A0A077Z369_TRITR Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A077Z369, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,456 aa.

						>A0A077Z369_TRITR|A0A077Z369
MSGPRSEEANTGKEDASISHRPSNAESHGTAGAHSAALTETASKTHAGPGRLRCYSCFTPVNSSSSVAWRKPDKLTSSASPMDLNKKRKFALKKMEAYTISENADFFGAEEKNRIKQLEDDWGKKLLHRRRRNLRSRQTSGDKQHVVAEIGSLPSPGGQRTEDLAVSTEQLGTTPKIIEEQAEERDAEELHDDDSELLEEHPIDKSVDGRFLKFEEEIGRGSFKTVYRGLDTETGVYVAWCELQESKLSKLERQRFRDEAEMLKTLHHPNIVRFYDFWDINAGKRKCIVLVTELMTSGTLKLYIKRFKKINVKVLKSWCRQILKGLAFLHSRQPPVIHRDLKCDNIFITGTTGSVKIGDLGLATLKDKSCPKSVIGTPEFMAPEMYEENYDESVDVYAFGMCMLEMITGEYPYSECQFPVQIYKKVTQARSGQCCRCVKGVKPQCFEKIPSSNPEIREIIDRCTRPRREERYSAKDLLIHDFFMPEELIGLRLEVKDRETTVASSNNEVQFLLRVLDEKKRKEYKQKENEAVQFSFDLLNEKAEDVVREMVNSRSSQFWHNVPVTAQLIQDEDYRTIVKLLQDKIGQIRKDRELYRKEQERLKENEKKAKEEAQLQLELKQLKEKKEKMENVGISEEQCIVHNDQVEQSEEVKEKAVAEETLQVPESAQDTVDNPKKNILVIEKVVRRASQQSLVVESGEPKATFKDNVSAEAKSRSSEDEETDASKKATPSQHQKSHGMKLKVIRLISGRKSPPVVSCRLETQKRTITFQFAPLTDNPRFIAEAFMESSFIDGNQAQLCSGQLEKVAQAVKDNPDAISGLLMGDEEGAPPLGCASSSVVSLSSVNDREVVYGIAKNISFDPKRLCQLSAAQLLSKVKIPDPGGYCSSLSNPNTADIGEHNQPSFPLSASLPDFPASLKDKSSVPLSSNILLSEKNGRFVVNKVVASESPEVVVPPVNTSSGNSAASVQTPEVQEASPQDIDKASIVQSAAATMPPLASQDVKAEVSPAEPCTLGSDSEAVSAGRDSLRAVASAKEVGLAERTAEADVLTESKEELGPTTRSMPNTIHRTAEEGRPPVADIGELAMELSKLIDLKREPSSSVSGKPVEQPATPSVAKTEQPPDADDLAKPSLAVESPFKADPKSSEAQSKELSKDIQKDAVKEAKKEQGSKHAEATKPLQKDSKEALMAILSRQKDEMTALIAKHKCELAAYFAASIEEKQVPSTEGSTEKKKGLVGLIAQKPPIEDAVNLRKPFCGAAWDCDDSSAKHGKSTNALADVVASPSNVNKVNNTLVKEFTRPSHRSAAVVTDVVAPSSRDPVTARLASVAGISLVPNGSSRKCSCPTVIDCKSQIPKPLGFNRMFLNSKKKLTGNKSPSADNTSIADVRIFKMRFLPLQFVESLTIRNLQNKEMKYEYKRTPEKDLLQQGNTFTFENMPTLRSSRFKTILNFRIPGNR
					

Structure Viewer

Loading PAE data...

(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	32.9	Very low	32.3	Very low	169 Å²	169	129.8 Å²	129.8	83%	0.833	75%	0.751	S	S	*	*				0	100.2	0	-74.4	177.6	166.2	0	0	108.2	K1117	M1-K1117 PolarHBondContact N-O 3.23Å; M1-K1117 VanDerWaalsContact N-O 3.12Å
2	S	35.5	Very low	32.5	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	75%	0.749	S	S	*	*				64.8	99.7	91.5	63.6	0	0	0	0	112.1
3	G	32.4	Very low	32.4	Very low	72 Å²	72	129.8 Å²	129.8	74%	0.742	76%	0.755	S	S	*	*			cis	106.8	128.7	15.7	0	0	0	0	0	110.5
4	P	40.8	Very low	32.6	Very low	127 Å²	127	132.5 Å²	132.5	83%	0.825	76%	0.757	S	S	*	*			trans	-101.3	-161.2	-161	41.8	-39.4	0	0	0	114.1
5	R	31.6	Very low	32.7	Very low	196 Å²	196	133.8 Å²	133.8	74%	0.74	76%	0.76	S	S	*	*			trans	87	138	-176.6	-58.2	-179.8	175.3	159.2	0.5	114	K1171	R5-K1171 PolarHBondContact NH1-O 2.88Å
6	S	29.8	Very low	33.1	Very low	89 Å²	89	131 Å²	131	62%	0.622	76%	0.759	S	S	*	*			cis	92	134.2	18.3	86.2	0	0	0	0	116.9
7	E	29	Very low	32.9	Very low	182 Å²	182	129.6 Å²	129.6	85%	0.85	76%	0.759	S	S	*	*			trans	75.8	167.4	165.5	-56.3	-174.4	114.5	0	0	118.4
8	E	31.5	Very low	33.3	Very low	114 Å²	114	131.1 Å²	131.1	53%	0.533	76%	0.761	S	S	.	*			trans	60.2	101.9	173.9	-54.9	-174.7	176.9	0	0	115.1	A1173 E1174	E8-A1173 WeakPolarHBondContact OE1-CA 3.31Å; E8-A1173 PolarHBondContact OE1-N 3.42Å; E8-A1173 PolarHBondContact OE2-N 2.79Å; E8-E1174 PolarHBondContact OE1-N 2.72Å
9	A	30.2	Very low	33.1	Very low	91 Å²	91	128.8 Å²	128.8	75%	0.752	75%	0.753	S	S	*	*			cis	65.3	84.5	32.1	0	0	0	0	0	114.9
10	N	31	Very low	33.5	Very low	144 Å²	144	131.3 Å²	131.3	77%	0.77	76%	0.757	S	S	*	*			trans	-163.1	143.7	152.1	-111.7	-32.8	0	0	0	116
11	T	30.7	Very low	33.4	Very low	132 Å²	132	136 Å²	136	81%	0.81	76%	0.762	S	S	*	*			trans	27.9	142.7	147.6	57.2	0	0	0	0	124
12	G	34.9	Very low	33.7	Very low	71 Å²	71	133.7 Å²	133.7	73%	0.732	76%	0.76	S	S	*	*			trans	122.6	96.2	171.6	0	0	0	0	0	109.8
13	K	30.4	Very low	33.7	Very low	189 Å²	189	134 Å²	134	82%	0.822	76%	0.762	S	S	*	*			cis	69.5	141.2	34.3	-152.1	-168.3	177.1	-163	0	112.2
14	E	35.3	Very low	33.5	Very low	167 Å²	167	138.1 Å²	138.1	78%	0.78	77%	0.767	S	S	*	*			trans	75.8	137.5	-175.2	-57.5	175.4	-164.3	0	0	114
15	D	34.2	Very low	33.2	Very low	152 Å²	152	136.2 Å²	136.2	81%	0.813	76%	0.762	S	S	*	*			cis	-163.2	-164.5	-27.8	-131.2	-51.4	0	0	0	111.3
16	A	39.1	Very low	33	Very low	89 Å²	89	135.7 Å²	135.7	74%	0.736	77%	0.768	S	S	*	*			trans	76.1	74.3	157	0	0	0	0	0	118.5
17	S	29.7	Very low	33.2	Very low	108 Å²	108	136.4 Å²	136.4	76%	0.755	77%	0.773	S	S	*	*			trans	-67.7	130.9	158.6	55.5	0	0	0	0	113.9
18	I	39.7	Very low	33.3	Very low	155 Å²	155	136.5 Å²	136.5	80%	0.795	77%	0.773	S	S	*	*			trans	-143.1	107.6	155.3	-55.2	179.7	0	0	0	106.2
19	S	30.9	Very low	33.5	Very low	89 Å²	89	134.4 Å²	134.4	62%	0.622	78%	0.782	S	S	*	*			cis	76.2	88.7	37.7	92.1	0	0	0	0	115.2
20	H	39.9	Very low	33.6	Very low	178 Å²	178	135.9 Å²	135.9	82%	0.824	78%	0.782	S	S	*	*			trans	170.8	153.6	149.4	-86.1	-48.5	0	0	0	109
21	R	32.6	Very low	33.6	Very low	229 Å²	229	134.2 Å²	134.2	86%	0.864	79%	0.788	S	S	*	*			cis	-166.9	147.6	-42.1	-138.4	-164	179	-172.2	0.3	105.5
22	P	38.3	Very low	33.8	Very low	121 Å²	121	131.3 Å²	131.3	79%	0.786	79%	0.785	S	S	*	*			trans	-99	164	-177.5	38.2	-33.9	0	0	0	113.3
23	S	35.2	Very low	33.6	Very low	120 Å²	120	131.9 Å²	131.9	84%	0.839	78%	0.782	S	S	*	*			trans	-167.9	157.9	153.2	51.4	0	0	0	0	113.9
24	N	29	Very low	33.9	Very low	158 Å²	158	131.8 Å²	131.8	85%	0.845	78%	0.784	S	S	*	*			trans	-74.8	151.8	174.3	-49.3	-24.1	0	0	0	112.8
25	A	34.5	Very low	33.6	Very low	87 Å²	87	128.6 Å²	128.6	72%	0.719	78%	0.78	S	S	*	*			trans	-176.8	124.1	138	0	0	0	0	0	105.9
26	E	27.8	Very low	33.4	Very low	185 Å²	185	125.1 Å²	125.1	86%	0.864	77%	0.773	S	S	*	*				71.6	152.1	60.7	-67.1	-163.6	134.4	0	0	114.9
27	S	32.9	Very low	32.8	Very low	103 Å²	103	125.3 Å²	125.3	72%	0.72	77%	0.774	S	S	*	*			trans	71.2	105.9	172.2	67.5	0	0	0	0	121.7
28	H	30.9	Very low	32.8	Very low	184 Å²	184	127.4 Å²	127.4	85%	0.852	78%	0.777	S	S	*	*				41.2	124.9	124.4	-59.4	-73.9	0	0	0	122.2	T30	H28-T30 HydrophobicContact CB-CG2 4.39Å
29	G	36.8	Very low	32.3	Very low	70 Å²	70	125.3 Å²	125.3	72%	0.722	77%	0.771	S	S	*	*			trans	-178	49	164.2	0	0	0	0	0	113.6
30	T	31.9	Very low	32.3	Very low	122 Å²	122	129.1 Å²	129.1	75%	0.748	78%	0.779	S	S	*	*				71.6	118.3	90.3	62.8	0	0	0	0	117.5	H28	H28-T30 HydrophobicContact CB-CG2 4.39Å
31	A	30.6	Very low	31.8	Very low	110 Å²	110	126.2 Å²	126.2	91%	0.909	77%	0.774	S	S	*	*			trans	72	159.3	150.5	0	0	0	0	0	120.3
32	G	35.3	Very low	31.8	Very low	71 Å²	71	119.8 Å²	119.8	73%	0.732	77%	0.769	S	S	*	*			trans	92.1	70.1	-175.3	0	0	0	0	0	113.2
33	A	31.6	Very low	31.7	Very low	82 Å²	82	118.8 Å²	118.8	68%	0.678	77%	0.766	S	S	*	*			cis	75.2	141.1	40.7	0	0	0	0	0	114.9
34	H	35.3	Very low	31.5	Very low	187 Å²	187	122 Å²	122	87%	0.866	77%	0.765	S	S	*	*			trans	72.3	152.8	-177.4	-56	-88.5	0	0	0	117.8
