31.5	Very low	140 Å²	140	149.9 Å²	149.9	75%	0.749	76%	0.758	S	S	*	*			trans	-68.8	145.5	-160.9	-61.6	-63.9	0	0	0	115.8
820	P	33.9	Very low	31.4	Very low	119 Å²	119	153.9 Å²	153.9	77%	0.773	76%	0.763	S	S	*	*			trans	-83.2	106.7	146.8	32.6	-26.3	0	0	0	108.9
821	I	28.7	Very low	31.3	Very low	153 Å²	153	149.8 Å²	149.8	79%	0.785	76%	0.758	S	S	*	*				67.6	122.3	75.9	-64.1	173.4	0	0	0	112.9
822	K	29.5	Very low	31.5	Very low	163 Å²	163	154.2 Å²	154.2	71%	0.709	77%	0.766	S	S	*	*			trans	-56.9	137.6	177.4	-66.4	176.5	160.8	-161	0	113.1	E824	K822-E824 IonicContact NZ-OE1 2.71Å; K822-E824 PolarHBondContact NZ-OE1 3.27Å
823	E	31	Very low	31.6	Very low	184 Å²	184	155.5 Å²	155.5	86%	0.86	76%	0.764	S	S	*	*			trans	-109.5	94.2	151.8	-69.3	-151.8	131.5	0	0	110.8	M825	E823-M825 PolarHBondContact O-N 3.18Å
824	E	30.3	Very low	31.8	Very low	161 Å²	161	151.7 Å²	151.7	75%	0.752	76%	0.758	S	S	*	*			trans	-75.5	67.6	166	-76.8	177.7	-168.6	0	0	110.1	K822	K822-E824 IonicContact NZ-OE1 2.71Å; K822-E824 PolarHBondContact NZ-OE1 3.27Å
825	M	28.8	Very low	32.1	Very low	156 Å²	156	152.4 Å²	152.4	77%	0.768	76%	0.762	S	S	*	*			trans	-153.3	143.4	177	-134.3	173.5	-175	0	0	113.9	E823	E823-M825 PolarHBondContact O-N 3.18Å
826	T	29.2	Very low	33.4	Very low	85 Å²	85	149.9 Å²	149.9	52%	0.521	75%	0.751	S	S	.	*			trans	94.7	4.2	164	79.7	0	0	0	0	122.5	S828 K829	T826-S828 PolarHBondContact O-N 3.19Å; T826-K829 HydrophobicContact CG2-CD 4.44Å; T826-K829 PolarHBondContact O-N 2.84Å
827	E	29.7	Very low	35.6	Very low	181 Å²	181	145.8 Å²	145.8	85%	0.846	73%	0.734	S	S	*	*	H	α-helix	trans	-49.8	-35.4	166.1	-84.3	-166.3	132.6	0	0	112.6	K829 F830	E827-K829 PolarHBondContact O-N 3.32Å; E827-F830 PolarHBondContact O-N 3.01Å
828	S	33.9	Very low	37.6	Very low	112 Å²	112	142 Å²	142	78%	0.783	73%	0.725	S	S	*	*	H	α-helix	trans	-62.3	-2.7	177.3	-36.8	0	0	0	0	115.9	T826	T826-S828 PolarHBondContact O-N 3.19Å
829	K	34.5	Very low	39.9	Very low	150 Å²	150	142.8 Å²	142.8	65%	0.652	72%	0.718	S	S	*	*	H	α-helix	trans	-102.4	-31.3	176.2	-73.8	-176.7	178.3	174.5	0	113.9	T826 E827 S831 K832	T826-K829 HydrophobicContact CG2-CD 4.44Å; T826-K829 PolarHBondContact O-N 2.84Å; E827-K829 PolarHBondContact O-N 3.32Å; K829-S831 VanDerWaalsContact C-N 3.33Å; K829-S831 PolarHBondContact O-N 2.95Å; K829-K832 PolarHBondContact O-N 3.23Å
830	F	30.9	Very low	42	Very low	185 Å²	185	139.8 Å²	139.8	81%	0.811	70%	0.698	S	S	*	*	H	α-helix	trans	-66.6	-35.8	-175.2	-128.5	-95.5	0	0	0	112.2	E827 K832 Y833	E827-F830 PolarHBondContact O-N 3.01Å; F830-K832 PolarHBondContact O-N 3.31Å; F830-Y833 PolarHBondContact O-N 2.99Å
831	S	30.1	Very low	44.3	Very low	103 Å²	103	140.5 Å²	140.5	72%	0.72	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	1.7	179.4	-53.1	0	0	0	0	116.1	K829	K829-S831 VanDerWaalsContact C-N 3.33Å; K829-S831 PolarHBondContact O-N 2.95Å
832	K	34.3	Very low	47	Very low	183 Å²	183	135.7 Å²	135.7	80%	0.796	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	-10.5	178.4	-84.9	-171.6	171.9	-176.1	0	115.9	K829 F830	K829-K832 PolarHBondContact O-N 3.23Å; F830-K832 PolarHBondContact O-N 3.31Å
833	Y	37.4	Very low	49.8	Very low	215 Å²	215	129.7 Å²	129.7	84%	0.843	64%	0.642	S	S	*	*	S	Bend	trans	-92.8	-12	-177.5	-76.5	-86.8	0	0	0	114.7	F830	F830-Y833 PolarHBondContact O-N 2.99Å
834	S	36.7	Very low	52.6	Low	108 Å²	108	124.7 Å²	124.7	76%	0.755	62%	0.621	S	S	*	*	S	Bend	trans	-81.7	-35.3	-172.7	-166.3	0	0	0	0	114.5	M836	S834-M836 PolarHBondContact O-N 2.76Å
835	E	37.3	Very low	55.5	Low	185 Å²	185	124.4 Å²	124.4	86%	0.864	61%	0.613	S	S	*	*			trans	-81.2	78.5	-178.3	-71.1	-158.7	121.2	0	0	113.1	S837	E835-S837 PolarHBondContact O-N 3.35Å
836	M	58.2	Low	58.5	Low	92 Å²	92	122.2 Å²	122.2	45%	0.453	60%	0.601	S	S	.	*			trans	-63.2	101.9	165.9	-172	-164.2	-61.8	0	0	109.9	S834 K840 R841 L844	S834-M836 PolarHBondContact O-N 2.76Å; M836-K840 HydrophobicContact CG-CB 4.02Å; M836-R841 HydrophobicContact CG-CG 4.26Å; M836-R841 HydrophobicContact SD-CG 3.79Å; M836-L844 HydrophobicContact SD-CD1 4.13Å
837	S	76.3	Confident	61.7	Low	53 Å²	53	118.7 Å²	118.7	37%	0.371	58%	0.579	S	S	.	*			trans	-56.8	151.8	-172.5	75.5	0	0	0	0	113.5	E835 E839 K840 R841	E835-S837 PolarHBondContact O-N 3.35Å; S837-E839 PolarHBondContact O-N 3.18Å; S837-K840 WeakPolarHBondContact O-CB 2.88Å; S837-K840 PolarHBondContact O-N 3.37Å; S837-K840 PolarHBondContact OG-N 2.9Å; S837-R841 PolarHBondContact O-N 3.03Å
838	E	74.2	Confident	64.6	Low	156 Å²	156	113.9 Å²	113.9	73%	0.729	56%	0.557	S	S	*	*	H	α-helix	trans	-58.7	-30.9	176.4	-173.7	164.7	-148.7	0	0	112.1	R841 A842	E838-R841 CarbonylContact O-C 3.58Å; E838-R841 PolarHBondContact O-N 3.33Å; E838-A842 WeakPolarHBondContact O-CB 3.49Å; E838-A842 PolarHBondContact O-N 3.38Å
839	E	77.5	Confident	67.5	Low	114 Å²	114	113.7 Å²	113.7	53%	0.533	55%	0.546	S	S	.	.	H	α-helix	trans	-65.6	-40.4	173	-160.1	-163.3	158.3	0	0	112.5	S837 A842 K843	S837-E839 PolarHBondContact O-N 3.18Å; E839-A842 PolarHBondContact O-N 2.98Å; E839-K843 WeakPolarHBondContact O-CG 3.31Å; E839-K843 PolarHBondContact O-N 3.01Å; E839-K843 VanDerWaalsContact OE1-CE 3.25Å; E839-K843 WeakPolarHBondContact OE1-CE 3.27Å; E839-K843 IonicContact OE1-NZ 2.85Å; E839-K843 PolarHBondContact OE1-NZ 3.23Å
840	K	80	Confident	70.4	Confident	78 Å²	78	110 Å²	110	34%	0.339	53%	0.53	S	S	.	.	H	α-helix	trans	-63.2	-44.9	170.9	-82	-169.4	173.5	-173.4	0	111.4	M836 S837 A842 K843 L844 E890	M836-K840 HydrophobicContact CG-CB 4.02Å; S837-K840 WeakPolarHBondContact O-CB 2.88Å; S837-K840 PolarHBondContact O-N 3.37Å; S837-K840 PolarHBondContact OG-N 2.9Å; K840-A842 PolarHBondContact O-N 3.35Å; K840-K843 PolarHBondContact O-N 3.04Å; K840-L844 WeakPolarHBondContact O-CG 3.36Å; K840-L844 PolarHBondContact O-N 3.39Å; K840-E890 WeakPolarHBondContact CE-OE1 3.41Å; K840-E890 WeakPolarHBondContact CE-OE2 3.48Å; K840-E890 VanDerWaalsContact NZ-CD 3.25Å; K840-E890 IonicContact NZ-OE1 3.29Å; K840-E890 PolarHBondContact NZ-OE1 3.14Å; K840-E890 IonicContact NZ-OE2 3.43Å; K840-E890 PolarHBondContact NZ-OE2 3.18Å
841	R	81.9	Confident	73.5	Confident	134 Å²	134	101.6 Å²	101.6	51%	0.506	49%	0.494	S	S	.	.	H	α-helix	trans	-64.2	-26	175.9	-66.6	-179	179.3	143.3	0.2	113.3	M836 S837 E838 R845	M836-R841 HydrophobicContact CG-CG 4.26Å; M836-R841 HydrophobicContact SD-CG 3.79Å; S837-R841 PolarHBondContact O-N 3.03Å; E838-R841 CarbonylContact O-C 3.58Å; E838-R841 PolarHBondContact O-N 3.33Å; R841-R845 WeakPolarHBondContact O-CG 3.22Å; R841-R845 PolarHBondContact O-NE 3.17Å
842	A	85.9	Confident	76.4	Confident	51 Å²	51	101.7 Å²	101.7	42%	0.421	48%	0.484	S	S	.	.	H	α-helix	trans	-73.8	-47.8	172.2	0	0	0	0	0	111.2	E838 E839 K840 L844 R845 E846	E838-A842 WeakPolarHBondContact O-CB 3.49Å; E838-A842 PolarHBondContact O-N 3.38Å; E839-A842 PolarHBondContact O-N 2.98Å; K840-A842 PolarHBondContact O-N 3.35Å; A842-L844 PolarHBondContact O-N 3.38Å; A842-R845 PolarHBondContact O-N 2.91Å; A842-E846 PolarHBondContact O-N 3.13Å
843	K	88.6	Confident	79.1	Confident	37 Å²	37	99.1 Å²	99.1	16%	0.161	47%	0.473	C	S	.	.	H	α-helix	trans	-60.9	-44	178.3	-71.2	164.4	-179.9	172.8	0	112.9	E839 K840 R845 E846 I847 E886	E839-K843 WeakPolarHBondContact O-CG 3.31Å; E839-K843 PolarHBondContact O-N 3.01Å; E839-K843 VanDerWaalsContact OE1-CE 3.25Å; E839-K843 WeakPolarHBondContact OE1-CE 3.27Å; E839-K843 IonicContact OE1-NZ 2.85Å; E839-K843 PolarHBondContact OE1-NZ 3.23Å; K840-K843 PolarHBondContact O-N 3.04Å; K843-R845 VanDerWaalsContact C-N 3.31Å; K843-R845 PolarHBondContact O-N 2.94Å; K843-E846 CarbonylContact O-C 3.45Å; K843-E846 WeakPolarHBondContact O-CB 3.25Å; K843-E846 PolarHBondContact O-N 2.85Å; K843-E846 VanDerWaalsContact O-N 3.09Å; K843-I847 WeakPolarHBondContact O-CG1 3.35Å; K843-I847 PolarHBondContact O-N 3.33Å; K843-E886 HydrophobicContact CB-CG 4.41Å; K843-E886 HydrophobicContact CD-CG 4.09Å; K843-E886 WeakPolarHBondContact CD-OE1 3.44Å; K843-E886 WeakPolarHBondContact CE-OE1 3.49Å; K843-E886 IonicContact NZ-OE1 3.38Å
844	L	89.7	Confident	81.8	Confident	80 Å²	80	89.9 Å²	89.9	42%	0.419	44%	0.437	S	S	.	.	H	α-helix	trans	-60.7	-39.5	176.3	-71.7	169.3	0	0	0	111.8	M836 K840 A842 I847 E848 L883	M836-L844 HydrophobicContact SD-CD1 4.13Å; K840-L844 WeakPolarHBondContact O-CG 3.36Å; K840-L844 PolarHBondContact O-N 3.39Å; A842-L844 PolarHBondContact O-N 3.38Å; L844-I847 PolarHBondContact O-N 3.07Å; L844-E848 PolarHBondContact O-N 2.89Å; L844-L883 HydrophobicContact CD2-CD2 4.05Å
845	R	90.4	Very high	84.4	Confident	154 Å²	154	87.9 Å²	87.9	58%	0.581	42%	0.416	S	S	*	.	H	α-helix	trans	-67.2	-34.3	172.9	-75.3	-179.1	-78.8	-173.4	-0.3	112.8	R841 A842 K843 L849	R841-R845 WeakPolarHBondContact O-CG 3.22Å; R841-R845 PolarHBondContact O-NE 3.17Å; A842-R845 PolarHBondContact O-N 2.91Å; K843-R845 VanDerWaalsContact C-N 3.31Å; K843-R845 PolarHBondContact O-N 2.94Å; R845-L849 WeakPolarHBondContact O-CB 3.3Å; R845-L849 VanDerWaalsContact O-CG 3.29Å; R845-L849 WeakPolarHBondContact O-CG 3.41Å; R845-L849 PolarHBondContact O-N 3.43Å; R845-L849 VanDerWaalsContact O-N 3.07Å
846	E	92.6	Very high	86.9	Confident	111 Å²	111	82.8 Å²	82.8	52%	0.519	40%	0.395	S	S	.	.	H	α-helix	trans	-71.8	-27.4	174	-155.9	-154.1	137.4	0	0	113.1	A842 K843 K850	A842-E846 PolarHBondContact O-N 3.13Å; K843-E846 CarbonylContact O-C 3.45Å; K843-E846 WeakPolarHBondContact O-CB 3.25Å; K843-E846 PolarHBondContact O-N 2.85Å; K843-E846 VanDerWaalsContact O-N 3.09Å; E846-K850 VanDerWaalsContact O-CD 3.3Å; E846-K850 WeakPolarHBondContact O-CD 3.44Å; E846-K850 WeakPolarHBondContact O-CE 3.43Å; E846-K850 WeakPolarHBondContact O-CG 3.45Å; E846-K850 WeakPolarHBondContact OE1-CE 3.47Å; E846-K850 IonicContact OE1-NZ 2.78Å; E846-K850 PolarHBondContact OE1-NZ 2.83Å
847	I	94.8	Very high	88.5	Confident	11 Å²	11	81.6 Å²	81.6	6%	0.056	39%	0.388	C	S	.	.	H	α-helix	trans	-70	-53.4	170.7	-71.4	172.3	0	0	0	109.3	K843 L844 L849 K850 V851 L882 L883 E886	K843-I847 WeakPolarHBondContact O-CG1 3.35Å; K843-I847 PolarHBondContact O-N 3.33Å; L844-I847 PolarHBondContact O-N 3.07Å; I847-L849 VanDerWaalsContact C-N 3.3Å; I847-L849 PolarHBondContact O-N 3.15Å; I847-K850 WeakPolarHBondContact O-CA 3.45Å; I847-K850 WeakPolarHBondContact O-CB 3.45Å; I847-K850 PolarHBondContact O-N 3.11Å; I847-V851 HydrophobicContact CG2-CG2 4.29Å; I847-V851 WeakPolarHBondContact O-CG2 3.44Å; I847-V851 PolarHBondContact O-N 3.24Å; I847-L882 HydrophobicContact CG1-CB 4.25Å; I847-L882 HydrophobicContact CG2-CB 3.83Å; I847-L882 HydrophobicContact CG2-CD1 4.1Å; I847-L883 HydrophobicContact CD1-CD2 4.05Å; I847-E886 HydrophobicContact CD1-CB 4.2Å
848	E	92.5	Very high	89.2	Confident	80 Å²	80	79.4 Å²	79.4	37%	0.374	37%	0.372	S	S	.	.	H	α-helix	trans	-66.2	-32.2	-174.9	-137.6	77.9	126.9	0	0	112.6	L844 K850 V851 M852 R879	L844-E848 PolarHBondContact O-N 2.89Å; E848-K850 PolarHBondContact O-N 3.43Å; E848-V851 PolarHBondContact O-N 3.33Å; E848-M852 WeakPolarHBondContact O-CB 3.48Å; E848-M852 PolarHBondContact O-N 3.38Å; E848-R879 IonicContact OE1-CZ 3.03Å; E848-R879 IonicContact OE1-NE 2.71Å; E848-R879 PolarHBondContact OE1-NE 3.29Å; E848-R879 IonicContact OE1-NH2 2.64Å; E848-R879 PolarHBondContact OE1-NH2 3Å; E848-R879 IonicContact OE2-CZ 2.99Å; E848-R879 IonicContact OE2-NE 3.19Å; E848-R879 PolarHBondContact OE2-NE 3.22Å; E848-R879 IonicContact OE2-NH2 4Å
849	L	92.9	Very high	89.8	Confident	107 Å²	107	77.6 Å²	77.6	56%	0.56	36%	0.364	S	S	*	.	H	α-helix	trans	-63.4	-21.7	170.2	-78.5	169.3	0	0	0	114.1	R845 I847	R845-L849 WeakPolarHBondContact O-CB 3.3Å; R845-L849 VanDerWaalsContact O-CG 3.29Å; R845-L849 WeakPolarHBondContact O-CG 3.41Å; R845-L849 PolarHBondContact O-N 3.43Å; R845-L849 VanDerWaalsContact O-N 3.07Å; I847-L849 VanDerWaalsContact C-N 3.3Å; I847-L849 PolarHBondContact O-N 3.15Å
850	K	95.4	Very high	90.2	Very high	72 Å²	72	75 Å²	75	31%	0.313	36%	0.358	S	S	.	.	H	α-helix	trans	-86.8	-38	172	-66.1	161.3	-169.6	154	0	111.3	E846 I847 E848 K853 F854 Y878 L882	E846-K850 VanDerWaalsContact O-CD 3.3Å; E846-K850 WeakPolarHBondContact O-CD 3.44Å; E846-K850 WeakPolarHBondContact O-CE 3.43Å; E846-K850 WeakPolarHBondContact O-CG 3.45Å; E846-K850 WeakPolarHBondContact OE1-CE 3.47Å; E846-K850 IonicContact OE1-NZ 2.78Å; E846-K850 PolarHBondContact OE1-NZ 2.83Å; I847-K850 WeakPolarHBondContact O-CA 3.45Å; I847-K850 WeakPolarHBondContact O-CB 3.45Å; I847-K850 PolarHBondContact O-N 3.11Å; E848-K850 PolarHBondContact O-N 3.43Å; K850-K853 PolarHBondContact O-N 3.48Å; K850-F854 WeakPolarHBondContact O-CB 3.27Å; K850-F854 PolarHBondContact O-N 2.81Å; K850-Y878 HydrophobicContact CB-CE1 4.17Å; K850-L882 HydrophobicContact CB-CD1 3.7Å; K850-L882 HydrophobicContact CD-CD1 4.14Å; K850-L882 HydrophobicContact CD-CD2 4.23Å
851	V	96	Very high	90.4	Very high	9 Å²	9	74.3 Å²	74.3	6%	0.055	37%	0.373	C	S	.	.	H	α-helix	trans	-59.8	-49.9	174.6	178.5	0	0	0	0	110	I847 E848 K853 F854 Q855 V875 Y878 R879 L882	I847-V851 HydrophobicContact CG2-CG2 4.29Å; I847-V851 WeakPolarHBondContact O-CG2 3.44Å; I847-V851 PolarHBondContact O-N 3.24Å; E848-V851 PolarHBondContact O-N 3.33Å; V851-K853 VanDerWaalsContact C-N 3.34Å; V851-K853 PolarHBondContact O-N 3.4Å; V851-F854 WeakPolarHBondContact O-CB 3.44Å; V851-F854 PolarHBondContact O-N 3.34Å; V851-Q855 PolarHBondContact O-N 3.05Å; V851-V875 HydrophobicContact CG1-CG1 3.53Å; V851-Y878 HydrophobicContact CG2-CD1 4.38Å; V851-R879 HydrophobicContact CG1-CB 4.33Å; V851-R879 HydrophobicContact CG2-CB 3.76Å; V851-R879 HydrophobicContact CG2-CG 3.84Å; V851-L882 HydrophobicContact CG2-CD1 4.14Å
852	M	91.1	Very high	90.5	Very high	105 Å²	105	75.5 Å²	75.5	52%	0.517	38%	0.382	S	S	.	.	H	α-helix	trans	-58.9	-42.2	176.7	-163	-178	86.8	0	0	112	E848 F854 Q855 D856	E848-M852 WeakPolarHBondContact O-CB 3.48Å; E848-M852 PolarHBondContact O-N 3.38Å; M852-F854 PolarHBondContact O-N 2.9Å; M852-Q855 WeakPolarHBondContact O-CB 3.46Å; M852-Q855 PolarHBondContact O-N 2.85Å; M852-D856 VanDerWaalsContact O-CG 3.3Å; M852-D856 PolarHBondContact O-N 2.98Å
853	K	92	Very high	90.4	Very high	129 Å²	129	77.5 Å²	77.5	56%	0.561	38%	0.379	S	S	*	.	H	α-helix	trans	-65.4	-34.6	173.3	-87.4	-168.5	170.4	-167.2	0	114.2	K850 V851 E857	K850-K853 PolarHBondContact O-N 3.48Å; V851-K853 VanDerWaalsContact C-N 3.34Å; V851-K853 PolarHBondContact O-N 3.4Å; K853-E857 VanDerWaalsContact O-CB 3.31Å; K853-E857 WeakPolarHBondContact O-CB 3.43Å; K853-E857 VanDerWaalsContact O-CG 3.26Å; K853-E857 WeakPolarHBondContact O-CG 3.48Å; K853-E857 PolarHBondContact O-N 3.49Å
854	F	94	Very high	90.2	Very high	22 Å²	22	81.4 Å²	81.4	10%	0.096	41%	0.407	C	S	.	.	H	α-helix	trans	-71.1	-36.7	177.7	178.7	-88.5	0	0	0	110.8	K850 V851 M852 E857 L858 Q874 V875 Y878	K850-F854 WeakPolarHBondContact O-CB 3.27Å; K850-F854 PolarHBondContact O-N 2.81Å; V851-F854 WeakPolarHBondContact O-CB 3.44Å; V851-F854 PolarHBondContact O-N 3.34Å; M852-F854 PolarHBondContact O-N 2.9Å; F854-E857 PolarHBondContact O-N 3.31Å; F854-L858 HydrophobicContact CD1-CD1 3.88Å; F854-L858 HydrophobicContact CE1-CD1 3.38Å; F854-L858 HydrophobicContact CE1-CG 4.31Å; F854-L858 HydrophobicContact CZ-CD1 4Å; F854-L858 PolarHBondContact O-N 3.09Å; F854-Q874 HydrophobicContact CE1-CB 4.21Å; F854-Q874 VanDerWaalsContact CE1-O 3.24Å; F854-Q874 WeakPolarHBondContact CE1-O 3.49Å; F854-V875 HydrophobicContact CD1-CG2 4.18Å; F854-V875 HydrophobicContact CE1-CG2 4.42Å; F854-Y878 HydrophobicContact CB-CD1 3.56Å; F854-Y878 HydrophobicContact CB-CE1 3.55Å; F854-Y878 HydrophobicContact CB-CG 4.15Å; F854-Y878 AromaticContact CD1-CD1 3.94Å; F854-Y878 HydrophobicContact CD1-CD1 3.94Å; F854-Y878 AromaticContact CD1-CG 3.83Å; F854-Y878 HydrophobicContact CD1-CG 3.83Å; F854-Y878 AromaticContact CD2-CD1 3.96Å; F854-Y878 HydrophobicContact CD2-CD1 3.96Å; F854-Y878 AromaticContact CD2-CD2 3.54Å; F854-Y878 HydrophobicContact CD2-CD2 3.54Å; F854-Y878 HydrophobicContact CD2-CE1 4.14Å; F854-Y878 AromaticContact CD2-CE2 3.75Å; F854-Y878 HydrophobicContact CD2-CE2 3.75Å; F854-Y878 AromaticContact CD2-CG 3.65Å; F854-Y878 HydrophobicContact CD2-CG 3.65Å; F854-Y878 HydrophobicContact CE1-CG 4.09Å; F854-Y878 AromaticContact CE2-CD2 3.65Å; F854-Y878 HydrophobicContact CE2-CD2 3.65Å; F854-Y878 HydrophobicContact CE2-CE2 4.18Å; F854-Y878 AromaticContact CE2-CG 3.92Å; F854-Y878 HydrophobicContact CE2-CG 3.92Å; F854-Y878 AromaticContact CG-CD1 3.55Å; F854-Y878 HydrophobicContact CG-CD1 3.55Å; F854-Y878 HydrophobicContact CG-CD2 4Å; F854-Y878 AromaticContact CG-CE1 3.92Å; F854-Y878 HydrophobicContact CG-CE1 3.92Å; F854-Y878 HydrophobicContact CG-CE2 4.33Å; F854-Y878 AromaticContact CG-CG 3.6Å; F854-Y878 HydrophobicContact CG-CG 3.6Å; F854-Y878 HydrophobicContact CZ-CD2 4.21Å; F854-Y878 HydrophobicContact CZ-CG 4.14Å