35	S	29.8	Very low	31.8	Very low	100 Å²	100	120.9 Å²	120.9	70%	0.699	76%	0.763	S	S	*	*			cis	165.5	144.7	-38.2	174.9	0	0	0	0	108.2
36	A	29.3	Very low	31.6	Very low	80 Å²	80	126 Å²	126	66%	0.661	77%	0.772	S	S	*	*			trans	47.9	101.6	151.7	0	0	0	0	0	120.3
37	A	27.4	Very low	32	Very low	92 Å²	92	122.2 Å²	122.2	76%	0.76	77%	0.773	S	S	*	*				64.3	-173.4	112.8	0	0	0	0	0	119.4
38	L	30.1	Very low	31.8	Very low	153 Å²	153	120.8 Å²	120.8	80%	0.801	77%	0.774	S	S	*	*			trans	68.7	139.3	175	-55.5	178.6	0	0	0	116
39	T	27.4	Very low	32.2	Very low	110 Å²	110	118.7 Å²	118.7	68%	0.675	78%	0.776	S	S	*	*			cis	-172.9	-175.1	-38.7	16.7	0	0	0	0	106
40	E	31.5	Very low	32.1	Very low	170 Å²	170	118.7 Å²	118.7	79%	0.794	78%	0.776	S	S	*	*			trans	75	155.7	156.7	-47.2	-159.1	121.2	0	0	118.7
41	T	28.6	Very low	32.1	Very low	117 Å²	117	123.7 Å²	123.7	72%	0.718	78%	0.782	S	S	*	*			cis	-157.1	167.4	-46.1	40.7	0	0	0	0	108
42	A	34.1	Very low	32	Very low	93 Å²	93	124.6 Å²	124.6	77%	0.769	77%	0.77	S	S	*	*			trans	70.8	154.7	161.7	0	0	0	0	0	116.8
43	S	35.1	Very low	31.8	Very low	101 Å²	101	131.6 Å²	131.6	71%	0.706	78%	0.775	S	S	*	*			cis	-149.3	137.4	-1.1	-139	0	0	0	0	114.2
44	K	31.2	Very low	31.5	Very low	188 Å²	188	133 Å²	133	82%	0.817	78%	0.778	S	S	*	*			trans	14.6	123.6	140.3	-57.3	169.9	178.4	175.6	0	119.5
45	T	34.9	Very low	31.1	Very low	133 Å²	133	134.3 Å²	134.3	82%	0.816	78%	0.777	S	S	*	*				167.6	116.6	110.1	34.1	0	0	0	0	109.1
46	H	30.3	Very low	31.1	Very low	195 Å²	195	134 Å²	134	90%	0.903	78%	0.775	S	S	*	*				59.1	87.2	71.1	-98.6	-81.4	0	0	0	116.3
47	A	37.2	Very low	31	Very low	106 Å²	106	135.3 Å²	135.3	88%	0.876	78%	0.778	S	S	*	*			trans	-166.3	131.4	143.1	0	0	0	0	0	112.7
48	G	28.6	Very low	31.2	Very low	73 Å²	73	139.6 Å²	139.6	75%	0.753	78%	0.78	S	S	*	*			trans	-133.4	-153.1	152.3	0	0	0	0	0	107
49	P	39.6	Very low	31.2	Very low	139 Å²	139	137.8 Å²	137.8	90%	0.903	78%	0.775	S	S	*	*			cis	-136.2	-175.2	-10.4	42.1	-25.8	0	0	0	113.7
50	G	34.5	Very low	31.6	Very low	70 Å²	70	138 Å²	138	72%	0.722	78%	0.779	S	S	*	*			trans	94.4	178.6	162.3	0	0	0	0	0	116.2
51	R	31.3	Very low	31.5	Very low	227 Å²	227	136.7 Å²	136.7	86%	0.857	78%	0.782	S	S	*	*			cis	-162.1	134.9	-10.6	-130.3	-161	178	-168.4	1.1	110.6
52	L	28.5	Very low	31.5	Very low	129 Å²	129	138.3 Å²	138.3	68%	0.675	79%	0.786	S	S	*	*			trans	46.2	142	151.2	-89.7	82.4	0	0	0	123.2
53	R	30.5	Very low	31.3	Very low	218 Å²	218	139.6 Å²	139.6	82%	0.823	79%	0.79	S	S	*	*			trans	78.5	99.3	145.8	-73.3	174.1	178.9	-177.4	-0.7	121.1
54	C	25.7	Very low	31.1	Very low	111 Å²	111	139.5 Å²	139.5	75%	0.75	79%	0.789	S	S	*	*				43.7	140	104.8	-54.6	0	0	0	0	123.3
55	Y	27.5	Very low	31.1	Very low	215 Å²	215	136.5 Å²	136.5	84%	0.843	79%	0.792	S	S	*	*			trans	87.6	116.5	145.7	-80.8	-60.3	0	0	0	122.1
56	S	29.5	Very low	30.9	Very low	94 Å²	94	135.3 Å²	135.3	66%	0.657	79%	0.789	S	S	*	*				81.6	122.8	127	67.8	0	0	0	0	122.1
57	C	27.5	Very low	31	Very low	107 Å²	107	132.6 Å²	132.6	72%	0.723	79%	0.786	S	S	*	*			trans	67	153.1	149.6	-53.9	0	0	0	0	116.4
58	F	31.4	Very low	30.7	Very low	183 Å²	183	130.6 Å²	130.6	80%	0.803	77%	0.769	S	S	*	*			cis	-147.6	159.6	34.2	-106.2	-91	0	0	0	114.4
59	T	30.3	Very low	30.7	Very low	114 Å²	114	139.4 Å²	139.4	70%	0.699	78%	0.78	S	S	*	*			trans	7.3	148.1	155.5	51.3	0	0	0	0	123.1
60	P	35.9	Very low	30.2	Very low	116 Å²	116	144 Å²	144	75%	0.753	78%	0.779	S	S	*	*			trans	-81.7	164.3	173.8	36.8	-37.4	0	0	0	114.1
61	V	29.7	Very low	29.9	Very low	142 Å²	142	150.1 Å²	150.1	86%	0.861	79%	0.786	S	S	*	*				176.6	151.6	126.3	150.8	0	0	0	0	111
62	N	27.6	Very low	30	Very low	150 Å²	150	144.6 Å²	144.6	80%	0.802	78%	0.779	S	S	*	*			trans	-51.2	140.6	-171.8	-63.8	-36.9	0	0	0	118.2
63	S	31.5	Very low	30.1	Very low	120 Å²	120	144.6 Å²	144.6	84%	0.839	78%	0.78	S	S	*	*				-163.8	166.4	126.6	56.7	0	0	0	0	111.2
64	S	31.2	Very low	30.1	Very low	100 Å²	100	143 Å²	143	70%	0.699	78%	0.779	S	S	*	*				-173.7	131.1	-58	-98.6	0	0	0	0	110.2
65	S	30.4	Very low	30.3	Very low	125 Å²	125	145 Å²	145	87%	0.874	78%	0.782	S	S	*	*			trans	66.9	153.2	176.9	82.5	0	0	0	0	115.8
66	S	30.9	Very low	30.3	Very low	107 Å²	107	140.8 Å²	140.8	75%	0.748	78%	0.779	S	S	*	*			cis	-149.6	-171.3	13.7	62.8	0	0	0	0	109.9
67	V	31.3	Very low	30.3	Very low	138 Å²	138	141.9 Å²	141.9	84%	0.836	79%	0.786	S	S	*	*			cis	-148.1	-57	8.3	59.1	0	0	0	0	115.1
68	A	31.1	Very low	30.5	Very low	65 Å²	65	142.5 Å²	142.5	54%	0.537	79%	0.792	S	S	.	*			trans	-161.5	160.3	-162.8	0	0	0	0	0	111.5
69	W	28.5	Very low	30.4	Very low	257 Å²	257	138.6 Å²	138.6	97%	0.973	79%	0.793	S	S	*	*			cis	-120.5	-179	19.2	-75.1	76.9	0	0	0	114.4
70	R	29.3	Very low	30.5	Very low	235 Å²	235	138.3 Å²	138.3	89%	0.887	80%	0.796	S	S	*	*			trans	-112.3	135.9	-160.2	-62.1	-178.6	178.1	-169.7	0.4	114.8
71	K	28.5	Very low	30.5	Very low	200 Å²	200	138.7 Å²	138.7	87%	0.87	80%	0.799	S	S	*	*				35.2	154.6	124.6	-69.7	-167	176.1	-170.7	0	120.9
72	P	33.2	Very low	30.8	Very low	110 Å²	110	139.1 Å²	139.1	71%	0.714	79%	0.793	S	S	*	*			cis	-140.2	178.8	24.7	43	-24.6	0	0	0	118.8
73	D	30.3	Very low	31.8	Very low	130 Å²	130	135.4 Å²	135.4	70%	0.695	77%	0.773	S	S	*	*			trans	71.5	120.6	147.8	-78.1	20.3	0	0	0	125.6
74	K	30.6	Very low	32.5	Very low	183 Å²	183	135 Å²	135	80%	0.796	76%	0.761	S	S	*	*			trans	80.2	136.9	140.3	-70.3	179.1	-176.3	175.7	0	122.7
75	L	30.4	Very low	33.1	Very low	153 Å²	153	134.5 Å²	134.5	80%	0.801	75%	0.75	S	S	*	*			trans	86.3	127.4	153.7	-71.9	159.3	0	0	0	121.6
76	T	28.6	Very low	34.3	Very low	128 Å²	128	135.8 Å²	135.8	79%	0.785	74%	0.74	S	S	*	*			trans	60.6	108.9	153.5	55.1	0	0	0	0	121.2
77	S	29.3	Very low	35.3	Very low	117 Å²	117	135.2 Å²	135.2	82%	0.818	72%	0.724	S	S	*	*				-179.2	177.8	127.2	45.2	0	0	0	0	112
78	S	31.5	Very low	36	Very low	119 Å²	119	133.6 Å²	133.6	83%	0.832	70%	0.703	S	S	*	*			trans	52.9	81.5	175	68.8	0	0	0	0	118.1
79	A	29.2	Very low	37	Very low	101 Å²	101	138.4 Å²	138.4	84%	0.835	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-85.5	132.5	149.9	0	0	0	0	0	109.2
80	S	31.5	Very low	38	Very low	108 Å²	108	133.4 Å²	133.4	76%	0.755	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-72.7	145.4	177.7	-170.5	0	0	0	0	111.4	M82	S80-M82 PolarHBondContact O-N 2.94Å; S80-M82 VanDerWaalsContact O-N 3.17Å
81	P	35.7	Very low	38.7	Very low	125 Å²	125	123.3 Å²	123.3	81%	0.812	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-58.6	118.6	176.9	-24	34.6	0	0	0	112.3	D83	P81-D83 PolarHBondContact O-N 3.16Å
82	M	37.3	Very low	39.7	Very low	151 Å²	151	118.4 Å²	118.4	74%	0.744	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-67.6	123.7	173.5	-83.1	-167.6	-80.4	0	0	111.3	S80 L84	S80-M82 PolarHBondContact O-N 2.94Å; S80-M82 VanDerWaalsContact O-N 3.17Å; M82-L84 PolarHBondContact O-N 3.25Å
83	D	48.2	Very low	40.4	Very low	71 Å²	71	120.6 Å²	120.6	38%	0.38	65%	0.645	S	S	.	*			trans	-33.2	117.8	172.1	167.6	16.1	0	0	0	113.8	P81 N85 K86 K87	P81-D83 PolarHBondContact O-N 3.16Å; D83-N85 PolarHBondContact O-N 3.49Å; D83-N85 WeakPolarHBondContact OD1-CB 3.49Å; D83-N85 PolarHBondContact OD1-N 3.49Å; D83-K86 HydrophobicContact CB-CB 4.39Å; D83-K86 HydrophobicContact CB-CD 4.14Å; D83-K86 HydrophobicContact CB-CG 4.42Å; D83-K86 PolarHBondContact O-N 3.17Å; D83-K86 VanDerWaalsContact O-N 3.12Å; D83-K86 WeakPolarHBondContact OD2-CD 3.19Å; D83-K86 VanDerWaalsContact OD2-CE 3.31Å; D83-K86 WeakPolarHBondContact OD2-CE 3.37Å; D83-K86 VanDerWaalsContact OD2-CG 3.27Å; D83-K86 WeakPolarHBondContact OD2-CG 3.34Å; D83-K87 PolarHBondContact O-N 2.94Å
84	L	45.6	Very low	41.2	Very low	113 Å²	113	119.6 Å²	119.6	59%	0.592	64%	0.635	S	S	*	*	H	α-helix	trans	-57.7	-34	179.6	-77.5	162.9	0	0	0	112.6	M82 K87 R88	M82-L84 PolarHBondContact O-N 3.25Å; L84-K87 PolarHBondContact O-N 2.91Å; L84-R88 WeakPolarHBondContact O-CB 3.49Å; L84-R88 PolarHBondContact O-N 2.83Å
85	N	44.7	Very low	41.5	Very low	89 Å²	89	115.5 Å²	115.5	48%	0.476	62%	0.619	S	S	.	*	H	α-helix	trans	-73.2	-28.7	179.2	-77.6	-52.4	0	0	0	112.6	D83 R88 K89	D83-N85 PolarHBondContact O-N 3.49Å; D83-N85 WeakPolarHBondContact OD1-CB 3.49Å; D83-N85 PolarHBondContact OD1-N 3.49Å; N85-R88 PolarHBondContact OD1-NH1 3.07Å; N85-R88 VanDerWaalsContact OD1-NH1 3.07Å; N85-K89 PolarHBondContact O-N 3.36Å
86	K	55.5	Low	41.9	Very low	152 Å²	152	113.8 Å²	113.8	66%	0.661	61%	0.607	S	S	*	*	H	α-helix	trans	-69.6	-45.7	169.8	-77.1	169.1	-165.3	171.6	0	111.4	D83 R88 K89 F90	D83-K86 HydrophobicContact CB-CB 4.39Å; D83-K86 HydrophobicContact CB-CD 4.14Å; D83-K86 HydrophobicContact CB-CG 4.42Å; D83-K86 PolarHBondContact O-N 3.17Å; D83-K86 VanDerWaalsContact O-N 3.12Å; D83-K86 WeakPolarHBondContact OD2-CD 3.19Å; D83-K86 VanDerWaalsContact OD2-CE 3.31Å; D83-K86 WeakPolarHBondContact OD2-CE 3.37Å; D83-K86 VanDerWaalsContact OD2-CG 3.27Å; D83-K86 WeakPolarHBondContact OD2-CG 3.34Å; K86-R88 VanDerWaalsContact C-N 3.35Å; K86-R88 PolarHBondContact O-N 3.04Å; K86-K89 PolarHBondContact O-N 2.83Å; K86-F90 WeakPolarHBondContact O-CB 3.12Å; K86-F90 PolarHBondContact O-N 3.31Å
87	K	51.9	Low	42.2	Very low	94 Å²	94	111 Å²	111	41%	0.409	60%	0.597	S	S	.	*	H	α-helix	trans	-55.3	-49.1	171.4	-74.6	-172.1	174.2	-171.5	0	111.3	D83 L84 K89 F90 A91	D83-K87 PolarHBondContact O-N 2.94Å; L84-K87 PolarHBondContact O-N 2.91Å; K87-K89 PolarHBondContact O-N 3.45Å; K87-F90 PolarHBondContact O-N 2.75Å; K87-A91 WeakPolarHBondContact O-CB 3.34Å; K87-A91 PolarHBondContact O-N 3.37Å
88	R	44.9	Very low	42.4	Very low	105 Å²	105	112.9 Å²	112.9	40%	0.396	59%	0.588	S	S	.	*	H	α-helix	trans	-56	-49.7	178.7	-175.8	-176.6	-175.1	-173.7	6.6	112.9	L84 N85 K86 L92 Y237	L84-R88 WeakPolarHBondContact O-CB 3.49Å; L84-R88 PolarHBondContact O-N 2.83Å; N85-R88 PolarHBondContact OD1-NH1 3.07Å; N85-R88 VanDerWaalsContact OD1-NH1 3.07Å; K86-R88 VanDerWaalsContact C-N 3.35Å; K86-R88 PolarHBondContact O-N 3.04Å; R88-L92 HydrophobicContact CG-CD1 4.33Å; R88-L92 WeakPolarHBondContact O-CB 3.15Å; R88-L92 WeakPolarHBondContact O-CG 3.16Å; R88-L92 PolarHBondContact O-N 3.18Å; R88-L92 VanDerWaalsContact O-N 3.12Å; R88-Y237 PolarHBondContact NH2-OH 3.08Å
89	K	53.1	Low	42.8	Very low	165 Å²	165	110.2 Å²	110.2	72%	0.717	57%	0.566	S	S	*	*	H	α-helix	trans	-63.6	-39.8	176.6	-81.9	-176.9	174.9	176.1	0	112.4	N85 K86 K87 K93	N85-K89 PolarHBondContact O-N 3.36Å; K86-K89 PolarHBondContact O-N 2.83Å; K87-K89 PolarHBondContact O-N 3.45Å; K89-K93 WeakPolarHBondContact O-CB 3.38Å; K89-K93 PolarHBondContact O-N 3.37Å
90	F	49.2	Very low	43.2	Very low	152 Å²	152	110.3 Å²	110.3	67%	0.667	55%	0.552	S	S	*	*	H	α-helix	trans	-71.5	-41.7	-179.7	-158.9	-92.7	0	0	0	112.4	K86 K87 K93 K94	K86-F90 WeakPolarHBondContact O-CB 3.12Å; K86-F90 PolarHBondContact O-N 3.31Å; K87-F90 PolarHBondContact O-N 2.75Å; F90-K93 PolarHBondContact O-N 2.81Å; F90-K94 HydrophobicContact CE1-CD 4.42Å; F90-K94 VanDerWaalsContact O-CB 3.29Å; F90-K94 WeakPolarHBondContact O-CB 3.43Å; F90-K94 PolarHBondContact O-N 2.79Å
91	A	44	Very low	43.4	Very low	23 Å²	23	110.3 Å²	110.3	19%	0.19	55%	0.552	C	S	.	*	H	α-helix	trans	-62.7	-47	177.3	0	0	0	0	0	112.1	K87 K94 M95	K87-A91 WeakPolarHBondContact O-CB 3.34Å; K87-A91 PolarHBondContact O-N 3.37Å; A91-K94 PolarHBondContact O-N 3.36Å; A91-M95 WeakPolarHBondContact O-CG 3.44Å; A91-M95 PolarHBondContact O-N 3.16Å
92	L	49	Very low	43.6	Very low	97 Å²	97	112.7 Å²	112.7	51%	0.508	55%	0.552	S	S	.	*	H	α-helix	trans	-56.6	-54.1	175.1	-76.1	166.3	0	0	0	111.3	R88 K94 M95 E96	R88-L92 HydrophobicContact CG-CD1 4.33Å; R88-L92 WeakPolarHBondContact O-CB 3.15Å; R88-L92 WeakPolarHBondContact O-CG 3.16Å; R88-L92 PolarHBondContact O-N 3.18Å; R88-L92 VanDerWaalsContact O-N 3.12Å; L92-K94 VanDerWaalsContact C-N 3.25Å; L92-K94 PolarHBondContact O-N 3.36Å; L92-M95 PolarHBondContact O-N 3.33Å; L92-M95 VanDerWaalsContact O-N 3.1Å; L92-E96 WeakPolarHBondContact O-CG 3.32Å; L92-E96 PolarHBondContact O-N 2.85Å
93	K	48.6	Very low	43.9	Very low	156 Å²	156	110.2 Å²	110.2	68%	0.678	54%	0.542	S	S	*	.	H	α-helix	trans	-61.9	-31.5	-179.3	-166.7	173.6	-176.8	-180	0	113	K89 F90 A97	K89-K93 WeakPolarHBondContact O-CB 3.38Å; K89-K93 PolarHBondContact O-N 3.37Å; F90-K93 PolarHBondContact O-N 2.81Å; K93-A97 WeakPolarHBondContact O-CB 3.24Å; K93-A97 PolarHBondContact O-N 3.44Å; K93-A97 VanDerWaalsContact O-N 3.16Å
94	K	46.7	Very low	43.5	Very low	110 Å²	110	108.3 Å²	108.3	48%	0.478	54%	0.536	S	S	.	.	H	α-helix	trans	-74.8	-35	175.8	-166.3	171.4	-176.8	178.1	0	112.5	F90 A91 L92 Y98	F90-K94 HydrophobicContact CE1-CD 4.42Å; F90-K94 VanDerWaalsContact O-CB 3.29Å; F90-K94 WeakPolarHBondContact O-CB 3.43Å; F90-K94 PolarHBondContact O-N 2.79Å; A91-K94 PolarHBondContact O-N 3.36Å; L92-K94 VanDerWaalsContact C-N 3.25Å; L92-K94 PolarHBondContact O-N 3.36Å; K94-Y98 HydrophobicContact CG-CD2 4.4Å; K94-Y98 PolarHBondContact O-N 2.98Å; K94-Y98 VanDerWaalsContact O-N 3.13Å
95	M	36.2	Very low	43.6	Very low	96 Å²	96	110.6 Å²	110.6	47%	0.473	55%	0.549	S	S	.	.	H	α-helix	trans	-70.9	-38.8	173.3	-68.4	-139.3	-63.5	0	0	112.5	A91 L92 Y98 T99 V236	A91-M95 WeakPolarHBondContact O-CG 3.44Å; A91-M95 PolarHBondContact O-N 3.16Å; L92-M95 PolarHBondContact O-N 3.33Å; L92-M95 VanDerWaalsContact O-N 3.1Å; M95-Y98 PolarHBondContact O-N 3.25Å; M95-T99 WeakPolarHBondContact O-CG2 3.49Å; M95-T99 PolarHBondContact O-N 2.96Å; M95-T99 PolarHBondContact O-OG1 2.69Å; M95-V236 HydrophobicContact CE-CG1 4.31Å; M95-V236 HydrophobicContact CE-CG2 4.18Å; M95-V236 HydrophobicContact SD-CG2 4.4Å