855	Q	91.8	Very high	89.7	Confident	65 Å²	65	83.3 Å²	83.3	30%	0.304	41%	0.413	S	S	.	.	H	α-helix	trans	-62.1	-54	168.3	-177.8	174.4	-4.6	0	0	111.2	V851 M852 E857 L858 E859 V875	V851-Q855 PolarHBondContact O-N 3.05Å; M852-Q855 WeakPolarHBondContact O-CB 3.46Å; M852-Q855 PolarHBondContact O-N 2.85Å; Q855-E857 PolarHBondContact O-N 3.41Å; Q855-L858 PolarHBondContact O-N 3.27Å; Q855-E859 HydrophobicContact CG-CG 4.22Å; Q855-E859 WeakPolarHBondContact CG-OE1 3.43Å; Q855-E859 PolarHBondContact NE2-OE1 3.04Å; Q855-E859 WeakPolarHBondContact O-CG 3.48Å; Q855-E859 PolarHBondContact O-N 2.89Å; Q855-V875 HydrophobicContact CB-CG2 3.99Å; Q855-V875 HydrophobicContact CG-CG2 4.32Å
856	D	90.2	Very high	89.4	Confident	79 Å²	79	81 Å²	81	42%	0.422	41%	0.406	S	S	.	.	H	α-helix	trans	-50.9	-42.4	174.4	-71.5	-25.4	0	0	0	112.2	M852 S860	M852-D856 VanDerWaalsContact O-CG 3.3Å; M852-D856 PolarHBondContact O-N 2.98Å; D856-S860 VanDerWaalsContact O-CB 3.29Å; D856-S860 WeakPolarHBondContact O-CB 3.26Å; D856-S860 PolarHBondContact O-N 3.22Å; D856-S860 PolarHBondContact O-OG 2.76Å
857	E	91.3	Very high	88.7	Confident	67 Å²	67	81.9 Å²	81.9	31%	0.313	42%	0.422	S	S	.	.	H	α-helix	trans	-72.8	-28.8	-179.1	-77.5	175.1	-174.5	0	0	113.2	K853 F854 Q855 K862 R863	K853-E857 VanDerWaalsContact O-CB 3.31Å; K853-E857 WeakPolarHBondContact O-CB 3.43Å; K853-E857 VanDerWaalsContact O-CG 3.26Å; K853-E857 WeakPolarHBondContact O-CG 3.48Å; K853-E857 PolarHBondContact O-N 3.49Å; F854-E857 PolarHBondContact O-N 3.31Å; Q855-E857 PolarHBondContact O-N 3.41Å; E857-K862 HydrophobicContact CB-CB 4.49Å; E857-K862 CarbonylContact O-C 3.47Å; E857-K862 WeakPolarHBondContact O-CA 3.45Å; E857-K862 WeakPolarHBondContact O-CB 3.49Å; E857-K862 PolarHBondContact O-N 3Å; E857-R863 HydrophobicContact CB-CG 4.02Å; E857-R863 PolarHBondContact O-N 3.3Å; E857-R863 IonicContact OE2-CZ 3.13Å; E857-R863 IonicContact OE2-NE 3.1Å; E857-R863 PolarHBondContact OE2-NE 3.16Å; E857-R863 IonicContact OE2-NH2 2.7Å; E857-R863 PolarHBondContact OE2-NH2 2.89Å
858	L	90.4	Very high	88.1	Confident	7 Å²	7	85.4 Å²	85.4	4%	0.037	46%	0.461	C	S	.	.	H	α-helix	trans	-75.2	-49.4	168.7	-76.4	167.8	0	0	0	111.2	F854 Q855 S860 G861 R863 F871 Q874 V875	F854-L858 HydrophobicContact CD1-CD1 3.88Å; F854-L858 HydrophobicContact CE1-CD1 3.38Å; F854-L858 HydrophobicContact CE1-CG 4.31Å; F854-L858 HydrophobicContact CZ-CD1 4Å; F854-L858 PolarHBondContact O-N 3.09Å; Q855-L858 PolarHBondContact O-N 3.27Å; L858-S860 VanDerWaalsContact C-N 3.34Å; L858-S860 PolarHBondContact O-N 3.01Å; L858-G861 PolarHBondContact O-N 3Å; L858-R863 HydrophobicContact CD2-CB 3.62Å; L858-R863 HydrophobicContact CG-CB 4.09Å; L858-F871 HydrophobicContact CB-CD1 4.1Å; L858-F871 HydrophobicContact CB-CE1 3.44Å; L858-F871 VanDerWaalsContact CB-CE1 3.44Å; L858-F871 HydrophobicContact CB-CZ 3.96Å; L858-F871 WeakPolarHBondContact O-CZ 3.06Å; L858-Q874 HydrophobicContact CD1-CB 3.94Å; L858-V875 HydrophobicContact CD1-CG2 4.21Å
859	E	87.4	Confident	87.4	Confident	118 Å²	118	83.8 Å²	83.8	55%	0.551	45%	0.453	S	S	*	.	H	α-helix	trans	-65	-37.8	-174.6	-71.5	-176.9	-168.4	0	0	111.8	Q855 G861 F871	Q855-E859 HydrophobicContact CG-CG 4.22Å; Q855-E859 WeakPolarHBondContact CG-OE1 3.43Å; Q855-E859 PolarHBondContact NE2-OE1 3.04Å; Q855-E859 WeakPolarHBondContact O-CG 3.48Å; Q855-E859 PolarHBondContact O-N 2.89Å; E859-G861 PolarHBondContact O-N 2.71Å; E859-F871 HydrophobicContact CB-CE1 4.23Å; E859-F871 HydrophobicContact CG-CD1 4.12Å; E859-F871 HydrophobicContact CG-CE1 3.55Å; E859-F871 HydrophobicContact CG-CZ 4.49Å
860	S	86	Confident	87.1	Confident	60 Å²	60	81 Å²	81	42%	0.42	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	12.9	173.2	65.2	0	0	0	0	114.7	D856 L858 K862	D856-S860 VanDerWaalsContact O-CB 3.29Å; D856-S860 WeakPolarHBondContact O-CB 3.26Å; D856-S860 PolarHBondContact O-N 3.22Å; D856-S860 PolarHBondContact O-OG 2.76Å; L858-S860 VanDerWaalsContact C-N 3.34Å; L858-S860 PolarHBondContact O-N 3.01Å; S860-K862 PolarHBondContact O-N 2.87Å; S860-K862 VanDerWaalsContact O-N 3.15Å; S860-K862 PolarHBondContact OG-NZ 3.4Å
861	G	83.2	Confident	86.4	Confident	63 Å²	63	81.2 Å²	81.2	65%	0.649	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	11	174.9	0	0	0	0	0	115.5	L858 E859 R863	L858-G861 PolarHBondContact O-N 3Å; E859-G861 PolarHBondContact O-N 2.71Å; G861-R863 VanDerWaalsContact C-N 3.31Å
862	K	83.8	Confident	85.9	Confident	158 Å²	158	85.8 Å²	85.8	69%	0.687	47%	0.465	S	S	*	.	S	Bend	trans	-76.9	-18.8	179.6	-61.9	178.3	-171.9	113.3	0	112.7	E857 S860	E857-K862 HydrophobicContact CB-CB 4.49Å; E857-K862 CarbonylContact O-C 3.47Å; E857-K862 WeakPolarHBondContact O-CA 3.45Å; E857-K862 WeakPolarHBondContact O-CB 3.49Å; E857-K862 PolarHBondContact O-N 3Å; S860-K862 PolarHBondContact O-N 2.87Å; S860-K862 VanDerWaalsContact O-N 3.15Å; S860-K862 PolarHBondContact OG-NZ 3.4Å
863	R	84.6	Confident	85.8	Confident	94 Å²	94	85.1 Å²	85.1	36%	0.355	46%	0.46	S	S	.	.	S	Bend	trans	-115.9	136.4	170.5	-74.5	174.3	-176	-92.2	-6.9	109.9	E857 L858 G861	E857-R863 HydrophobicContact CB-CG 4.02Å; E857-R863 PolarHBondContact O-N 3.3Å; E857-R863 IonicContact OE2-CZ 3.13Å; E857-R863 IonicContact OE2-NE 3.1Å; E857-R863 PolarHBondContact OE2-NE 3.16Å; E857-R863 IonicContact OE2-NH2 2.7Å; E857-R863 PolarHBondContact OE2-NH2 2.89Å; L858-R863 HydrophobicContact CD2-CB 3.62Å; L858-R863 HydrophobicContact CG-CB 4.09Å; G861-R863 VanDerWaalsContact C-N 3.31Å
864	P	83.4	Confident	85.7	Confident	118 Å²	118	79.8 Å²	79.8	77%	0.766	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-72.1	132.4	171.8	29.8	-33.3	0	0	0	110.8
865	K	80.3	Confident	85.7	Confident	121 Å²	121	79.1 Å²	79.1	53%	0.526	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-60.7	137.3	166	-175.3	-178.9	176.4	-176.5	0	109.3	Q869 F871	K865-Q869 WeakPolarHBondContact CE-O 3.27Å; K865-F871 HydrophobicContact CD-CD2 4.36Å; K865-F871 HydrophobicContact CD-CE2 4.46Å
866	K	83.7	Confident	85.7	Confident	104 Å²	104	80.3 Å²	80.3	45%	0.452	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-73	143.2	171.1	-83.2	173.4	174.9	-177.2	0	110.2	Q869	K866-Q869 HydrophobicContact CB-CB 4.49Å; K866-Q869 VanDerWaalsContact NZ-OE1 3.13Å
867	P	77.2	Confident	85.8	Confident	130 Å²	130	81.2 Å²	81.2	84%	0.844	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	139.1	165	28.5	-34	0	0	0	109.6	Q869	P867-Q869 PolarHBondContact O-N 3.16Å
868	G	82.5	Confident	85.9	Confident	85 Å²	85	81.1 Å²	81.1	88%	0.876	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	9	177.1	0	0	0	0	0	116.8
869	Q	77.4	Confident	86.2	Confident	46 Å²	46	84.8 Å²	84.8	22%	0.215	45%	0.453	C	S	.	.			trans	-125.5	144.5	169.6	-61	-160.4	-81.7	0	0	111.9	K865 K866 P867 E873 Q874	K865-Q869 WeakPolarHBondContact CE-O 3.27Å; K866-Q869 HydrophobicContact CB-CB 4.49Å; K866-Q869 VanDerWaalsContact NZ-OE1 3.13Å; P867-Q869 PolarHBondContact O-N 3.16Å; Q869-E873 VanDerWaalsContact CA-OE2 3.27Å; Q869-E873 WeakPolarHBondContact CA-OE2 3.42Å; Q869-E873 HydrophobicContact CB-CB 4.46Å; Q869-Q874 HydrophobicContact CB-CG 4.04Å
870	S	86.6	Confident	86.5	Confident	48 Å²	48	83.8 Å²	83.8	34%	0.336	45%	0.451	S	S	.	.			trans	-71.3	166.3	170.4	93.7	0	0	0	0	111.3	Q872 E873 Q874	S870-Q872 VanDerWaalsContact C-N 3.3Å; S870-Q872 PolarHBondContact OG-N 3.44Å; S870-E873 PolarHBondContact N-OE2 2.84Å; S870-E873 WeakPolarHBondContact OG-CG 3.48Å; S870-E873 PolarHBondContact OG-N 2.98Å; S870-Q874 WeakPolarHBondContact O-CG 3.15Å; S870-Q874 PolarHBondContact O-N 3.24Å
871	F	81.9	Confident	86.9	Confident	78 Å²	78	87.9 Å²	87.9	34%	0.342	46%	0.462	S	S	.	.	H	α-helix	trans	-60	-44.9	172.7	-113.3	-101.4	0	0	0	111.2	L858 E859 K865 Q874 V875	L858-F871 HydrophobicContact CB-CD1 4.1Å; L858-F871 HydrophobicContact CB-CE1 3.44Å; L858-F871 VanDerWaalsContact CB-CE1 3.44Å; L858-F871 HydrophobicContact CB-CZ 3.96Å; L858-F871 WeakPolarHBondContact O-CZ 3.06Å; E859-F871 HydrophobicContact CB-CE1 4.23Å; E859-F871 HydrophobicContact CG-CD1 4.12Å; E859-F871 HydrophobicContact CG-CE1 3.55Å; E859-F871 HydrophobicContact CG-CZ 4.49Å; K865-F871 HydrophobicContact CD-CD2 4.36Å; K865-F871 HydrophobicContact CD-CE2 4.46Å; F871-Q874 PolarHBondContact O-N 3.39Å; F871-V875 WeakPolarHBondContact O-CG2 3.29Å; F871-V875 PolarHBondContact O-N 2.69Å
872	Q	85.8	Confident	87.5	Confident	104 Å²	104	86.3 Å²	86.3	49%	0.486	44%	0.438	S	S	.	.	H	α-helix	trans	-65.5	-45.7	-176.8	-161.3	67.7	9.3	0	0	111.6	S870 Q874 V875 E876	S870-Q872 VanDerWaalsContact C-N 3.3Å; S870-Q872 PolarHBondContact OG-N 3.44Å; Q872-Q874 VanDerWaalsContact C-N 3.27Å; Q872-Q874 PolarHBondContact O-N 2.77Å; Q872-V875 WeakPolarHBondContact O-CB 3.31Å; Q872-V875 PolarHBondContact O-N 2.65Å; Q872-E876 PolarHBondContact NE2-OE1 2.95Å; Q872-E876 PolarHBondContact O-N 3.37Å