96	E	39.8	Very low	43.8	Very low	118 Å²	118	109.2 Å²	109.2	55%	0.551	54%	0.539	S	S	*	.	H	α-helix	trans	-58.1	-47.4	172	-71.1	172.7	157.4	0	0	110.9	L92 Y98 I100	L92-E96 WeakPolarHBondContact O-CG 3.32Å; L92-E96 PolarHBondContact O-N 2.85Å; E96-Y98 PolarHBondContact O-N 3.34Å; E96-I100 VanDerWaalsContact O-CD1 3.31Å; E96-I100 WeakPolarHBondContact O-CD1 3.37Å; E96-I100 WeakPolarHBondContact O-CG1 3.28Å
97	A	34.8	Very low	44	Very low	69 Å²	69	102.5 Å²	102.5	57%	0.57	51%	0.509	S	S	*	.	H	α-helix	trans	-63.2	-41.8	178.8	0	0	0	0	0	113.7	K93	K93-A97 WeakPolarHBondContact O-CB 3.24Å; K93-A97 PolarHBondContact O-N 3.44Å; K93-A97 VanDerWaalsContact O-N 3.16Å
98	Y	32.9	Very low	44.3	Very low	157 Å²	157	100.3 Å²	100.3	62%	0.616	51%	0.514	S	S	*	.	H	α-helix	trans	-76.7	-24.4	-175.9	-105.2	-88.7	0	0	0	114.8	K94 M95 E96	K94-Y98 HydrophobicContact CG-CD2 4.4Å; K94-Y98 PolarHBondContact O-N 2.98Å; K94-Y98 VanDerWaalsContact O-N 3.13Å; M95-Y98 PolarHBondContact O-N 3.25Å; E96-Y98 PolarHBondContact O-N 3.34Å
99	T	39.1	Very low	45.4	Very low	63 Å²	63	98.7 Å²	98.7	39%	0.387	52%	0.523	S	S	.	.	H	α-helix	trans	-92.9	-12	-171.7	50.4	0	0	0	0	114.9	M95 T352	M95-T99 WeakPolarHBondContact O-CG2 3.49Å; M95-T99 PolarHBondContact O-N 2.96Å; M95-T99 PolarHBondContact O-OG1 2.69Å; T99-T352 HydrophobicContact CG2-CG2 4.46Å
100	I	38.9	Very low	46.3	Very low	103 Å²	103	96.8 Å²	96.8	53%	0.528	52%	0.516	S	S	.	.	S	Bend	trans	-83.7	-27.1	-176.4	-67.9	171	0	0	0	112.6	E96 E102 A104	E96-I100 VanDerWaalsContact O-CD1 3.31Å; E96-I100 WeakPolarHBondContact O-CD1 3.37Å; E96-I100 WeakPolarHBondContact O-CG1 3.28Å; I100-E102 PolarHBondContact O-N 3.02Å; I100-A104 HydrophobicContact CG2-CB 4.21Å; I100-A104 WeakPolarHBondContact O-CB 3.46Å
101	S	34.9	Very low	47.4	Very low	108 Å²	108	90 Å²	90	76%	0.755	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	-13.3	-160	-162.8	0	0	0	0	117.7
102	E	40.7	Very low	48.9	Very low	175 Å²	175	93.1 Å²	93.1	82%	0.818	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	-11.2	-169.3	-66.3	-169.5	152.5	0	0	116	I100	I100-E102 PolarHBondContact O-N 3.02Å
103	N	42.5	Very low	50.4	Low	99 Å²	99	93 Å²	93	53%	0.529	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.9	5.3	-174.6	-74.2	-95.2	0	0	0	114.3	D105	N103-D105 VanDerWaalsContact C-N 3.35Å; N103-D105 PolarHBondContact O-N 2.87Å
104	A	40.3	Very low	52	Low	31 Å²	31	87.9 Å²	87.9	26%	0.256	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-34.3	-169.4	0	0	0	0	0	114.4	I100 K112	I100-A104 HydrophobicContact CG2-CB 4.21Å; I100-A104 WeakPolarHBondContact O-CB 3.46Å; A104-K112 WeakPolarHBondContact O-CE 3.29Å; A104-K112 PolarHBondContact O-NZ 3.48Å
105	D	48.3	Very low	53.4	Low	160 Å²	160	82.7 Å²	82.7	86%	0.856	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-16.3	-165.6	-61.1	-34.2	0	0	0	114.7	N103 F107	N103-D105 VanDerWaalsContact C-N 3.35Å; N103-D105 PolarHBondContact O-N 2.87Å; D105-F107 VanDerWaalsContact C-N 3.34Å; D105-F107 PolarHBondContact O-N 2.96Å
106	F	48.3	Very low	55.6	Low	61 Å²	61	84 Å²	84	27%	0.268	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-33.6	178.6	-167.4	-89.3	0	0	0	112.9	G108 K313 E487	F106-G108 PolarHBondContact O-N 2.84Å; F106-K313 HydrophobicContact CE1-CB 4.42Å; F106-K313 WeakPolarHBondContact CE1-O 3.36Å; F106-K313 HydrophobicContact CZ-CB 4.27Å; F106-E487 WeakPolarHBondContact CD2-OE1 3.34Å
107	F	59.8	Low	57.5	Low	11 Å²	11	82.4 Å²	82.4	5%	0.048	45%	0.445	C	S	.	.	S	Bend	trans	-87.7	100.7	-176.7	-106.1	-99.4	0	0	0	111.1	D105 E111 K112 I115 V314 W318 G353	D105-F107 VanDerWaalsContact C-N 3.34Å; D105-F107 PolarHBondContact O-N 2.96Å; F107-E111 HydrophobicContact CD1-CB 3.88Å; F107-E111 HydrophobicContact CD1-CG 4.02Å; F107-E111 HydrophobicContact CE1-CB 3.99Å; F107-E111 HydrophobicContact CE1-CG 3.57Å; F107-K112 HydrophobicContact CB-CD 4.39Å; F107-K112 HydrophobicContact CB-CG 3.94Å; F107-K112 HydrophobicContact CD1-CG 4.41Å; F107-K112 WeakPolarHBondContact O-CD 3.25Å; F107-K112 WeakPolarHBondContact O-CE 3.42Å; F107-K112 PolarHBondContact O-NZ 3.48Å; F107-I115 HydrophobicContact CD1-CD1 4.32Å; F107-I115 HydrophobicContact CE1-CD1 3.67Å; F107-I115 HydrophobicContact CZ-CD1 4.33Å; F107-V314 HydrophobicContact CE1-CG1 4.35Å; F107-V314 HydrophobicContact CZ-CG1 3.89Å; F107-V314 HydrophobicContact CZ-CG2 4.48Å; F107-W318 AromaticContact CZ-CE2 4Å; F107-W318 HydrophobicContact CZ-CZ2 4.07Å; F107-W318 AromaticContact CZ-NE1 3.59Å; F107-G353 WeakPolarHBondContact CE2-O 3.42Å; F107-G353 WeakPolarHBondContact CZ-O 3.47Å
108	G	58.5	Low	59.5	Low	48 Å²	48	79.3 Å²	79.3	50%	0.495	42%	0.419	S	S	.	.			trans	-55	146.1	172.9	0	0	0	0	0	112.5	F106 E110 E111 K112	F106-G108 PolarHBondContact O-N 2.84Å; G108-E110 PolarHBondContact O-N 2.7Å; G108-E110 VanDerWaalsContact O-N 3.09Å; G108-E111 PolarHBondContact O-N 3.21Å; G108-K112 PolarHBondContact O-N 2.6Å
109	A	67.2	Low	61.7	Low	71 Å²	71	74.2 Å²	74.2	59%	0.587	40%	0.401	S	S	*	.	H	α-helix	trans	-56.6	-31.9	-169.4	0	0	0	0	0	114.4	N113	A109-N113 WeakPolarHBondContact O-CB 3.48Å; A109-N113 VanDerWaalsContact O-CG 3.24Å; A109-N113 PolarHBondContact O-N 3.08Å; A109-N113 PolarHBondContact O-ND2 2.75Å
110	E	72.7	Confident	63.5	Low	124 Å²	124	74.8 Å²	74.8	58%	0.579	40%	0.402	S	S	*	.	H	α-helix	trans	-59.7	-48	174.9	-163.7	-160	157	0	0	112	G108 N113 R114	G108-E110 PolarHBondContact O-N 2.7Å; G108-E110 VanDerWaalsContact O-N 3.09Å; E110-N113 WeakPolarHBondContact O-CB 3.4Å; E110-N113 PolarHBondContact O-N 2.79Å; E110-R114 WeakPolarHBondContact O-CG 3.44Å; E110-R114 PolarHBondContact O-N 3.28Å; E110-R114 IonicContact OE1-CZ 3.95Å; E110-R114 IonicContact OE1-NE 2.77Å; E110-R114 PolarHBondContact OE1-NE 3.08Å; E110-R114 IonicContact OE1-NH2 2.66Å; E110-R114 PolarHBondContact OE1-NH2 3.03Å
111	E	73.2	Confident	65.2	Low	11 Å²	11	72 Å²	72	5%	0.051	39%	0.387	C	S	.	.	H	α-helix	trans	-73.3	-32.9	-175.8	-154.8	82.6	173.8	0	0	111.2	F107 G108 R114 I115 Y303 V314	F107-E111 HydrophobicContact CD1-CB 3.88Å; F107-E111 HydrophobicContact CD1-CG 4.02Å; F107-E111 HydrophobicContact CE1-CB 3.99Å; F107-E111 HydrophobicContact CE1-CG 3.57Å; G108-E111 PolarHBondContact O-N 3.21Å; E111-R114 WeakPolarHBondContact O-CB 2.97Å; E111-R114 PolarHBondContact O-N 2.91Å; E111-R114 IonicContact OE1-NH1 2.86Å; E111-R114 WeakPolarHBondContact OE2-CD 3.4Å; E111-R114 IonicContact OE2-CZ 3.68Å; E111-R114 IonicContact OE2-NE 2.76Å; E111-R114 PolarHBondContact OE2-NE 3.48Å; E111-R114 IonicContact OE2-NH1 3.71Å; E111-R114 PolarHBondContact OE2-NH1 3.04Å; E111-I115 WeakPolarHBondContact O-CG1 3.35Å; E111-I115 PolarHBondContact O-N 3.25Å; E111-Y303 PolarHBondContact OE1-OH 3.1Å; E111-Y303 PolarHBondContact OE2-OH 3.4Å; E111-V314 HydrophobicContact CB-CG2 4.46Å; E111-V314 HydrophobicContact CG-CG1 4.36Å; E111-V314 HydrophobicContact CG-CG2 3.79Å
112	K	74.3	Confident	66.7	Low	88 Å²	88	69.2 Å²	69.2	38%	0.383	36%	0.36	S	S	.	.	H	α-helix	trans	-59.1	-46.1	167.8	-69.2	179.9	173	158.7	0	111.4	A104 F107 G108 R114 I115 K116	A104-K112 WeakPolarHBondContact O-CE 3.29Å; A104-K112 PolarHBondContact O-NZ 3.48Å; F107-K112 HydrophobicContact CB-CD 4.39Å; F107-K112 HydrophobicContact CB-CG 3.94Å; F107-K112 HydrophobicContact CD1-CG 4.41Å; F107-K112 WeakPolarHBondContact O-CD 3.25Å; F107-K112 WeakPolarHBondContact O-CE 3.42Å; F107-K112 PolarHBondContact O-NZ 3.48Å; G108-K112 PolarHBondContact O-N 2.6Å; K112-R114 VanDerWaalsContact C-N 3.32Å; K112-R114 PolarHBondContact O-N 2.9Å; K112-I115 PolarHBondContact O-N 3.03Å; K112-K116 PolarHBondContact O-N 3.39Å
113	N	80.6	Confident	68.1	Low	93 Å²	93	62 Å²	62	50%	0.497	33%	0.334	S	S	.	.	H	α-helix	trans	-63.1	-37	176.2	-73.2	-28.4	0	0	0	112.2	A109 E110 K116 Q117	A109-N113 WeakPolarHBondContact O-CB 3.48Å; A109-N113 VanDerWaalsContact O-CG 3.24Å; A109-N113 PolarHBondContact O-N 3.08Å; A109-N113 PolarHBondContact O-ND2 2.75Å; E110-N113 WeakPolarHBondContact O-CB 3.4Å; E110-N113 PolarHBondContact O-N 2.79Å; N113-K116 PolarHBondContact O-N 2.82Å; N113-Q117 WeakPolarHBondContact O-CB 3.16Å; N113-Q117 VanDerWaalsContact O-CG 3.29Å; N113-Q117 WeakPolarHBondContact O-CG 3.42Å; N113-Q117 PolarHBondContact O-N 2.91Å
114	R	81.3	Confident	69.6	Low	50 Å²	50	63 Å²	63	19%	0.189	33%	0.333	C	S	.	.	H	α-helix	trans	-63.5	-42.8	174.3	-72.1	175.3	-175.7	-167.3	-5.8	112.5	E110 E111 K112 Q117 L118 Y303 F307 K309	E110-R114 WeakPolarHBondContact O-CG 3.44Å; E110-R114 PolarHBondContact O-N 3.28Å; E110-R114 IonicContact OE1-CZ 3.95Å; E110-R114 IonicContact OE1-NE 2.77Å; E110-R114 PolarHBondContact OE1-NE 3.08Å; E110-R114 IonicContact OE1-NH2 2.66Å; E110-R114 PolarHBondContact OE1-NH2 3.03Å; E111-R114 WeakPolarHBondContact O-CB 2.97Å; E111-R114 PolarHBondContact O-N 2.91Å; E111-R114 IonicContact OE1-NH1 2.86Å; E111-R114 WeakPolarHBondContact OE2-CD 3.4Å; E111-R114 IonicContact OE2-CZ 3.68Å; E111-R114 IonicContact OE2-NE 2.76Å; E111-R114 PolarHBondContact OE2-NE 3.48Å; E111-R114 IonicContact OE2-NH1 3.71Å; E111-R114 PolarHBondContact OE2-NH1 3.04Å; K112-R114 VanDerWaalsContact C-N 3.32Å; K112-R114 PolarHBondContact O-N 2.9Å; R114-Q117 PolarHBondContact O-N 2.96Å; R114-L118 PolarHBondContact O-N 2.91Å; R114-Y303 HydrophobicContact CB-CE2 4.42Å; R114-Y303 WeakPolarHBondContact CB-OH 3.24Å; R114-Y303 WeakPolarHBondContact CD-OH 3.47Å; R114-F307 HydrophobicContact CB-CD1 4.3Å; R114-F307 HydrophobicContact CB-CD2 4.25Å; R114-F307 HydrophobicContact CB-CE1 3.79Å; R114-F307 HydrophobicContact CB-CE2 3.69Å; R114-F307 HydrophobicContact CB-CZ 3.45Å; R114-F307 VanDerWaalsContact CB-CZ 3.45Å; R114-F307 HydrophobicContact CG-CD1 3.92Å; R114-F307 HydrophobicContact CG-CE1 3.6Å; R114-F307 HydrophobicContact CG-CE2 4.36Å; R114-F307 HydrophobicContact CG-CG 4.46Å; R114-F307 HydrophobicContact CG-CZ 3.85Å; R114-F307 WeakPolarHBondContact O-CE2 3.35Å; R114-F307 WeakPolarHBondContact O-CZ 3.33Å; R114-K309 PolarHBondContact NH1-O 2.97Å
115	I	77.5	Confident	71.1	Confident	1 Å²	1	67 Å²	67	1%	0.005	35%	0.345	C	S	.	.	H	α-helix	trans	-69.7	-41.8	176	-54.7	164.8	0	0	0	110.9	F107 E111 K112 Q117 L118 E119 Y303 W318 I348 G350	F107-I115 HydrophobicContact CD1-CD1 4.32Å; F107-I115 HydrophobicContact CE1-CD1 3.67Å; F107-I115 HydrophobicContact CZ-CD1 4.33Å; E111-I115 WeakPolarHBondContact O-CG1 3.35Å; E111-I115 PolarHBondContact O-N 3.25Å; K112-I115 PolarHBondContact O-N 3.03Å; I115-Q117 VanDerWaalsContact C-N 3.28Å; I115-Q117 PolarHBondContact O-N 3.29Å; I115-L118 WeakPolarHBondContact O-CA 3.37Å; I115-L118 VanDerWaalsContact O-CB 3.3Å; I115-L118 WeakPolarHBondContact O-CB 3.39Å; I115-L118 PolarHBondContact O-N 3.12Å; I115-E119 PolarHBondContact O-N 2.59Å; I115-E119 VanDerWaalsContact O-N 3.08Å; I115-Y303 HydrophobicContact CG1-CD2 4.38Å; I115-Y303 HydrophobicContact CG1-CE2 3.73Å; I115-W318 HydrophobicContact CD1-CZ2 4.41Å; I115-I348 HydrophobicContact CD1-CG2 4.02Å; I115-I348 HydrophobicContact CG1-CG2 4.33Å; I115-I348 HydrophobicContact CG2-CG2 3.89Å; I115-G350 VanDerWaalsContact CG2-CA 3.46Å
116	K	81.1	Confident	71.8	Confident	123 Å²	123	60.8 Å²	60.8	54%	0.535	31%	0.311	S	S	.	.	H	α-helix	trans	-57.5	-40	174.7	-174.1	173.8	-179.8	176.2	0	112.5	K112 N113 L118 E119 D120	K112-K116 PolarHBondContact O-N 3.39Å; N113-K116 PolarHBondContact O-N 2.82Å; K116-L118 VanDerWaalsContact C-N 3.27Å; K116-L118 PolarHBondContact O-N 2.7Å; K116-E119 WeakPolarHBondContact O-CB 3.38Å; K116-E119 PolarHBondContact O-N 2.81Å; K116-E119 VanDerWaalsContact O-N 3.11Å; K116-D120 PolarHBondContact O-N 3.26Å
117	Q	80.7	Confident	72.5	Confident	84 Å²	84	62.8 Å²	62.8	39%	0.393	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-31.2	173	-77.6	177.7	28.4	0	0	113.7	N113 R114 I115 D121 R306	N113-Q117 WeakPolarHBondContact O-CB 3.16Å; N113-Q117 VanDerWaalsContact O-CG 3.29Å; N113-Q117 WeakPolarHBondContact O-CG 3.42Å; N113-Q117 PolarHBondContact O-N 2.91Å; R114-Q117 PolarHBondContact O-N 2.96Å; I115-Q117 VanDerWaalsContact C-N 3.28Å; I115-Q117 PolarHBondContact O-N 3.29Å; Q117-D121 WeakPolarHBondContact O-CB 3.19Å; Q117-D121 PolarHBondContact O-N 2.7Å; Q117-D121 VanDerWaalsContact O-N 3.17Å; Q117-R306 PolarHBondContact O-NH1 3.01Å
118	L	77.7	Confident	72.8	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-68.9	-43.2	171.4	-79.7	163.9	0	0	0	111.3	R114 I115 K116 D121 W122 L302 Y303 R306 F307	R114-L118 PolarHBondContact O-N 2.91Å; I115-L118 WeakPolarHBondContact O-CA 3.37Å; I115-L118 VanDerWaalsContact O-CB 3.3Å; I115-L118 WeakPolarHBondContact O-CB 3.39Å; I115-L118 PolarHBondContact O-N 3.12Å; K116-L118 VanDerWaalsContact C-N 3.27Å; K116-L118 PolarHBondContact O-N 2.7Å; L118-D121 PolarHBondContact O-N 3.43Å; L118-W122 WeakPolarHBondContact O-CB 3.42Å; L118-W122 PolarHBondContact O-N 2.91Å; L118-L302 HydrophobicContact CD2-CD2 4.25Å; L118-L302 HydrophobicContact CD2-CG 3.99Å; L118-Y303 HydrophobicContact CD1-CD2 3.26Å; L118-Y303 HydrophobicContact CD1-CE2 3.9Å; L118-Y303 HydrophobicContact CD1-CG 4.08Å; L118-R306 HydrophobicContact CD2-CB 4.3Å; L118-R306 VanDerWaalsContact CD2-CD 3.44Å; L118-F307 HydrophobicContact CD1-CD2 4.5Å; L118-F307 HydrophobicContact CD1-CE2 3.82Å; L118-F307 HydrophobicContact CG-CE2 4.01Å