873	E	88.9	Confident	87.8	Confident	91 Å²	91	81.8 Å²	81.8	43%	0.425	42%	0.421	S	S	.	.	H	α-helix	trans	-60.1	-35.7	177.6	-71.1	176.5	129.3	0	0	112.4	Q869 S870 H877	Q869-E873 VanDerWaalsContact CA-OE2 3.27Å; Q869-E873 WeakPolarHBondContact CA-OE2 3.42Å; Q869-E873 HydrophobicContact CB-CB 4.46Å; S870-E873 PolarHBondContact N-OE2 2.84Å; S870-E873 WeakPolarHBondContact OG-CG 3.48Å; S870-E873 PolarHBondContact OG-N 2.98Å; E873-H877 WeakPolarHBondContact O-CB 3.41Å; E873-H877 PolarHBondContact O-N 2.86Å
874	Q	90	Very high	88.1	Confident	17 Å²	17	83.6 Å²	83.6	8%	0.079	43%	0.434	C	S	.	.	H	α-helix	trans	-68.2	-39.7	174.9	-68.4	-158.7	-64.8	0	0	111.9	F854 L858 Q869 S870 F871 Q872 Y878	F854-Q874 HydrophobicContact CE1-CB 4.21Å; F854-Q874 VanDerWaalsContact CE1-O 3.24Å; F854-Q874 WeakPolarHBondContact CE1-O 3.49Å; L858-Q874 HydrophobicContact CD1-CB 3.94Å; Q869-Q874 HydrophobicContact CB-CG 4.04Å; S870-Q874 WeakPolarHBondContact O-CG 3.15Å; S870-Q874 PolarHBondContact O-N 3.24Å; F871-Q874 PolarHBondContact O-N 3.39Å; Q872-Q874 VanDerWaalsContact C-N 3.27Å; Q872-Q874 PolarHBondContact O-N 2.77Å; Q874-Y878 VanDerWaalsContact O-CB 3.32Å; Q874-Y878 WeakPolarHBondContact O-CB 3.15Å; Q874-Y878 PolarHBondContact O-N 2.85Å; Q874-Y878 VanDerWaalsContact O-N 3.09Å
875	V	93.7	Very high	88.5	Confident	8 Å²	8	85.8 Å²	85.8	5%	0.048	43%	0.426	C	S	.	.	H	α-helix	trans	-68.3	-41.8	178.3	174.2	0	0	0	0	110.8	V851 F854 Q855 L858 F871 Q872 Y878 R879	V851-V875 HydrophobicContact CG1-CG1 3.53Å; F854-V875 HydrophobicContact CD1-CG2 4.18Å; F854-V875 HydrophobicContact CE1-CG2 4.42Å; Q855-V875 HydrophobicContact CB-CG2 3.99Å; Q855-V875 HydrophobicContact CG-CG2 4.32Å; L858-V875 HydrophobicContact CD1-CG2 4.21Å; F871-V875 WeakPolarHBondContact O-CG2 3.29Å; F871-V875 PolarHBondContact O-N 2.69Å; Q872-V875 WeakPolarHBondContact O-CB 3.31Å; Q872-V875 PolarHBondContact O-N 2.65Å; V875-Y878 WeakPolarHBondContact O-CB 3.41Å; V875-Y878 PolarHBondContact O-N 3.49Å; V875-R879 WeakPolarHBondContact O-CB 3.3Å; V875-R879 PolarHBondContact O-N 3.2Å
876	E	90.9	Very high	89.1	Confident	90 Å²	90	81.5 Å²	81.5	42%	0.421	41%	0.408	S	S	.	.	H	α-helix	trans	-69.6	-48	178	-73.2	170.7	176.3	0	0	111.9	Q872 Y878 R879 D880	Q872-E876 PolarHBondContact NE2-OE1 2.95Å; Q872-E876 PolarHBondContact O-N 3.37Å; E876-Y878 PolarHBondContact O-N 2.74Å; E876-Y878 VanDerWaalsContact O-N 3.14Å; E876-R879 WeakPolarHBondContact O-CA 3.32Å; E876-R879 WeakPolarHBondContact O-CB 3.49Å; E876-R879 PolarHBondContact O-N 3.45Å; E876-D880 PolarHBondContact O-N 2.99Å
877	H	92	Very high	89.2	Confident	99 Å²	99	83 Å²	83	46%	0.458	42%	0.415	S	S	.	.	H	α-helix	trans	-58.6	-30.5	173	-173.7	-15.4	0	0	0	111.8	E873 K881	E873-H877 WeakPolarHBondContact O-CB 3.41Å; E873-H877 PolarHBondContact O-N 2.86Å; H877-K881 VanDerWaalsContact O-CB 3.27Å; H877-K881 WeakPolarHBondContact O-CB 3.37Å; H877-K881 PolarHBondContact O-N 2.9Å
878	Y	95.3	Very high	89.8	Confident	64 Å²	64	83.3 Å²	83.3	25%	0.251	41%	0.405	S	S	.	.	H	α-helix	trans	-73.3	-41.1	172.4	-176.7	-100.8	0	0	0	112.8	K850 V851 F854 Q874 V875 E876 K881 L882	K850-Y878 HydrophobicContact CB-CE1 4.17Å; V851-Y878 HydrophobicContact CG2-CD1 4.38Å; F854-Y878 HydrophobicContact CB-CD1 3.56Å; F854-Y878 HydrophobicContact CB-CE1 3.55Å; F854-Y878 HydrophobicContact CB-CG 4.15Å; F854-Y878 AromaticContact CD1-CD1 3.94Å; F854-Y878 HydrophobicContact CD1-CD1 3.94Å; F854-Y878 AromaticContact CD1-CG 3.83Å; F854-Y878 HydrophobicContact CD1-CG 3.83Å; F854-Y878 AromaticContact CD2-CD1 3.96Å; F854-Y878 HydrophobicContact CD2-CD1 3.96Å; F854-Y878 AromaticContact CD2-CD2 3.54Å; F854-Y878 HydrophobicContact CD2-CD2 3.54Å; F854-Y878 HydrophobicContact CD2-CE1 4.14Å; F854-Y878 AromaticContact CD2-CE2 3.75Å; F854-Y878 HydrophobicContact CD2-CE2 3.75Å; F854-Y878 AromaticContact CD2-CG 3.65Å; F854-Y878 HydrophobicContact CD2-CG 3.65Å; F854-Y878 HydrophobicContact CE1-CG 4.09Å; F854-Y878 AromaticContact CE2-CD2 3.65Å; F854-Y878 HydrophobicContact CE2-CD2 3.65Å; F854-Y878 HydrophobicContact CE2-CE2 4.18Å; F854-Y878 AromaticContact CE2-CG 3.92Å; F854-Y878 HydrophobicContact CE2-CG 3.92Å; F854-Y878 AromaticContact CG-CD1 3.55Å; F854-Y878 HydrophobicContact CG-CD1 3.55Å; F854-Y878 HydrophobicContact CG-CD2 4Å; F854-Y878 AromaticContact CG-CE1 3.92Å; F854-Y878 HydrophobicContact CG-CE1 3.92Å; F854-Y878 HydrophobicContact CG-CE2 4.33Å; F854-Y878 AromaticContact CG-CG 3.6Å; F854-Y878 HydrophobicContact CG-CG 3.6Å; F854-Y878 HydrophobicContact CZ-CD2 4.21Å; F854-Y878 HydrophobicContact CZ-CG 4.14Å; Q874-Y878 VanDerWaalsContact O-CB 3.32Å; Q874-Y878 WeakPolarHBondContact O-CB 3.15Å; Q874-Y878 PolarHBondContact O-N 2.85Å; Q874-Y878 VanDerWaalsContact O-N 3.09Å; V875-Y878 WeakPolarHBondContact O-CB 3.41Å; V875-Y878 PolarHBondContact O-N 3.49Å; E876-Y878 PolarHBondContact O-N 2.74Å; E876-Y878 VanDerWaalsContact O-N 3.14Å; Y878-K881 PolarHBondContact O-N 3.14Å; Y878-L882 HydrophobicContact CD1-CD1 4.06Å; Y878-L882 HydrophobicContact CE1-CD1 3.51Å; Y878-L882 HydrophobicContact CE1-CG 4.26Å; Y878-L882 PolarHBondContact O-N 3.39Å
879	R	95.4	Very high	90.1	Very high	84 Å²	84	83.3 Å²	83.3	32%	0.317	38%	0.381	S	S	.	.	H	α-helix	trans	-61.2	-48.8	176	-173.9	169.3	-170.3	-124	8.9	111.9	E848 V851 V875 E876 K881 L882 L883	E848-R879 IonicContact OE1-CZ 3.03Å; E848-R879 IonicContact OE1-NE 2.71Å; E848-R879 PolarHBondContact OE1-NE 3.29Å; E848-R879 IonicContact OE1-NH2 2.64Å; E848-R879 PolarHBondContact OE1-NH2 3Å; E848-R879 IonicContact OE2-CZ 2.99Å; E848-R879 IonicContact OE2-NE 3.19Å; E848-R879 PolarHBondContact OE2-NE 3.22Å; E848-R879 IonicContact OE2-NH2 4Å; V851-R879 HydrophobicContact CG1-CB 4.33Å; V851-R879 HydrophobicContact CG2-CB 3.76Å; V851-R879 HydrophobicContact CG2-CG 3.84Å; V875-R879 WeakPolarHBondContact O-CB 3.3Å; V875-R879 PolarHBondContact O-N 3.2Å; E876-R879 WeakPolarHBondContact O-CA 3.32Å; E876-R879 WeakPolarHBondContact O-CB 3.49Å; E876-R879 PolarHBondContact O-N 3.45Å; R879-K881 VanDerWaalsContact C-N 3.32Å; R879-K881 PolarHBondContact O-N 3.44Å; R879-L882 WeakPolarHBondContact O-CB 3.35Å; R879-L882 PolarHBondContact O-N 3.04Å; R879-L883 HydrophobicContact CG-CD1 4.28Å; R879-L883 WeakPolarHBondContact O-CG 3.44Å; R879-L883 PolarHBondContact O-N 3.45Å
880	D	93.2	Very high	90.5	Very high	97 Å²	97	84.2 Å²	84.2	52%	0.519	39%	0.385	S	S	.	.	H	α-helix	trans	-62.4	-40.6	177.1	-69.4	-19	0	0	0	111.9	E876 L882 L883 Q884	E876-D880 PolarHBondContact O-N 2.99Å; D880-L882 PolarHBondContact O-N 2.93Å; D880-L883 PolarHBondContact O-N 3.14Å; D880-L883 VanDerWaalsContact O-N 3.15Å; D880-Q884 WeakPolarHBondContact O-CB 3.42Å; D880-Q884 PolarHBondContact O-N 2.72Å
881	K	94.8	Very high	90.4	Very high	147 Å²	147	85.9 Å²	85.9	64%	0.639	39%	0.39	S	S	*	.	H	α-helix	trans	-63.8	-23.3	175.7	-169.9	168.5	-173	168.8	0	113.2	H877 Y878 R879 R885	H877-K881 VanDerWaalsContact O-CB 3.27Å; H877-K881 WeakPolarHBondContact O-CB 3.37Å; H877-K881 PolarHBondContact O-N 2.9Å; Y878-K881 PolarHBondContact O-N 3.14Å; R879-K881 VanDerWaalsContact C-N 3.32Å; R879-K881 PolarHBondContact O-N 3.44Å; K881-R885 WeakPolarHBondContact O-CB 3.34Å
882	L	95.4	Very high	90.6	Very high	29 Å²	29	88.1 Å²	88.1	15%	0.152	40%	0.401	C	S	.	.	H	α-helix	trans	-83	-42.3	170.5	-69.9	175.3	0	0	0	112.2	I847 K850 V851 Y878 R879 D880 R885 E886	I847-L882 HydrophobicContact CG1-CB 4.25Å; I847-L882 HydrophobicContact CG2-CB 3.83Å; I847-L882 HydrophobicContact CG2-CD1 4.1Å; K850-L882 HydrophobicContact CB-CD1 3.7Å; K850-L882 HydrophobicContact CD-CD1 4.14Å; K850-L882 HydrophobicContact CD-CD2 4.23Å; V851-L882 HydrophobicContact CG2-CD1 4.14Å; Y878-L882 HydrophobicContact CD1-CD1 4.06Å; Y878-L882 HydrophobicContact CE1-CD1 3.51Å; Y878-L882 HydrophobicContact CE1-CG 4.26Å; Y878-L882 PolarHBondContact O-N 3.39Å; R879-L882 WeakPolarHBondContact O-CB 3.35Å; R879-L882 PolarHBondContact O-N 3.04Å; D880-L882 PolarHBondContact O-N 2.93Å; L882-R885 PolarHBondContact O-N 3.1Å; L882-E886 PolarHBondContact O-N 3.23Å; L882-E886 VanDerWaalsContact O-N 3.16Å
883	L	91.9	Very high	90.6	Very high	63 Å²	63	87.2 Å²	87.2	33%	0.33	39%	0.393	S	S	.	.	H	α-helix	trans	-61.4	-49.3	177.5	-71.2	168.5	0	0	0	111.7	L844 I847 R879 D880 R885 E886 K887	L844-L883 HydrophobicContact CD2-CD2 4.05Å; I847-L883 HydrophobicContact CD1-CD2 4.05Å; R879-L883 HydrophobicContact CG-CD1 4.28Å; R879-L883 WeakPolarHBondContact O-CG 3.44Å; R879-L883 PolarHBondContact O-N 3.45Å; D880-L883 PolarHBondContact O-N 3.14Å; D880-L883 VanDerWaalsContact O-N 3.15Å; L883-R885 PolarHBondContact O-N 3.15Å; L883-E886 PolarHBondContact O-N 3.13Å; L883-E886 VanDerWaalsContact O-N 3.16Å; L883-K887 WeakPolarHBondContact O-CB 3.42Å; L883-K887 PolarHBondContact O-N 2.86Å
884	Q	90.2	Very high	90.2	Very high	133 Å²	133	87 Å²	87	62%	0.621	39%	0.392	S	S	*	.	H	α-helix	trans	-56	-40.1	178.1	-151.7	77.1	-36.3	0	0	111.5	D880 K887 E888	D880-Q884 WeakPolarHBondContact O-CB 3.42Å; D880-Q884 PolarHBondContact O-N 2.72Å; Q884-K887 PolarHBondContact O-N 3.21Å; Q884-E888 WeakPolarHBondContact O-CB 3.37Å; Q884-E888 PolarHBondContact O-N 3.03Å
885	R	91.5	Very high	90	Very high	163 Å²	163	94.6 Å²	94.6	62%	0.615	42%	0.42	S	S	*	.	H	α-helix	trans	-74.2	-27.5	-178.4	-165.5	176.2	-171.9	-172.8	3.5	113.9	K881 L882 L883 K889	K881-R885 WeakPolarHBondContact O-CB 3.34Å; L882-R885 PolarHBondContact O-N 3.1Å; L883-R885 PolarHBondContact O-N 3.15Å; R885-K889 WeakPolarHBondContact O-CD 3.33Å; R885-K889 WeakPolarHBondContact O-CG 3.42Å; R885-K889 PolarHBondContact O-N 2.89Å
886	E	92	Very high	89.6	Confident	31 Å²	31	100.9 Å²	100.9	15%	0.145	45%	0.449	C	S	.	.	H	α-helix	trans	-85.1	-28.9	172.4	-164.6	57.7	-144.3	0	0	112	K843 I847 L882 L883 K889 E890 R893	K843-E886 HydrophobicContact CB-CG 4.41Å; K843-E886 HydrophobicContact CD-CG 4.09Å; K843-E886 WeakPolarHBondContact CD-OE1 3.44Å; K843-E886 WeakPolarHBondContact CE-OE1 3.49Å; K843-E886 IonicContact NZ-OE1 3.38Å; I847-E886 HydrophobicContact CD1-CB 4.2Å; L882-E886 PolarHBondContact O-N 3.23Å; L882-E886 VanDerWaalsContact O-N 3.16Å; L883-E886 PolarHBondContact O-N 3.13Å; L883-E886 VanDerWaalsContact O-N 3.16Å; E886-K889 PolarHBondContact O-N 3.22Å; E886-K889 WeakPolarHBondContact OE2-CD 3.46Å; E886-K889 IonicContact OE2-NZ 2.69Å; E886-K889 PolarHBondContact OE2-NZ 2.71Å; E886-E890 PolarHBondContact O-N 3.22Å; E886-R893 IonicContact OE1-CZ 3.08Å; E886-R893 IonicContact OE1-NH1 3.95Å; E886-R893 PolarHBondContact OE1-NH1 2.95Å; E886-R893 IonicContact OE1-NH2 2.69Å; E886-R893 PolarHBondContact OE1-NH2 3.22Å; E886-R893 IonicContact OE2-NH2 3.67Å
887	K	87.7	Confident	89.1	Confident	136 Å²	136	102.9 Å²	102.9	59%	0.591	45%	0.453	S	S	*	.	H	α-helix	trans	-62	-43.5	169	-171.7	175.8	-178	177.9	0	111.8	L883 Q884 E890 L891	L883-K887 WeakPolarHBondContact O-CB 3.42Å; L883-K887 PolarHBondContact O-N 2.86Å; Q884-K887 PolarHBondContact O-N 3.21Å; K887-E890 PolarHBondContact O-N 3.26Å; K887-L891 PolarHBondContact O-N 3.07Å; K887-L891 VanDerWaalsContact O-N 3.14Å
888	E	88.5	Confident	88.7	Confident	137 Å²	137	103.3 Å²	103.3	64%	0.64	46%	0.459	S	S	*	.	H	α-helix	trans	-60.2	-47.2	173.7	-174.5	174.1	-132.4	0	0	112.1	Q884 E890 L891 E892	Q884-E888 WeakPolarHBondContact O-CB 3.37Å; Q884-E888 PolarHBondContact O-N 3.03Å; E888-E890 VanDerWaalsContact C-N 3.3Å; E888-E890 PolarHBondContact O-N 3.41Å; E888-L891 WeakPolarHBondContact O-CB 3.48Å; E888-L891 PolarHBondContact O-N 3.3Å; E888-E892 PolarHBondContact O-N 3.03Å
889	K	88.7	Confident	88.3	Confident	84 Å²	84	107.1 Å²	107.1	37%	0.365	48%	0.476	S	S	.	.	H	α-helix	trans	-67.4	-23.1	173.2	-71	165.6	169.8	178.4	0	114.2	R885 E886 R893	R885-K889 WeakPolarHBondContact O-CD 3.33Å; R885-K889 WeakPolarHBondContact O-CG 3.42Å; R885-K889 PolarHBondContact O-N 2.89Å; E886-K889 PolarHBondContact O-N 3.22Å; E886-K889 WeakPolarHBondContact OE2-CD 3.46Å; E886-K889 IonicContact OE2-NZ 2.69Å; E886-K889 PolarHBondContact OE2-NZ 2.71Å; K889-R893 VanDerWaalsContact C-NH1 3.34Å; K889-R893 VanDerWaalsContact O-CG 3.26Å; K889-R893 WeakPolarHBondContact O-CG 3.34Å; K889-R893 PolarHBondContact O-N 2.89Å; K889-R893 PolarHBondContact O-NH1 3.17Å
890	E	85.9	Confident	87.7	Confident	65 Å²	65	110.3 Å²	110.3	30%	0.304	49%	0.493	S	S	.	.	H	α-helix	trans	-72	-47.3	174.8	-172.3	169.5	177.3	0	0	110	K840 E886 K887 E888 E892 R893 E894	K840-E890 WeakPolarHBondContact CE-OE1 3.41Å; K840-E890 WeakPolarHBondContact CE-OE2 3.48Å; K840-E890 VanDerWaalsContact NZ-CD 3.25Å; K840-E890 IonicContact NZ-OE1 3.29Å; K840-E890 PolarHBondContact NZ-OE1 3.14Å; K840-E890 IonicContact NZ-OE2 3.43Å; K840-E890 PolarHBondContact NZ-OE2 3.18Å; E886-E890 PolarHBondContact O-N 3.22Å; K887-E890 PolarHBondContact O-N 3.26Å; E888-E890 VanDerWaalsContact C-N 3.3Å; E888-E890 PolarHBondContact O-N 3.41Å; E890-E892 VanDerWaalsContact C-N 3.28Å; E890-E892 PolarHBondContact O-N 3.03Å; E890-R893 PolarHBondContact O-N 2.64Å; E890-E894 WeakPolarHBondContact O-CB 3.42Å; E890-E894 PolarHBondContact O-N 3.04Å
891	L	84.3	Confident	87.1	Confident	83 Å²	83	109.7 Å²	109.7	44%	0.435	49%	0.49	S	S	.	.	H	α-helix	trans	-55.6	-40.1	171.2	-85	161.4	0	0	0	112.6	K887 E888 E894 R895	K887-L891 PolarHBondContact O-N 3.07Å; K887-L891 VanDerWaalsContact O-N 3.14Å; E888-L891 WeakPolarHBondContact O-CB 3.48Å; E888-L891 PolarHBondContact O-N 3.3Å; L891-E894 PolarHBondContact O-N 3.4Å; L891-R895 VanDerWaalsContact O-CG 3.27Å; L891-R895 WeakPolarHBondContact O-CG 3.4Å; L891-R895 PolarHBondContact O-N 2.87Å
892	E	86.7	Confident	86.5	Confident	126 Å²	126	108.9 Å²	108.9	59%	0.589	49%	0.486	S	S	*	.	H	α-helix	trans	-65.4	-46.7	177	-168.4	168.6	-129.9	0	0	112.2	E888 E890 E894 R895 E896	E888-E892 PolarHBondContact O-N 3.03Å; E890-E892 VanDerWaalsContact C-N 3.28Å; E890-E892 PolarHBondContact O-N 3.03Å; E892-E894 VanDerWaalsContact C-N 3.26Å; E892-E894 PolarHBondContact O-N 3.4Å; E892-R895 PolarHBondContact O-N 2.97Å; E892-E896 PolarHBondContact O-N 3.14Å
893	R	85	Confident	85.8	Confident	84 Å²	84	113 Å²	113	32%	0.317	50%	0.504	S	S	.	.	H	α-helix	trans	-66.5	-24.8	174.7	-67.8	178.4	-157.7	108	-15.5	113.4	E886 K889 E890 R897	E886-R893 IonicContact OE1-CZ 3.08Å; E886-R893 IonicContact OE1-NH1 3.95Å; E886-R893 PolarHBondContact OE1-NH1 2.95Å; E886-R893 IonicContact OE1-NH2 2.69Å; E886-R893 PolarHBondContact OE1-NH2 3.22Å; E886-R893 IonicContact OE2-NH2 3.67Å; K889-R893 VanDerWaalsContact C-NH1 3.34Å; K889-R893 VanDerWaalsContact O-CG 3.26Å; K889-R893 WeakPolarHBondContact O-CG 3.34Å; K889-R893 PolarHBondContact O-N 2.89Å; K889-R893 PolarHBondContact O-NH1 3.17Å; E890-R893 PolarHBondContact O-N 2.64Å; R893-R897 WeakPolarHBondContact O-CG 3.37Å; R893-R897 PolarHBondContact O-N 3.15Å; R893-R897 PolarHBondContact O-NE 3.19Å
894	E	81.5	Confident	85.2	Confident	86 Å²	86	115.9 Å²	115.9	40%	0.402	51%	0.514	S	S	.	.	H	α-helix	trans	-73	-49.1	173.1	-164.3	149.3	-109.5	0	0	111.1	E890 L891 E892 E896 R897 D898	E890-E894 WeakPolarHBondContact O-CB 3.42Å; E890-E894 PolarHBondContact O-N 3.04Å; L891-E894 PolarHBondContact O-N 3.4Å; E892-E894 VanDerWaalsContact C-N 3.26Å; E892-E894 PolarHBondContact O-N 3.4Å; E894-E896 VanDerWaalsContact C-N 3.28Å; E894-E896 PolarHBondContact O-N 3.29Å; E894-R897 WeakPolarHBondContact O-CA 3.47Å; E894-R897 WeakPolarHBondContact O-CB 3.46Å; E894-R897 PolarHBondContact O-N 3.4Å; E894-R897 IonicContact OE1-NH2 2.73Å; E894-D898 PolarHBondContact O-N 2.78Å
895	R	86.3	Confident	84.5	Confident	177 Å²	177	115 Å²	115	67%	0.668	51%	0.513	S	S	*	.	H	α-helix	trans	-56.7	-37.8	173.7	-70.8	166.8	177.5	177.9	-0.4	113.1	L891 E892 K899	L891-R895 VanDerWaalsContact O-CG 3.27Å; L891-R895 WeakPolarHBondContact O-CG 3.4Å; L891-R895 PolarHBondContact O-N 2.87Å; E892-R895 PolarHBondContact O-N 2.97Å; R895-K899 VanDerWaalsContact O-CB 3.31Å; R895-K899 WeakPolarHBondContact O-CB 3.36Å; R895-K899 PolarHBondContact O-N 3.27Å; R895-K899 VanDerWaalsContact O-N 3.11Å
896	E	84	Confident	83.6	Confident	140 Å²	140	112.5 Å²	112.5	65%	0.654	51%	0.508	S	S	*	.	H	α-helix	trans	-65.3	-38.7	172.7	-77	-154.7	131	0	0	113.1	E892 E894 K900	E892-E896 PolarHBondContact O-N 3.14Å; E894-E896 VanDerWaalsContact C-N 3.28Å; E894-E896 PolarHBondContact O-N 3.29Å; E896-K900 VanDerWaalsContact O-CB 3.3Å; E896-K900 WeakPolarHBondContact O-CB 3.48Å; E896-K900 PolarHBondContact O-N 3.15Å
897	R	82.1	Confident	82.6	Confident	132 Å²	132	113.6 Å²	113.6	50%	0.498	52%	0.52	S	S	.	.	H	α-helix	trans	-66.8	-48.3	178.3	-77.4	174.4	-74.5	160.6	5.9	110.9	R893 E894 K899 K900 D901	R893-R897 WeakPolarHBondContact O-CG 3.37Å; R893-R897 PolarHBondContact O-N 3.15Å; R893-R897 PolarHBondContact O-NE 3.19Å; E894-R897 WeakPolarHBondContact O-CA 3.47Å; E894-R897 WeakPolarHBondContact O-CB 3.46Å; E894-R897 PolarHBondContact O-N 3.4Å; E894-R897 IonicContact OE1-NH2 2.73Å; R897-K899 VanDerWaalsContact C-N 3.33Å; R897-K899 PolarHBondContact O-N 3.35Å; R897-K900 PolarHBondContact O-N 2.77Å; R897-K900 VanDerWaalsContact O-N 3.17Å; R897-D901 PolarHBondContact O-N 3.22Å