119	E	77.6	Confident	72.9	Confident	50 Å²	50	69.1 Å²	69.1	23%	0.234	34%	0.338	C	S	.	.	H	α-helix	trans	-62.6	-47.1	177	-65.1	-176.7	134.9	0	0	111.6	I115 K116 D121 W122 G123 S297 G350	I115-E119 PolarHBondContact O-N 2.59Å; I115-E119 VanDerWaalsContact O-N 3.08Å; K116-E119 WeakPolarHBondContact O-CB 3.38Å; K116-E119 PolarHBondContact O-N 2.81Å; K116-E119 VanDerWaalsContact O-N 3.11Å; E119-D121 VanDerWaalsContact C-N 3.34Å; E119-D121 PolarHBondContact O-N 3.26Å; E119-W122 PolarHBondContact O-N 3.38Å; E119-G123 PolarHBondContact O-N 2.93Å; E119-S297 WeakPolarHBondContact OE1-CB 3.5Å; E119-S297 PolarHBondContact OE1-OG 3.48Å; E119-G350 WeakPolarHBondContact OE1-CA 3.49Å
120	D	77.1	Confident	72.4	Confident	76 Å²	76	69.5 Å²	69.5	41%	0.406	32%	0.324	S	S	.	.	H	α-helix	trans	-56.5	-46.7	175.4	-71.7	-29.3	0	0	0	111.4	K116 K124	K116-D120 PolarHBondContact O-N 3.26Å; D120-K124 WeakPolarHBondContact O-CB 3.31Å; D120-K124 WeakPolarHBondContact O-CD 3.26Å; D120-K124 VanDerWaalsContact O-CE 3.26Å; D120-K124 WeakPolarHBondContact O-CE 3.38Å; D120-K124 WeakPolarHBondContact O-CG 3.47Å; D120-K124 PolarHBondContact O-N 3.02Å
121	D	75	Confident	72.1	Confident	43 Å²	43	72.3 Å²	72.3	23%	0.23	33%	0.329	C	S	.	.	H	α-helix	trans	-79.9	-21.7	-178.6	-69.7	-24.8	0	0	0	113.6	Q117 L118 E119 K124 K125 R306	Q117-D121 WeakPolarHBondContact O-CB 3.19Å; Q117-D121 PolarHBondContact O-N 2.7Å; Q117-D121 VanDerWaalsContact O-N 3.17Å; L118-D121 PolarHBondContact O-N 3.43Å; E119-D121 VanDerWaalsContact C-N 3.34Å; E119-D121 PolarHBondContact O-N 3.26Å; D121-K124 WeakPolarHBondContact OD1-CD 3.07Å; D121-K124 IonicContact OD1-NZ 2.75Å; D121-K124 PolarHBondContact OD1-NZ 2.79Å; D121-K125 WeakPolarHBondContact O-CB 3.4Å; D121-K125 VanDerWaalsContact O-CD 3.27Å; D121-K125 WeakPolarHBondContact O-CD 3.23Å; D121-K125 WeakPolarHBondContact O-CG 3.39Å; D121-K125 PolarHBondContact O-N 3.39Å; D121-R306 IonicContact OD2-CZ 2.82Å; D121-R306 IonicContact OD2-NH1 3.28Å; D121-R306 PolarHBondContact OD2-NH1 3.31Å; D121-R306 IonicContact OD2-NH2 3.76Å; D121-R306 PolarHBondContact OD2-NH2 3.16Å
122	W	67.1	Low	71.8	Confident	50 Å²	50	78 Å²	78	19%	0.189	35%	0.35	C	S	.	.	H	α-helix	trans	-74.3	-44.3	170.1	-167	86	0	0	0	110.2	L118 E119 K124 K125 L126 I218 L294 T296	L118-W122 WeakPolarHBondContact O-CB 3.42Å; L118-W122 PolarHBondContact O-N 2.91Å; E119-W122 PolarHBondContact O-N 3.38Å; W122-K124 PolarHBondContact O-N 3.48Å; W122-K125 CarbonylContact O-C 3.51Å; W122-K125 WeakPolarHBondContact O-CB 3.45Å; W122-K125 PolarHBondContact O-N 3.2Å; W122-K125 VanDerWaalsContact O-N 3.12Å; W122-L126 HydrophobicContact CZ3-CD2 4.2Å; W122-L126 WeakPolarHBondContact O-CB 3.44Å; W122-L126 PolarHBondContact O-N 3.24Å; W122-I218 HydrophobicContact CH2-CG2 3.95Å; W122-I218 HydrophobicContact CZ2-CG2 3.54Å; W122-L294 HydrophobicContact CH2-CD1 4.41Å; W122-T296 HydrophobicContact CZ3-CG2 4.27Å
123	G	69.6	Low	70.9	Confident	25 Å²	25	76.1 Å²	76.1	26%	0.258	34%	0.344	S	S	.	.	H	α-helix	trans	-57.2	-45.4	169.6	0	0	0	0	0	112.5	E119 K125 L126 L127	E119-G123 PolarHBondContact O-N 2.93Å; G123-K125 PolarHBondContact O-N 3.39Å; G123-L126 PolarHBondContact O-N 2.72Å; G123-L127 WeakPolarHBondContact O-CB 3.44Å; G123-L127 WeakPolarHBondContact O-CG 3.3Å; G123-L127 PolarHBondContact O-N 2.72Å
124	K	74.2	Confident	69.9	Low	118 Å²	118	76.4 Å²	76.4	51%	0.513	35%	0.345	S	S	.	.	H	α-helix	trans	-60.6	-41	172.5	-70.6	163.7	-142.6	161.1	0	112.5	D120 D121 W122 H128	D120-K124 WeakPolarHBondContact O-CB 3.31Å; D120-K124 WeakPolarHBondContact O-CD 3.26Å; D120-K124 VanDerWaalsContact O-CE 3.26Å; D120-K124 WeakPolarHBondContact O-CE 3.38Å; D120-K124 WeakPolarHBondContact O-CG 3.47Å; D120-K124 PolarHBondContact O-N 3.02Å; D121-K124 WeakPolarHBondContact OD1-CD 3.07Å; D121-K124 IonicContact OD1-NZ 2.75Å; D121-K124 PolarHBondContact OD1-NZ 2.79Å; W122-K124 PolarHBondContact O-N 3.48Å; K124-H128 VanDerWaalsContact O-CB 3.23Å; K124-H128 WeakPolarHBondContact O-CB 3.31Å; K124-H128 PolarHBondContact O-N 2.79Å
125	K	70.8	Confident	69	Low	116 Å²	116	82.6 Å²	82.6	50%	0.504	37%	0.368	S	S	.	.	H	α-helix	trans	-66.1	-41	175.5	-75.5	161.7	-168.3	162.6	0	111.9	D121 W122 G123 H128 R129	D121-K125 WeakPolarHBondContact O-CB 3.4Å; D121-K125 VanDerWaalsContact O-CD 3.27Å; D121-K125 WeakPolarHBondContact O-CD 3.23Å; D121-K125 WeakPolarHBondContact O-CG 3.39Å; D121-K125 PolarHBondContact O-N 3.39Å; W122-K125 CarbonylContact O-C 3.51Å; W122-K125 WeakPolarHBondContact O-CB 3.45Å; W122-K125 PolarHBondContact O-N 3.2Å; W122-K125 VanDerWaalsContact O-N 3.12Å; G123-K125 PolarHBondContact O-N 3.39Å; K125-H128 PolarHBondContact O-N 3.02Å; K125-R129 WeakPolarHBondContact O-CB 3.4Å; K125-R129 PolarHBondContact O-N 3.48Å
126	L	63.4	Low	67.8	Low	29 Å²	29	85.6 Å²	85.6	15%	0.152	39%	0.389	C	S	.	.	H	α-helix	trans	-63.7	-50	177.2	-166.1	69.4	0	0	0	110.4	W122 G123 H128 R129 R130 E216	W122-L126 HydrophobicContact CZ3-CD2 4.2Å; W122-L126 WeakPolarHBondContact O-CB 3.44Å; W122-L126 PolarHBondContact O-N 3.24Å; G123-L126 PolarHBondContact O-N 2.72Å; L126-H128 VanDerWaalsContact C-N 3.33Å; L126-H128 PolarHBondContact O-N 3.21Å; L126-R129 CarbonylContact O-C 3.21Å; L126-R129 WeakPolarHBondContact O-CA 3.42Å; L126-R129 WeakPolarHBondContact O-CB 2.99Å; L126-R129 PolarHBondContact O-N 3.27Å; L126-R130 PolarHBondContact O-N 3.3Å; L126-E216 HydrophobicContact CD1-CG 3.93Å; L126-E216 HydrophobicContact CG-CG 4.17Å
127	L	62.7	Low	66.2	Low	103 Å²	103	85.8 Å²	85.8	54%	0.539	39%	0.387	S	S	.	.	H	α-helix	trans	-58.6	-40.1	172.8	-73.5	168.5	0	0	0	112.7	G123 R129 R130 R131	G123-L127 WeakPolarHBondContact O-CB 3.44Å; G123-L127 WeakPolarHBondContact O-CG 3.3Å; G123-L127 PolarHBondContact O-N 2.72Å; L127-R129 VanDerWaalsContact C-N 3.33Å; L127-R130 PolarHBondContact O-N 3.22Å; L127-R131 WeakPolarHBondContact O-CB 3.44Å; L127-R131 WeakPolarHBondContact O-CG 3.49Å; L127-R131 PolarHBondContact O-N 2.82Å
128	H	66	Low	64.8	Low	111 Å²	111	89.1 Å²	89.1	51%	0.514	40%	0.402	S	S	.	.	H	α-helix	trans	-69.1	-31.3	175.1	-174.6	79	0	0	0	112.3	K124 K125 L126 R132	K124-H128 VanDerWaalsContact O-CB 3.23Å; K124-H128 WeakPolarHBondContact O-CB 3.31Å; K124-H128 PolarHBondContact O-N 2.79Å; K125-H128 PolarHBondContact O-N 3.02Å; L126-H128 VanDerWaalsContact C-N 3.33Å; L126-H128 PolarHBondContact O-N 3.21Å; H128-R132 PolarHBondContact NE2-NH2 2.87Å; H128-R132 PolarHBondContact O-N 2.97Å; H128-R132 VanDerWaalsContact O-N 3.08Å