898	D	82.8	Confident	81.4	Confident	109 Å²	109	115.7 Å²	115.7	58%	0.583	52%	0.524	S	S	*	.	H	α-helix	trans	-58.6	-44.4	177.4	-69.5	-22.5	0	0	0	112	E894 K900 D901 K902	E894-D898 PolarHBondContact O-N 2.78Å; D898-K900 VanDerWaalsContact C-N 3.34Å; D898-K900 PolarHBondContact O-N 3.37Å; D898-D901 PolarHBondContact O-N 3.05Å; D898-K902 WeakPolarHBondContact O-CB 3.4Å; D898-K902 PolarHBondContact O-N 3.13Å
899	K	87.1	Confident	80.1	Confident	143 Å²	143	112.9 Å²	112.9	62%	0.622	52%	0.519	S	S	*	.	H	α-helix	trans	-61.1	-43.2	177.2	-169.4	179.2	-179.2	-174	0	111.6	R895 R897 K902 E903	R895-K899 VanDerWaalsContact O-CB 3.31Å; R895-K899 WeakPolarHBondContact O-CB 3.36Å; R895-K899 PolarHBondContact O-N 3.27Å; R895-K899 VanDerWaalsContact O-N 3.11Å; R897-K899 VanDerWaalsContact C-N 3.33Å; R897-K899 PolarHBondContact O-N 3.35Å; K899-K902 PolarHBondContact O-N 2.9Å; K899-E903 WeakPolarHBondContact O-CG 3.5Å; K899-E903 PolarHBondContact O-N 3.32Å
900	K	83	Confident	78.8	Confident	152 Å²	152	116 Å²	116	66%	0.661	53%	0.533	S	S	*	.	H	α-helix	trans	-69	-39.5	-179.5	-167.8	170.8	-169	166.1	0	113	E896 R897 D898 K904	E896-K900 VanDerWaalsContact O-CB 3.3Å; E896-K900 WeakPolarHBondContact O-CB 3.48Å; E896-K900 PolarHBondContact O-N 3.15Å; R897-K900 PolarHBondContact O-N 2.77Å; R897-K900 VanDerWaalsContact O-N 3.17Å; D898-K900 VanDerWaalsContact C-N 3.34Å; D898-K900 PolarHBondContact O-N 3.37Å; K900-K904 WeakPolarHBondContact O-CB 3.24Å; K900-K904 PolarHBondContact O-N 3.36Å; K900-K904 VanDerWaalsContact O-N 3.14Å
901	D	80.2	Confident	77.4	Confident	84 Å²	84	118 Å²	118	45%	0.449	55%	0.546	S	S	.	.	H	α-helix	trans	-75.2	-26.5	175.2	-82.2	-33.3	0	0	0	112.3	R897 D898 K904 L905	R897-D901 PolarHBondContact O-N 3.22Å; D898-D901 PolarHBondContact O-N 3.05Å; D901-K904 WeakPolarHBondContact O-CB 3.32Å; D901-K904 PolarHBondContact O-N 3.09Å; D901-K904 WeakPolarHBondContact OD1-CD 3.27Å; D901-K904 IonicContact OD1-NZ 3.46Å; D901-K904 PolarHBondContact OD1-NZ 3.03Å; D901-L905 PolarHBondContact O-N 3.22Å
902	K	82.4	Confident	76	Confident	129 Å²	129	121.1 Å²	121.1	56%	0.561	56%	0.556	S	S	*	*	H	α-helix	trans	-64	-49	167.7	-175.4	173.8	175.4	177.3	0	112.2	D898 K899 K904 L905 E906	D898-K902 WeakPolarHBondContact O-CB 3.4Å; D898-K902 PolarHBondContact O-N 3.13Å; K899-K902 PolarHBondContact O-N 2.9Å; K902-K904 PolarHBondContact O-N 2.84Å; K902-L905 WeakPolarHBondContact O-CB 3.41Å; K902-L905 PolarHBondContact O-N 3.28Å; K902-E906 WeakPolarHBondContact CE-OE1 3.15Å; K902-E906 IonicContact NZ-OE1 3.65Å; K902-E906 PolarHBondContact O-N 3.04Å
903	E	81	Confident	74.4	Confident	115 Å²	115	123.2 Å²	123.2	54%	0.537	56%	0.563	S	S	.	*	H	α-helix	trans	-57.4	-35.1	174.4	-73	171.2	-172.7	0	0	112.1	K899 S907	K899-E903 WeakPolarHBondContact O-CG 3.5Å; K899-E903 PolarHBondContact O-N 3.32Å; E903-S907 WeakPolarHBondContact O-CB 3.14Å; E903-S907 PolarHBondContact O-N 2.9Å; E903-S907 PolarHBondContact O-OG 2.71Å
904	K	79.3	Confident	72.8	Confident	125 Å²	125	126.5 Å²	126.5	54%	0.543	58%	0.582	S	S	.	*	H	α-helix	trans	-74.9	-22	177.3	-161	179.5	-178.2	-175.4	0	114.1	K900 D901 K902 S907 R908	K900-K904 WeakPolarHBondContact O-CB 3.24Å; K900-K904 PolarHBondContact O-N 3.36Å; K900-K904 VanDerWaalsContact O-N 3.14Å; D901-K904 WeakPolarHBondContact O-CB 3.32Å; D901-K904 PolarHBondContact O-N 3.09Å; D901-K904 WeakPolarHBondContact OD1-CD 3.27Å; D901-K904 IonicContact OD1-NZ 3.46Å; D901-K904 PolarHBondContact OD1-NZ 3.03Å; K902-K904 PolarHBondContact O-N 2.84Å; K904-S907 VanDerWaalsContact CA-OG 3.3Å; K904-S907 WeakPolarHBondContact CA-OG 3.49Å; K904-S907 PolarHBondContact O-OG 2.93Å; K904-R908 WeakPolarHBondContact O-CB 3.26Å; K904-R908 WeakPolarHBondContact O-CD 3.47Å; K904-R908 WeakPolarHBondContact O-CG 3.31Å
905	L	73.8	Confident	71.4	Confident	113 Å²	113	130.3 Å²	130.3	59%	0.592	60%	0.597	S	S	*	*	H	α-helix	trans	-83.5	-40.2	170.2	-83.1	162.2	0	0	0	111.8	D901 K902 S909	D901-L905 PolarHBondContact O-N 3.22Å; K902-L905 WeakPolarHBondContact O-CB 3.41Å; K902-L905 PolarHBondContact O-N 3.28Å; L905-S909 WeakPolarHBondContact O-CB 3.27Å; L905-S909 PolarHBondContact O-N 3.34Å; L905-S909 PolarHBondContact O-OG 3.34Å
906	E	74	Confident	69.4	Low	111 Å²	111	128.1 Å²	128.1	52%	0.519	60%	0.598	S	S	.	*	H	α-helix	trans	-67.4	-42.3	177.7	-71.9	-177.5	-165.2	0	0	112.1	K902 S909 K910	K902-E906 WeakPolarHBondContact CE-OE1 3.15Å; K902-E906 IonicContact NZ-OE1 3.65Å; K902-E906 PolarHBondContact O-N 3.04Å; E906-S909 WeakPolarHBondContact O-CB 2.85Å; E906-S909 PolarHBondContact O-N 2.96Å; E906-K910 PolarHBondContact O-N 2.84Å
907	S	71.5	Confident	67.4	Low	55 Å²	55	130 Å²	130	39%	0.385	61%	0.608	S	S	.	*	H	α-helix	trans	-59.6	-51.2	171.9	45.7	0	0	0	0	112.2	E903 K904 S909 K910 D911	E903-S907 WeakPolarHBondContact O-CB 3.14Å; E903-S907 PolarHBondContact O-N 2.9Å; E903-S907 PolarHBondContact O-OG 2.71Å; K904-S907 VanDerWaalsContact CA-OG 3.3Å; K904-S907 WeakPolarHBondContact CA-OG 3.49Å; K904-S907 PolarHBondContact O-OG 2.93Å; S907-S909 PolarHBondContact O-N 3.5Å; S907-S909 VanDerWaalsContact O-N 3.12Å; S907-K910 WeakPolarHBondContact O-CB 3.48Å; S907-K910 PolarHBondContact O-N 3.36Å; S907-D911 PolarHBondContact O-N 2.82Å
908	R	62.4	Low	65.1	Low	180 Å²	180	129 Å²	129	68%	0.679	62%	0.619	S	S	*	*	H	α-helix	trans	-56.8	-27.2	173.3	-84.7	179.3	149.4	-166.4	-6.8	114.1	K904 K912	K904-R908 WeakPolarHBondContact O-CB 3.26Å; K904-R908 WeakPolarHBondContact O-CD 3.47Å; K904-R908 WeakPolarHBondContact O-CG 3.31Å; R908-K912 PolarHBondContact O-N 3.02Å
909	S	61.2	Low	62.9	Low	77 Å²	77	129.9 Å²	129.9	54%	0.538	63%	0.629	S	S	.	*	H	α-helix	trans	-79.1	-35.3	177.3	-59.2	0	0	0	0	112	L905 E906 S907 K913	L905-S909 WeakPolarHBondContact O-CB 3.27Å; L905-S909 PolarHBondContact O-N 3.34Å; L905-S909 PolarHBondContact O-OG 3.34Å; E906-S909 WeakPolarHBondContact O-CB 2.85Å; E906-S909 PolarHBondContact O-N 2.96Å; S907-S909 PolarHBondContact O-N 3.5Å; S907-S909 VanDerWaalsContact O-N 3.12Å; S909-K913 WeakPolarHBondContact O-CB 3.29Å; S909-K913 PolarHBondContact O-N 3.18Å; S909-K913 VanDerWaalsContact O-N 3.08Å
910	K	60.6	Low	60.6	Low	149 Å²	149	128.9 Å²	128.9	65%	0.648	64%	0.637	S	S	*	*	H	α-helix	trans	-65.2	-49.8	168.4	-80	-179.3	171.2	178.3	0	111.9	E906 S907 K912 K913 E914	E906-K910 PolarHBondContact O-N 2.84Å; S907-K910 WeakPolarHBondContact O-CB 3.48Å; S907-K910 PolarHBondContact O-N 3.36Å; K910-K912 PolarHBondContact O-N 3.48Å; K910-K913 PolarHBondContact O-N 2.9Å; K910-E914 PolarHBondContact O-N 3.47Å
911	D	57.3	Low	58.5	Low	109 Å²	109	128 Å²	128	58%	0.583	65%	0.645	S	S	*	*	H	α-helix	trans	-54.9	-27.2	177.6	-71.8	-26.2	0	0	0	113.3	S907 K915	S907-D911 PolarHBondContact O-N 2.82Å; D911-K915 WeakPolarHBondContact O-CB 3.43Å
912	K	53.6	Low	56.3	Low	148 Å²	148	135 Å²	135	64%	0.643	67%	0.665	S	S	*	*	H	α-helix	trans	-85.3	-43.4	176.2	-157.8	174.6	-177.5	-172	0	111.7	R908 K910 E914 K915 D916	R908-K912 PolarHBondContact O-N 3.02Å; K910-K912 PolarHBondContact O-N 3.48Å; K912-E914 PolarHBondContact O-N 3.44Å; K912-K915 WeakPolarHBondContact O-CB 3.4Å; K912-K915 PolarHBondContact O-N 3.28Å; K912-K915 VanDerWaalsContact O-N 3.11Å; K912-D916 PolarHBondContact O-N 2.83Å
913	K	53.5	Low	54.4	Low	169 Å²	169	137.1 Å²	137.1	74%	0.735	67%	0.674	S	S	*	*	H	α-helix	trans	-66.9	-35.7	-179.7	-164.5	173.8	-176.4	-179.5	0	113.3	S909 K910 K915	S909-K913 WeakPolarHBondContact O-CB 3.29Å; S909-K913 PolarHBondContact O-N 3.18Å; S909-K913 VanDerWaalsContact O-N 3.08Å; K910-K913 PolarHBondContact O-N 2.9Å; K913-K915 PolarHBondContact O-N 2.6Å
914	E	52.2	Low	52.4	Low	154 Å²	154	137.4 Å²	137.4	72%	0.72	68%	0.675	S	S	*	*	H	α-helix	trans	-72.1	-10.6	173.9	-68.8	-176.1	-179.5	0	0	113.3	K910 K912	K910-E914 PolarHBondContact O-N 3.47Å; K912-E914 PolarHBondContact O-N 3.44Å
915	K	51.3	Low	50.4	Low	166 Å²	166	140.6 Å²	140.6	72%	0.722	68%	0.684	S	S	*	*	H	α-helix	trans	-99.6	-20.4	-174.2	-159.5	166.8	-170.6	168.7	0	114.3	D911 K912 K913	D911-K915 WeakPolarHBondContact O-CB 3.43Å; K912-K915 WeakPolarHBondContact O-CB 3.4Å; K912-K915 PolarHBondContact O-N 3.28Å; K912-K915 VanDerWaalsContact O-N 3.11Å; K913-K915 PolarHBondContact O-N 2.6Å
916	D	45.1	Very low	48.9	Very low	130 Å²	130	142.6 Å²	142.6	70%	0.695	69%	0.688	S	S	*	*	H	α-helix	trans	-88.7	-16.1	176.9	-66.7	-34.5	0	0	0	112.6	K912 C918	K912-D916 PolarHBondContact O-N 2.83Å; D916-C918 PolarHBondContact O-N 2.96Å
917	E	42.2	Very low	47.2	Very low	181 Å²	181	147.6 Å²	147.6	85%	0.846	70%	0.702	S	S	*	*	S	Bend	trans	-90.8	48.6	172.7	-71.6	-147.2	128.8	0	0	114.2
918	C	32.7	Very low	45.6	Very low	109 Å²	109	153.6 Å²	153.6	74%	0.736	72%	0.716	S	S	*	*			trans	-150.5	88.3	168.7	-147.7	0	0	0	0	114.9	D916	D916-C918 PolarHBondContact O-N 2.96Å
919	T	36.6	Very low	44.6	Very low	128 Å²	128	153.9 Å²	153.9	79%	0.785	73%	0.725	S	S	*	*			trans	-136	127.5	165.5	-61.2	0	0	0	0	110.1
920	P	38.1	Very low	43.6	Very low	123 Å²	123	154.6 Å²	154.6	80%	0.799	73%	0.73	S	S	*	*			trans	-95.7	128.3	-164	34.3	-35	0	0	0	115.5
921	T	40.3	Very low	42.5	Very low	134 Å²	134	153.9 Å²	153.9	82%	0.822	74%	0.738	S	S	*	*			trans	-120.3	85.9	175.1	47.5	0	0	0	0	113.8
922	R	33.2	Very low	41.8	Very low	230 Å²	230	154.1 Å²	154.1	87%	0.868	75%	0.748	S	S	*	*			trans	-2.3	133.8	147.8	-169.9	-170.6	-176	-179.6	1.9	117.7
923	K	42.7	Very low	41.3	Very low	173 Å²	173	152.9 Å²	152.9	75%	0.752	76%	0.755	S	S	*	*			trans	93.9	147.9	172.3	-63.3	-167.2	-176.2	-176.7	0	115.6
924	E	39.7	Very low	40.6	Very low	121 Å²	121	150 Å²	150	57%	0.565	76%	0.756	S	S	*	*			cis	-165.3	138.3	-19.6	177.4	166.6	164.3	0	0	112.3
925	R	37.4	Very low	40.6	Very low	192 Å²	192	148.1 Å²	148.1	73%	0.725	76%	0.757	S	S	*	*			trans	52.8	123.4	157.7	-74.7	172.1	172.8	150	-11.2	123
926	K	41	Very low	40.2	Very low	156 Å²	156	145.2 Å²	145.2	68%	0.678	76%	0.758	S	S	*	*				77	120.4	129.5	-70.5	175.3	177.6	177.5	0	121.4
927	R	38.7	Very low	40.1	Very low	215 Å²	215	149.7 Å²	149.7	81%	0.811	77%	0.765	S	S	*	*			trans	69.7	152.2	133.3	-66.9	175.8	-179.7	-172.9	-2.9	117.6
928	R	38.4	Very low	40.1	Very low	182 Å²	182	146.1 Å²	146.1	69%	0.687	76%	0.76	S	S	*	*			cis	-173.8	143.9	-27.4	-123.3	-172.7	-177.3	-136.5	5.1	106.5
929	H	40.3	Very low	40.6	Very low	185 Å²	185	146.1 Å²	146.1	86%	0.856	76%	0.761	S	S	*	*			trans	65.2	156.5	165	-57.8	-30.3	0	0	0	115.3
930	S	39.6	Very low	41	Very low	93 Å²	93	145.7 Å²	145.7	65%	0.65	76%	0.764	S	S	*	*			cis	-167.3	-167.6	-17.6	49.9	0	0	0	0	109.8
931	T	39.3	Very low	40.9	Very low	133 Å²	133	142.6 Å²	142.6	82%	0.816	75%	0.754	S	S	*	*			trans	76.5	115.8	153	34.3	0	0	0	0	120.9
932	S	41.1	Very low	41	Very low	114 Å²	114	147.5 Å²	147.5	80%	0.797	76%	0.757	S	S	*	*			trans	-64.7	-169.7	163	-23.4	0	0	0	0	113.5
933	P	43.3	Very low	41.2	Very low	123 Å²	123	147.6 Å²	147.6	80%	0.799	76%	0.758	S	S	*	*			cis	-138.3	-170.6	-2.1	38.1	-16.3	0	0	0	116.4
934	S	39.7	Very low	41.1	Very low	107 Å²	107	145.8 Å²	145.8	75%	0.748	76%	0.761	S	S	*	*			trans	-70.4	-172.1	168.4	-33.3	0	0	0	0	113.4
935	P	51.6	Low	41	Very low	115 Å²	115	149.7 Å²	149.7	75%	0.747	78%	0.776	S	S	*	*			cis	-146.4	-157.4	9.2	44.6	-22.8	0	0	0	117.2
936	S	42.8	Very low	41	Very low	106 Å²	106	145.5 Å²	145.5	74%	0.741	78%	0.776	S	S	*	*			trans	93.1	152.9	159.3	90.8	0	0	0	0	117.6
937	R	42.8	Very low	41.2	Very low	224 Å²	224	143.1 Å²	143.1	85%	0.845	78%	0.777	S	S	*	*			cis	-166	148	-0.1	-139.5	174.7	-172.2	-163.9	2.5	113.6
938	S	42.6	Very low	41.2	Very low	105 Å²	105	138.3 Å²	138.3	73%	0.734	78%	0.776	S	S	*	*			trans	61.3	154.9	152.5	30.9	0	0	0	0	121.1
939	S	43.7	Very low	41.5	Very low	109 Å²	109	134.9 Å²	134.9	76%	0.762	78%	0.777	S	S	*	*			cis	-171.6	153.5	-8.9	47.3	0	0	0	0	114.5
940	S	44.2	Very low	41.4	Very low	120 Å²	120	135.5 Å²	135.5	84%	0.839	78%	0.778	S	S	*	*			trans	68.7	146.7	152.6	-154.7	0	0	0	0	120.7
941	G	37.4	Very low	41.3	Very low	57 Å²	57	135.7 Å²	135.7	59%	0.588	78%	0.779	S	S	*	*			cis	150.9	126	-17.5	0	0	0	0	0	117.9
942	R	42.1	Very low	41.2	Very low	237 Å²	237	138 Å²	138	89%	0.894	78%	0.78	S	S	*	*			trans	74	161.9	164.7	-48.3	179.3	178.5	-169.6	-2.1	115.5
943	R	37.4	Very low	40.8	Very low	233 Å²	233	143.3 Å²	143.3	88%	0.879	78%	0.783	S	S	*	*			cis	-150.3	176.5	4.8	-146.5	175.2	-176.4	-177	0.1	112.7
944	V	39.7	Very low	40.5	Very low	134 Å²	134	141.3 Å²	141.3	81%	0.812	77%	0.772	S	S	*	*			trans	-102.9	139.8	-169.1	171.1	0	0	0	0	114.5
945	K	37	Very low	40.2	Very low	204 Å²	204	143.8 Å²	143.8	89%	0.887	77%	0.771	S	S	*	*			trans	-175	164.7	132	-111.9	176.8	175.6	-176.6	0	115
946	S	39.2	Very low	39.3	Very low	104 Å²	104	148.5 Å²	148.5	73%	0.727	77%	0.774	S	S	*	*			trans	-114.8	-169.9	177.6	57.5	0	0	0	0	110.2
947	P	44.3	Very low	39	Very low	106 Å²	106	148.2 Å²	148.2	69%	0.688	77%	0.772	S	S	*	*			cis	-141.1	169.6	-1.4	43.1	-25.3	0	0	0	118.3
948	S	39.2	Very low	38.6	Very low	114 Å²	114	143.8 Å²	143.8	80%	0.797	76%	0.761	S	S	*	*			trans	61.5	174	149.1	-69	0	0	0	0	120.5
949	P	44.3	Very low	38.4	Very low	110 Å²	110	148.6 Å²	148.6	71%	0.714	76%	0.763	S	S	*	*			cis	-134.3	167.5	-40.7	37.3	-21	0	0	0	116
950	K	37.4	Very low	38	Very low	198 Å²	198	148 Å²	148	86%	0.861	76%	0.759	S	S	*	*			trans	55.5	151.2	146.6	-84.2	-166.2	172.7	-168.9	0	124.7
951	S	39.2	Very low	37.9	Very low	97 Å²	97	151.6 Å²	151.6	68%	0.678	76%	0.762	S	S	*	*			trans	77	115.9	146.4	42.8	0	0	0	0	123.4
952	E	35.7	Very low	37.9	Very low	181 Å²	181	157.2 Å²	157.2	85%	0.846	77%	0.771	S	S	*	*				93.6	129.4	126.2	-77.4	175.5	-144.9	0	0	124.8
953	R	33.1	Very low	37.8	Very low	225 Å²	225	153.5 Å²	153.5	85%	0.849	76%	0.763	S	S	*	*			trans	92.8	135	139.9	-133.3	-179.7	172	145.2	-2.5	122.6
954	S	36.1	Very low	37.9	Very low	81 Å²	81	147.2 Å²	147.2	57%	0.566	76%	0.755	S	S	*	*			trans	63.7	113.3	144.5	49	0	0	0	0	122.7
955	E	34.2	Very low	37.8	Very low	159 Å²	159	145.5 Å²	145.5	74%	0.743	75%	0.749	S	S	*	*				83.4	124.2	116.6	-73	172.8	-119.5	0	0	124.5
956	R	32.4	Very low	37.8	Very low	215 Å²	215	147.4 Å²	147.4	81%	0.811	75%	0.751	S	S	*	*				85	128	121.6	-168	171.5	-171.7	172.5	2.7	121
957	S	36.6	Very low	37.6	Very low	99 Å²	99	148.2 Å²	148.2	69%	0.692	76%	0.756	S	S	*	*			trans	63	160.8	158.2	88	0	0	0	0	117.7
958	E	34.6	Very low	37.3	Very low	132 Å²	132	155.4 Å²	155.4	62%	0.617	77%	0.77	S	S	*	*			cis	-158.8	174.8	-8.6	-138.4	169.3	-111.1	0	0	111.2
959	R	37.9	Very low	37.1	Very low	205 Å²	205	155 Å²	155	77%	0.774	77%	0.766	S	S	*	*			trans	65.2	112.7	160.4	-63.6	157.6	-154.3	-150.2	-0.2	117
960	S	36.7	Very low	36.8	Very low	97 Å²	97	154.8 Å²	154.8	68%	0.678	77%	0.768	S	S	*	*				79.1	121.7	51.4	79.6	0	0	0	0	115.8
961	H	41.2	Very low	37	Very low	195 Å²	195	152.4 Å²	152.4	90%	0.903	76%	0.759	S	S	*	*			trans	-161	156.3	136.8	-110.9	-77.1	0	0	0	112
962	K	38	Very low	36.9	Very low	176 Å²	176	155 Å²	155	77%	0.765	76%	0.758	S	S	*	*			trans	-77.1	-177.2	-179.9	-68.7	176.5	172.6	173.2	0	111.1
963	E	39.3	Very low	37	Very low	158 Å²	158	153.2 Å²	153.2	74%	0.738	76%	0.755	S	S	*	*			cis	-173.6	161.7	34.5	-158.1	146.5	-106.6	0	0	115.7
964	S	39.3	Very low	37	Very low	101 Å²	101	147.7 Å²	147.7	71%	0.706	75%	0.751	S	S	*	*			trans	62.4	125.8	165.8	69.4	0	0	0	0	117.8
965	S	37.1	Very low	37.5	Very low	98 Å²	98	148.9 Å²	148.9	69%	0.685	76%	0.757	S	S	*	*			cis	92.4	111.9	26.7	87.9	0	0	0	0	116.5
966	R	37.9	Very low	37.6	Very low	245 Å²	245	152.7 Å²	152.7	93%	0.925	76%	0.764	S	S	*	*				165.4	124.9	123.9	-89.2	162.5	177.8	-179.5	-0.2	113
967	S	36.1	Very low	37.9	Very low	120 Å²	120	149.6 Å²	149.6	84%	0.839	76%	0.764	S	S	*	*			trans	-83.8	157	175.1	-35.1	0	0	0	0	112.2
968	R	37.4	Very low	38	Very low	258 Å²	258	150.6 Å²	150.6	97%	0.974	77%	0.765	S	S	*	*			trans	-156.3	158.9	154.4	-115	167.1	-174.4	173.7	0.8	111.5
969	S	35.6	Very low	38.1	Very low	104 Å²	104	148.4 Å²	148.4	73%	0.727	76%	0.764	S	S	*	*			trans	-126.8	-178.4	-159.2	56.5	0	0	0	0	113.2
970	S	37.6	Very low	38.2	Very low	106 Å²	106	147.2 Å²	147.2	74%	0.741	77%	0.765	S	S	*	*			trans	74.5	158.1	172.4	88.7	0	0	0	0	115
971	H	41.3	Very low	38.3	Very low	149 Å²	149	152.2 Å²	152.2	69%	0.69	77%	0.774	S	S	*	*			cis	-161.4	152.6	0.5	-139.6	3.9	0	0	0	111.5
972	K	36.9	Very low	38.1	Very low	150 Å²	150	146.8 Å²	146.8	65%	0.652	76%	0.763	S	S	*	*			trans	69.8	148.6	137.3	-91.3	178.8	179.7	178.6	0	125.1
973	D	38.5	Very low	38.2	Very low	145 Å²	145	147.3 Å²	147.3	78%	0.775	77%	0.765	S	S	*	*			trans	81.9	152.1	139.5	-62	-15.4	0	0	0	124.3
974	S	31.9	Very low	38.2	Very low	109 Å²	109	151 Å²	151	76%	0.762	77%	0.773	S	S	*	*			trans	-161.4	170	-171.4	179.1	0	0	0	0	106.3
975	P	46.6	Very low	38.4	Very low	106 Å²	106	151.3 Å²	151.3	69%	0.688	78%	0.775	S	S	*	*			cis	-121.1	171.5	-29	35.6	-22.2	0	0	0	112.8
976	R	38	Very low	38.7	Very low	238 Å²	238	152.8 Å²	152.8	90%	0.898	78%	0.782	S	S	*	*			trans	172.1	125.5	134.3	-100.8	169.5	171.6	164.2	-0	116.3
977	D	36.6	Very low	38.6	Very low	151 Å²	151	147 Å²	147	81%	0.807	78%	0.779	S	S	*	*				52.7	176.7	125.8	-132.2	-36.9	0	0	0	123.4
978	V	39.4	Very low	38.8	Very low	120 Å²	120	145 Å²	145	73%	0.727	78%	0.778	S	S	*	*			trans	84.4	57.9	167.1	-154.6	0	0	0	0	119.3