129	R	61.5	Low	63.5	Low	82 Å²	82	94.7 Å²	94.7	31%	0.309	44%	0.437	S	S	.	.	H	α-helix	trans	-70.4	-46.1	172.6	-157.6	174.4	-154.4	-147.7	-3.2	111.1	K125 L126 L127 R131 R132 N133 E217 I218	K125-R129 WeakPolarHBondContact O-CB 3.4Å; K125-R129 PolarHBondContact O-N 3.48Å; L126-R129 CarbonylContact O-C 3.21Å; L126-R129 WeakPolarHBondContact O-CA 3.42Å; L126-R129 WeakPolarHBondContact O-CB 2.99Å; L126-R129 PolarHBondContact O-N 3.27Å; L127-R129 VanDerWaalsContact C-N 3.33Å; R129-R131 PolarHBondContact O-N 2.87Å; R129-R132 CarbonylContact O-C 3.54Å; R129-R132 WeakPolarHBondContact O-CA 3.34Å; R129-R132 WeakPolarHBondContact O-CB 3.44Å; R129-R132 PolarHBondContact O-N 2.96Å; R129-N133 PolarHBondContact O-N 2.91Å; R129-N133 PolarHBondContact O-OD1 2.85Å; R129-E217 WeakPolarHBondContact CD-O 3.43Å; R129-E217 IonicContact CZ-OE1 3.74Å; R129-E217 PolarHBondContact NH1-O 2.85Å; R129-E217 IonicContact NH1-OE1 2.75Å; R129-E217 PolarHBondContact NH1-OE1 3.34Å; R129-E217 IonicContact NH2-OE1 2.66Å; R129-E217 PolarHBondContact NH2-OE1 3.45Å; R129-I218 PolarHBondContact NH1-O 3.18Å
130	R	57.4	Low	61.6	Low	78 Å²	78	95.7 Å²	95.7	29%	0.294	45%	0.449	S	S	.	.	H	α-helix	trans	-55.9	-48.7	171.7	-169.3	-173.6	-171.6	126.8	-9.8	111.7	L126 L127 R132 N133 L134 E200 E216	L126-R130 PolarHBondContact O-N 3.3Å; L127-R130 PolarHBondContact O-N 3.22Å; R130-R132 PolarHBondContact O-N 2.95Å; R130-N133 PolarHBondContact O-N 3.24Å; R130-L134 WeakPolarHBondContact O-CB 3.31Å; R130-L134 PolarHBondContact O-N 3.28Å; R130-E200 IonicContact CZ-OE1 3.1Å; R130-E200 IonicContact NH1-OE1 3.74Å; R130-E200 PolarHBondContact NH1-OE1 2.91Å; R130-E200 IonicContact NH2-OE1 2.66Å; R130-E200 PolarHBondContact NH2-OE1 3.17Å; R130-E216 WeakPolarHBondContact CD-OE1 3.33Å; R130-E216 IonicContact CZ-OE1 2.62Å; R130-E216 IonicContact NH1-OE1 3.49Å; R130-E216 PolarHBondContact NH1-OE1 2.86Å; R130-E216 IonicContact NH1-OE2 3.3Å
131	R	66.1	Low	59.4	Low	184 Å²	184	95.5 Å²	95.5	69%	0.694	47%	0.465	S	S	*	.	H	α-helix	trans	-61.3	-27.2	173.8	-76.5	178.9	174.1	-174.5	-1.1	113.5	L127 R129 R135	L127-R131 WeakPolarHBondContact O-CB 3.44Å; L127-R131 WeakPolarHBondContact O-CG 3.49Å; L127-R131 PolarHBondContact O-N 2.82Å; R129-R131 PolarHBondContact O-N 2.87Å; R131-R135 WeakPolarHBondContact O-CD 3.34Å; R131-R135 VanDerWaalsContact O-CG 3.24Å; R131-R135 WeakPolarHBondContact O-CG 3.44Å; R131-R135 PolarHBondContact O-N 3.39Å
132	R	65.3	Low	57.4	Low	130 Å²	130	100.3 Å²	100.3	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-77	-48.9	172.4	-175.2	-178.4	-73.1	102.3	0.9	111.1	H128 R129 R130 L134 R135 S136	H128-R132 PolarHBondContact NE2-NH2 2.87Å; H128-R132 PolarHBondContact O-N 2.97Å; H128-R132 VanDerWaalsContact O-N 3.08Å; R129-R132 CarbonylContact O-C 3.54Å; R129-R132 WeakPolarHBondContact O-CA 3.34Å; R129-R132 WeakPolarHBondContact O-CB 3.44Å; R129-R132 PolarHBondContact O-N 2.96Å; R130-R132 PolarHBondContact O-N 2.95Å; R132-L134 PolarHBondContact O-N 2.75Å; R132-R135 PolarHBondContact O-N 2.81Å; R132-S136 PolarHBondContact O-N 3.33Å; R132-S136 PolarHBondContact O-OG 2.82Å
133	N	55.6	Low	55.6	Low	49 Å²	49	107.2 Å²	107.2	26%	0.262	52%	0.522	S	S	.	.	H	α-helix	trans	-61.4	-42.6	179.6	-67.6	13.6	0	0	0	111.7	R129 R130 R135 S136 R137	R129-N133 PolarHBondContact O-N 2.91Å; R129-N133 PolarHBondContact O-OD1 2.85Å; R130-N133 PolarHBondContact O-N 3.24Å; N133-R135 VanDerWaalsContact C-N 3.33Å; N133-R135 PolarHBondContact O-N 2.99Å; N133-S136 WeakPolarHBondContact O-CB 3.37Å; N133-S136 PolarHBondContact O-N 2.81Å; N133-S136 VanDerWaalsContact O-N 3.15Å; N133-R137 PolarHBondContact O-N 2.85Å
134	L	61.2	Low	53.8	Low	98 Å²	98	114.8 Å²	114.8	51%	0.513	55%	0.551	S	S	.	*	H	α-helix	trans	-63.9	-38	177.2	-164.2	72.4	0	0	0	111.9	R130 R132 R137 Q138	R130-L134 WeakPolarHBondContact O-CB 3.31Å; R130-L134 PolarHBondContact O-N 3.28Å; R132-L134 PolarHBondContact O-N 2.75Å; L134-R137 PolarHBondContact O-N 3.42Å; L134-Q138 WeakPolarHBondContact O-CG 3.21Å; L134-Q138 PolarHBondContact O-N 2.83Å
135	R	60.9	Low	51.6	Low	180 Å²	180	117.3 Å²	117.3	68%	0.679	56%	0.564	S	S	*	*	H	α-helix	trans	-66.2	-41.1	171.6	-75.8	173.1	-177.7	-116.9	-2.7	111.8	R131 R132 N133 Q138 T139	R131-R135 WeakPolarHBondContact O-CD 3.34Å; R131-R135 VanDerWaalsContact O-CG 3.24Å; R131-R135 WeakPolarHBondContact O-CG 3.44Å; R131-R135 PolarHBondContact O-N 3.39Å; R132-R135 PolarHBondContact O-N 2.81Å; N133-R135 VanDerWaalsContact C-N 3.33Å; N133-R135 PolarHBondContact O-N 2.99Å; R135-Q138 PolarHBondContact O-N 3.32Å; R135-T139 PolarHBondContact O-N 2.82Å; R135-T139 PolarHBondContact O-OG1 2.93Å; R135-T139 VanDerWaalsContact O-OG1 3.14Å
136	S	52.2	Low	49.8	Very low	64 Å²	64	118.1 Å²	118.1	45%	0.448	58%	0.579	S	S	.	*	H	α-helix	trans	-59.1	-46	173.9	-70.3	0	0	0	0	111.7	R132 N133 Q138 T139 S140	R132-S136 PolarHBondContact O-N 3.33Å; R132-S136 PolarHBondContact O-OG 2.82Å; N133-S136 WeakPolarHBondContact O-CB 3.37Å; N133-S136 PolarHBondContact O-N 2.81Å; N133-S136 VanDerWaalsContact O-N 3.15Å; S136-Q138 PolarHBondContact O-N 2.73Å; S136-T139 WeakPolarHBondContact CA-OG1 3.29Å; S136-T139 CarbonylContact O-C 3.54Å; S136-T139 PolarHBondContact O-N 2.78Å; S136-T139 VanDerWaalsContact O-N 3.07Å; S136-T139 PolarHBondContact O-OG1 3.21Å; S136-S140 WeakPolarHBondContact O-CB 3.31Å; S136-S140 PolarHBondContact O-N 2.8Å; S136-S140 PolarHBondContact O-OG 3.21Å; S136-S140 VanDerWaalsContact O-OG 3.11Å
137	R	48.1	Very low	48.1	Very low	128 Å²	128	122.3 Å²	122.3	48%	0.483	61%	0.605	S	S	.	*	H	α-helix	trans	-55.3	-48.7	171.8	-83.9	-173.5	166.5	-146.1	-0.9	112.4	N133 L134 T139 S140 E215	N133-R137 PolarHBondContact O-N 2.85Å; L134-R137 PolarHBondContact O-N 3.42Å; R137-T139 PolarHBondContact O-N 2.74Å; R137-S140 CarbonylContact O-C 3.46Å; R137-S140 PolarHBondContact O-N 3.33Å; R137-S140 PolarHBondContact O-OG 3.42Å; R137-E215 IonicContact CZ-OE1 3.26Å; R137-E215 IonicContact CZ-OE2 3.9Å; R137-E215 IonicContact NE-OE1 2.74Å; R137-E215 PolarHBondContact NE-OE1 3.26Å; R137-E215 IonicContact NE-OE2 2.9Å; R137-E215 PolarHBondContact NE-OE2 2.89Å; R137-E215 IonicContact NH2-OE1 2.9Å; R137-E215 PolarHBondContact NH2-OE1 3.34Å; R137-E215 IonicContact NH2-OE2 2.78Å; R137-E215 PolarHBondContact NH2-OE2 3.41Å
138	Q	51.4	Low	46.5	Very low	153 Å²	153	122.1 Å²	122.1	72%	0.715	62%	0.618	S	S	*	*	H	α-helix	trans	-63	-20.9	177.7	-73.8	176.3	-15.8	0	0	113.5	L134 R135 S136	L134-Q138 WeakPolarHBondContact O-CG 3.21Å; L134-Q138 PolarHBondContact O-N 2.83Å; R135-Q138 PolarHBondContact O-N 3.32Å; S136-Q138 PolarHBondContact O-N 2.73Å