979	S	37.3	Very low	38.9	Very low	85 Å²	85	138.8 Å²	138.8	59%	0.594	77%	0.774	S	S	*	*				59.8	142.8	118.9	94.9	0	0	0	0	124.8
980	K	39.5	Very low	39.1	Very low	181 Å²	181	145.6 Å²	145.6	79%	0.787	78%	0.783	S	S	*	*			trans	86.1	118.5	141.2	-75.9	165	-175.4	158.4	0	122.5
981	K	38.7	Very low	39.5	Very low	202 Å²	202	147 Å²	147	88%	0.878	79%	0.788	S	S	*	*			trans	76.5	146.5	146.8	-65.5	175.6	177.5	176.9	0	118.3
982	A	38.1	Very low	39.8	Very low	80 Å²	80	146 Å²	146	66%	0.661	80%	0.795	S	S	*	*			cis	-173.7	161	-20.6	0	0	0	0	0	112.1
983	K	39.2	Very low	39.9	Very low	188 Å²	188	148.8 Å²	148.8	82%	0.817	81%	0.807	S	S	*	*			trans	110	119.3	150.8	-61.9	168.8	179.8	172.1	0	118.2
984	R	39.5	Very low	39.8	Very low	235 Å²	235	154.2 Å²	154.2	89%	0.887	82%	0.816	S	S	*	*			trans	66.2	139.1	131.8	-68.6	179.7	171.3	-170.5	-5.3	118.1
985	S	43.6	Very low	40.1	Very low	107 Å²	107	153 Å²	153	75%	0.748	81%	0.808	S	S	*	*			cis	-142.2	-153	13.5	-66.8	0	0	0	0	111.4
986	P	42.5	Very low	39.7	Very low	130 Å²	130	157.9 Å²	157.9	84%	0.844	81%	0.812	S	S	*	*				-117.3	179.7	-88.1	37.7	-22.3	0	0	0	115.4
987	S	37.1	Very low	39.6	Very low	124 Å²	124	156 Å²	156	87%	0.867	81%	0.805	S	S	*	*			trans	-87.3	155.9	-169.8	56.4	0	0	0	0	116.6
988	G	39.3	Very low	39.9	Very low	78 Å²	78	153.6 Å²	153.6	80%	0.804	80%	0.8	S	S	*	*			trans	-167.7	41.5	176.1	0	0	0	0	0	121.9
989	S	39.8	Very low	39.8	Very low	127 Å²	127	156.8 Å²	156.8	89%	0.888	80%	0.799	S	S	*	*			trans	-167	154	152.7	52.5	0	0	0	0	112.6
990	R	39.7	Very low	39.9	Very low	247 Å²	247	158.7 Å²	158.7	93%	0.932	81%	0.813	S	S	*	*			trans	-128.3	129.9	-176.7	-80.2	175.3	163.3	177.9	-5.3	111.2
991	T	45.6	Very low	39.9	Very low	135 Å²	135	161.5 Å²	161.5	83%	0.828	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-100.9	136.2	156.8	47.9	0	0	0	0	109.7
992	P	48.8	Very low	40.1	Very low	129 Å²	129	157.2 Å²	157.2	84%	0.838	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-79.5	125.8	-176.2	29.9	-33.3	0	0	0	112
993	K	37.7	Very low	40.5	Very low	208 Å²	208	159.5 Å²	159.5	90%	0.904	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-69.1	131.6	170.5	-67.8	176.4	175.9	179.3	0	110.3
994	R	36.4	Very low	40.6	Very low	259 Å²	259	158.5 Å²	158.5	98%	0.977	82%	0.817	S	S	*	*			trans	-120.4	94	161.9	-155.4	178.3	-165.6	-168.1	6.2	110.4
995	S	39.2	Very low	40.7	Very low	83 Å²	83	157.6 Å²	157.6	58%	0.58	82%	0.82	S	S	*	*			trans	-105	157.6	174.5	70.2	0	0	0	0	110.9
996	R	37.6	Very low	40.7	Very low	208 Å²	208	157.2 Å²	157.2	79%	0.785	82%	0.817	S	S	*	*			trans	64.5	91.7	163.4	-58.4	171.6	179.9	179.5	-1.7	117	D311	D311-R996 IonicContact OD2-CZ 3.18Å; D311-R996 VanDerWaalsContact OD2-CZ 3.24Å; D311-R996 IonicContact OD2-NE 3.07Å; D311-R996 PolarHBondContact OD2-NE 2.97Å; D311-R996 IonicContact OD2-NH2 3.58Å; D311-R996 PolarHBondContact OD2-NH2 3.4Å
997	R	36.6	Very low	40.5	Very low	198 Å²	198	155.1 Å²	155.1	75%	0.747	82%	0.819	S	S	*	*			trans	-134.9	132.4	133.5	-158.4	166.7	-179	169.8	-3.9	107.6	D109	D109-R997 IonicContact OD2-NH1 2.77Å
998	S	42.8	Very low	40.7	Very low	101 Å²	101	158.8 Å²	158.8	71%	0.706	82%	0.82	S	S	*	*			trans	-110.6	149.3	-162.3	42.7	0	0	0	0	113.3
999	R	36.3	Very low	40.8	Very low	187 Å²	187	164.3 Å²	164.3	71%	0.706	82%	0.822	S	S	*	*			trans	42.8	83.8	151.3	-63.2	172.2	169.4	-169.3	-13	116.8	E312	E312-R999 IonicContact OE1-CZ 3.99Å; E312-R999 IonicContact OE1-NE 4Å; E312-R999 IonicContact OE1-NH2 2.81Å; E312-R999 PolarHBondContact OE1-NH2 2.95Å; E312-R999 IonicContact OE2-CZ 2.68Å; E312-R999 IonicContact OE2-NE 2.79Å; E312-R999 PolarHBondContact OE2-NE 3.06Å; E312-R999 IonicContact OE2-NH2 3.21Å; E312-R999 PolarHBondContact OE2-NH2 2.86Å
1000	S	39.1	Very low	40.8	Very low	126 Å²	126	163.5 Å²	163.5	88%	0.881	82%	0.816	S	S	*	*			trans	-68.4	142.1	150	47.8	0	0	0	0	109.7
1001	R	39.6	Very low	40.8	Very low	240 Å²	240	163.5 Å²	163.5	91%	0.906	82%	0.816	S	S	*	*			trans	-108.5	110.9	-178.2	-75.1	-179.7	169.7	-174.2	-3.5	111
1002	S	43.4	Very low	40.5	Very low	111 Å²	111	162.9 Å²	162.9	78%	0.776	82%	0.817	S	S	*	*			trans	-78.1	136.4	160.9	-60.2	0	0	0	0	110	K1004	S1002-K1004 PolarHBondContact O-N 2.73Å
1003	P	46.6	Very low	40.5	Very low	128 Å²	128	165.8 Å²	165.8	83%	0.831	82%	0.82	S	S	*	*			trans	-79.2	107.3	-171.3	29.9	-34.5	0	0	0	112.7	K1005	P1003-K1005 PolarHBondContact O-N 2.7Å
1004	K	41.5	Very low	40.9	Very low	167 Å²	167	161 Å²	161	73%	0.726	81%	0.812	S	S	*	*			trans	-68.5	111.6	162.9	-76.6	-168.1	174.6	-172.9	0	109.6	S1002 S1006	S1002-K1004 PolarHBondContact O-N 2.73Å; K1004-S1006 PolarHBondContact O-N 3.15Å
1005	K	41.2	Very low	41.1	Very low	216 Å²	216	159.5 Å²	159.5	94%	0.939	81%	0.806	S	S	*	*			trans	-56.6	123	158.6	-89.2	-177.8	172.8	178.4	0	107.9	P1003	P1003-K1005 PolarHBondContact O-N 2.7Å
1006	S	43.9	Very low	41.7	Very low	100 Å²	100	160.8 Å²	160.8	70%	0.699	82%	0.815	S	S	*	*			trans	-120.9	116.4	170.8	44.4	0	0	0	0	108.9	K1004 K1008	K1004-S1006 PolarHBondContact O-N 3.15Å; S1006-K1008 PolarHBondContact O-N 3.37Å
1007	G	37.9	Very low	42.2	Very low	86 Å²	86	155.8 Å²	155.8	89%	0.887	81%	0.81	S	S	*	*			trans	-71	114.9	171.8	0	0	0	0	0	109.2
1008	K	41.4	Very low	42.6	Very low	201 Å²	201	154.8 Å²	154.8	87%	0.874	81%	0.813	S	S	*	*			trans	-98	148	171.8	-94.4	-171.6	173.5	-175.7	0	111.5	S1006	S1006-K1008 PolarHBondContact O-N 3.37Å
1009	K	41.7	Very low	42.7	Very low	194 Å²	194	161 Å²	161	84%	0.843	82%	0.821	S	S	*	*			trans	-64	166.5	-169.8	-65.5	173.9	172.8	179	0	113.9
1010	S	40.7	Very low	43.2	Very low	110 Å²	110	156.3 Å²	156.3	77%	0.769	82%	0.817	S	S	*	*			trans	63.9	105.3	145.4	60.6	0	0	0	0	119.4
1011	R	39.4	Very low	43.8	Very low	247 Å²	247	158.5 Å²	158.5	93%	0.932	81%	0.813	S	S	*	*				-156.5	103.2	112.2	-116.9	175	174.7	162.8	-2.3	111.1
1012	S	39.5	Very low	44.2	Very low	122 Å²	122	155.4 Å²	155.4	85%	0.853	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-88.4	130	159.1	39.3	0	0	0	0	108.4
1013	Q	48.1	Very low	44.4	Very low	190 Å²	190	159.1 Å²	159.1	89%	0.888	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-100.3	145.4	164.7	-89.4	-178.1	-48.1	0	0	109.5
1014	S	45.5	Very low	44.6	Very low	106 Å²	106	157.6 Å²	157.6	74%	0.741	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-78.3	145.7	176.9	49.5	0	0	0	0	111.7
1015	R	42.1	Very low	45	Very low	229 Å²	229	159.1 Å²	159.1	86%	0.864	81%	0.808	S	S	*	*				178.7	104.8	120.8	-96.4	165.4	-179.6	-150.3	-1.7	113.5
1016	S	50.6	Low	45.4	Very low	109 Å²	109	158.5 Å²	158.5	76%	0.762	81%	0.805	S	S	*	*			trans	70.2	169.2	131.8	-40.3	0	0	0	0	117.2
1017	P	48.6	Very low	45.4	Very low	104 Å²	104	161.2 Å²	161.2	68%	0.675	81%	0.812	S	S	*	*				-141	-176.8	-106	30.7	-4.6	0	0	0	117.3
1018	H	45.3	Very low	46.1	Very low	177 Å²	177	166.6 Å²	166.6	82%	0.819	81%	0.811	S	S	*	*			trans	82.3	143.6	157.1	-68.9	-63.5	0	0	0	122.4
1019	R	43.8	Very low	46.4	Very low	230 Å²	230	168.7 Å²	168.7	87%	0.868	82%	0.823	S	S	*	*			trans	66.4	90.9	147.6	-85.8	-174.2	169.8	-178.1	-3.1	120.9
1020	S	48.3	Very low	46.6	Very low	89 Å²	89	167.4 Å²	167.4	62%	0.622	82%	0.822	S	S	*	*				72.8	125.3	108.8	68.4	0	0	0	0	122.3
1021	H	50.1	Low	46.9	Very low	172 Å²	172	170.4 Å²	170.4	80%	0.796	82%	0.824	S	S	*	*			trans	85.2	137.9	140.6	-74.8	-49.4	0	0	0	122.8
1022	K	47.9	Very low	47.4	Very low	175 Å²	175	166.2 Å²	166.2	76%	0.761	82%	0.819	S	S	*	*			trans	79.9	114.4	145.4	-79.4	172.1	179.2	173.4	0	120.2
1023	K	48.6	Very low	47.8	Very low	189 Å²	189	168.8 Å²	168.8	82%	0.822	82%	0.816	S	S	*	*			trans	61.6	128.4	130.1	-66.8	-175.1	174.6	-171	0	116.9
1024	S	50.9	Low	47.8	Very low	97 Å²	97	167.4 Å²	167.4	68%	0.678	81%	0.812	S	S	*	*			cis	163.9	168.7	22.2	47.1	0	0	0	0	108.1
1025	K	48.6	Very low	48	Very low	199 Å²	199	171.5 Å²	171.5	87%	0.865	82%	0.817	S	S	*	*			trans	43.2	126.2	147	-66.9	177.6	177.8	-173.8	0	117.7
1026	K	51.2	Low	48.4	Very low	203 Å²	203	167.4 Å²	167.4	88%	0.883	81%	0.813	S	S	*	*				-164.3	154.9	63.8	-134.4	169.7	-176.8	178.6	0	112.4
1027	N	44	Very low	48.2	Very low	157 Å²	157	171.9 Å²	171.9	84%	0.84	82%	0.817	S	S	*	*			trans	-77.2	143.2	171.8	-63.2	12.2	0	0	0	112
1028	K	52	Low	48.2	Very low	199 Å²	199	177.6 Å²	177.6	87%	0.865	83%	0.829	S	S	*	*			trans	173.2	140.9	131.3	-95.8	175.7	174.7	-168.9	0	106.6
1029	H	47.2	Very low	48.4	Very low	244 Å²	244	177.6 Å²	177.6	100%	1.13	83%	0.83	S	S	*	*			cis	-130.2	0	14.5	-158.2	-44.7	0	0	0	111.4

Retrieved 1,029 of 1,029 residues in 924.5 ms (Link to these results)

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