139	T	49.5	Very low	44.7	Very low	122 Å²	122	125.3 Å²	125.3	75%	0.748	63%	0.633	S	S	*	*	H	α-helix	trans	-96	-8.3	172.2	53.5	0	0	0	0	114.5	R135 S136 R137	R135-T139 PolarHBondContact O-N 2.82Å; R135-T139 PolarHBondContact O-OG1 2.93Å; R135-T139 VanDerWaalsContact O-OG1 3.14Å; S136-T139 WeakPolarHBondContact CA-OG1 3.29Å; S136-T139 CarbonylContact O-C 3.54Å; S136-T139 PolarHBondContact O-N 2.78Å; S136-T139 VanDerWaalsContact O-N 3.07Å; S136-T139 PolarHBondContact O-OG1 3.21Å; R137-T139 PolarHBondContact O-N 2.74Å
140	S	38.1	Very low	43.4	Very low	71 Å²	71	129.7 Å²	129.7	50%	0.497	66%	0.661	S	S	.	*			trans	-118.2	62.4	-178.7	69.6	0	0	0	0	111	S136 R137 D142	S136-S140 WeakPolarHBondContact O-CB 3.31Å; S136-S140 PolarHBondContact O-N 2.8Å; S136-S140 PolarHBondContact O-OG 3.21Å; S136-S140 VanDerWaalsContact O-OG 3.11Å; R137-S140 CarbonylContact O-C 3.46Å; R137-S140 PolarHBondContact O-N 3.33Å; R137-S140 PolarHBondContact O-OG 3.42Å; S140-D142 PolarHBondContact O-N 3.25Å
141	G	31.3	Very low	42.2	Very low	71 Å²	71	129.5 Å²	129.5	73%	0.732	68%	0.683	S	S	*	*			trans	-75.1	52.6	-178.2	0	0	0	0	0	114.6	K143	G141-K143 PolarHBondContact O-N 2.89Å
142	D	33	Very low	40.6	Very low	144 Å²	144	126.2 Å²	126.2	77%	0.77	69%	0.689	S	S	*	*			trans	-68.3	112.3	176.2	-87	-31.4	0	0	0	111.1	S140 Q144	S140-D142 PolarHBondContact O-N 3.25Å; D142-Q144 PolarHBondContact O-N 3.3Å
143	K	29.9	Very low	39	Very low	196 Å²	196	128 Å²	128	85%	0.852	71%	0.707	S	S	*	*			trans	-70.5	93.2	177.4	-65.9	-179.6	179.7	180	0	110.8	G141 H145	G141-K143 PolarHBondContact O-N 2.89Å; K143-H145 PolarHBondContact O-N 2.84Å
144	Q	31.7	Very low	37.9	Very low	183 Å²	183	131.3 Å²	131.3	86%	0.855	73%	0.731	S	S	*	*			trans	-75.3	90.5	168	-69.4	-165.2	-4	0	0	110.7	D142 V146	D142-Q144 PolarHBondContact O-N 3.3Å; Q144-V146 PolarHBondContact O-N 2.85Å
145	H	28	Very low	36.5	Very low	172 Å²	172	131.9 Å²	131.9	80%	0.796	74%	0.743	S	S	*	*			trans	-68	114.7	167.1	-126	-83.7	0	0	0	109.1	K143	K143-H145 PolarHBondContact O-N 2.84Å
146	V	32.2	Very low	35.2	Very low	133 Å²	133	129.5 Å²	129.5	81%	0.806	75%	0.751	S	S	*	*			trans	-86	132.7	163.1	-178.4	0	0	0	0	107.5	Q144	Q144-V146 PolarHBondContact O-N 2.85Å
147	V	27.1	Very low	34.2	Very low	117 Å²	117	130.4 Å²	130.4	71%	0.709	77%	0.77	S	S	*	*			trans	-91.3	134.8	-174	177.8	0	0	0	0	110.2	E149	V147-E149 HydrophobicContact CG1-CG 4.29Å
148	A	30.8	Very low	33.5	Very low	98 Å²	98	128.2 Å²	128.2	81%	0.81	79%	0.788	S	S	*	*			trans	-114.9	125.8	154.6	0	0	0	0	0	107.4
149	E	27.8	Very low	32.6	Very low	179 Å²	179	128.6 Å²	128.6	84%	0.836	79%	0.79	S	S	*	*			trans	-80.4	145.5	176.3	-64.9	174.8	97	0	0	110.9	V147	V147-E149 HydrophobicContact CG1-CG 4.29Å
150	I	34.4	Very low	31.6	Very low	174 Å²	174	133 Å²	133	89%	0.892	79%	0.793	S	S	*	*			trans	172.5	129.1	135.8	-89.7	152.9	0	0	0	109.5
151	G	31.4	Very low	31.1	Very low	74 Å²	74	134.4 Å²	134.4	76%	0.763	80%	0.798	S	S	*	*			trans	82.4	129.9	153.6	0	0	0	0	0	118.5
152	S	32.5	Very low	31.1	Very low	115 Å²	115	139.1 Å²	139.1	80%	0.804	80%	0.801	S	S	*	*			trans	-135	174.2	178.1	-65.6	0	0	0	0	111.7
153	L	31.3	Very low	31.1	Very low	167 Å²	167	140.4 Å²	140.4	87%	0.874	81%	0.808	S	S	*	*			trans	93.5	157.2	165.7	-52.7	163.9	0	0	0	115.9
154	P	33.9	Very low	31.2	Very low	118 Å²	118	139 Å²	139	77%	0.766	81%	0.809	S	S	*	*				-138.9	-179.4	-77.2	36.8	-16.3	0	0	0	116.3
155	S	30	Very low	30.9	Very low	111 Å²	111	135 Å²	135	78%	0.776	81%	0.807	S	S	*	*			trans	-61.8	-177.3	169.7	-34.8	0	0	0	0	113.9
156	P	35.7	Very low	31.1	Very low	129 Å²	129	133.3 Å²	133.3	84%	0.838	81%	0.809	S	S	*	*			cis	-146.7	-177.9	13.2	44.8	-25	0	0	0	118.7
157	G	30.3	Very low	30.9	Very low	83 Å²	83	132 Å²	132	86%	0.856	81%	0.805	S	S	*	*			trans	128.7	122	144.8	0	0	0	0	0	117.9
158	G	32.6	Very low	31	Very low	82 Å²	82	131.5 Å²	131.5	85%	0.845	80%	0.803	S	S	*	*			trans	153	113	172.3	0	0	0	0	0	112.1
159	Q	32.9	Very low	30.8	Very low	162 Å²	162	134.1 Å²	134.1	76%	0.757	80%	0.798	S	S	*	*			trans	-105.5	149.9	-166.6	-65	-178.6	-6.2	0	0	114.4
160	R	29.7	Very low	31	Very low	215 Å²	215	133 Å²	133	81%	0.811	79%	0.793	S	S	*	*			trans	68.2	143	141.3	-80.5	170.9	173.8	-179.2	-4.3	119.2
161	T	27.4	Very low	30.9	Very low	100 Å²	100	133 Å²	133	61%	0.613	79%	0.794	S	S	*	*			cis	-161	166.3	-16.4	-0.3	0	0	0	0	110.9
162	E	30.4	Very low	30.7	Very low	169 Å²	169	132 Å²	132	79%	0.79	78%	0.784	S	S	*	*			trans	66.4	84.7	151.3	-69.4	150.7	-114.5	0	0	118.7
163	D	32.2	Very low	30.7	Very low	172 Å²	172	133.1 Å²	133.1	92%	0.92	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-92	145.2	166.5	-77	-59.6	0	0	0	112.9
164	L	32.8	Very low	30.8	Very low	165 Å²	165	131.4 Å²	131.4	86%	0.864	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-95.1	149.3	-178.8	-71.1	95.2	0	0	0	113.6
165	A	26.4	Very low	30.9	Very low	100 Å²	100	130.5 Å²	130.5	83%	0.826	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-93	128.8	165	0	0	0	0	0	111.2
166	V	32.2	Very low	31.1	Very low	136 Å²	136	134.4 Å²	134.4	82%	0.824	78%	0.78	S	S	*	*			trans	-135.8	136.3	162.5	175.8	0	0	0	0	108.4
167	S	27.1	Very low	31.1	Very low	105 Å²	105	135.7 Å²	135.7	73%	0.734	78%	0.778	S	S	*	*			trans	-94.8	-161.2	-175.9	-56	0	0	0	0	111.9
168	T	28.6	Very low	31.5	Very low	108 Å²	108	137.4 Å²	137.4	66%	0.663	77%	0.766	S	S	*	*			trans	105	98.3	142.2	-47.7	0	0	0	0	117.2
169	E	28	Very low	31.9	Very low	152 Å²	152	141.6 Å²	141.6	71%	0.71	76%	0.764	S	S	*	*			trans	94.4	143.2	130.5	-80.4	175.8	-146.6	0	0	125.8
170	Q	31.4	Very low	32.3	Very low	157 Å²	157	142.5 Å²	142.5	73%	0.734	77%	0.768	S	S	*	*			trans	59.8	121.5	144.1	-69.8	-177.1	64.7	0	0	122
171	L	32.2	Very low	32.7	Very low	173 Å²	173	138 Å²	138	91%	0.906	76%	0.756	S	S	*	*				-162.2	172.8	105.3	-130.4	75.9	0	0	0	112.1
172	G	27.6	Very low	33.3	Very low	54 Å²	54	134.8 Å²	134.8	56%	0.557	74%	0.74	S	S	*	*			trans	-166.6	-176.6	175.9	0	0	0	0	0	113.9
173	T	32.5	Very low	33.7	Very low	138 Å²	138	134.5 Å²	134.5	85%	0.847	74%	0.739	S	S	*	*			trans	63.5	143.3	178.3	62.6	0	0	0	0	116.7
174	T	32.3	Very low	34.2	Very low	130 Å²	130	133.4 Å²	133.4	80%	0.798	73%	0.728	S	S	*	*			cis	-155.5	165.7	-2.9	7.6	0	0	0	0	110.3
175	P	36.8	Very low	34.5	Very low	99 Å²	99	131.7 Å²	131.7	64%	0.643	71%	0.71	S	S	*	*			trans	-108.5	160.4	-163.7	40.4	-35	0	0	0	116.6
176	K	33.8	Very low	35	Very low	194 Å²	194	131.8 Å²	131.8	84%	0.843	70%	0.697	S	S	*	*			trans	179.2	147.9	139.7	-100	167.3	-177.6	-174.8	0	109.3
177	I	36.6	Very low	35.3	Very low	156 Å²	156	128.2 Å²	128.2	80%	0.8	68%	0.681	S	S	*	*	S	Bend	trans	100.9	40.8	-168	-54.8	155.7	0	0	0	112.9
178	I	37.7	Very low	35.9	Very low	119 Å²	119	130.5 Å²	130.5	61%	0.61	68%	0.681	S	S	*	*			trans	-141.8	46.7	178.5	-37.5	177.8	0	0	0	111
179	E	41.4	Very low	36.2	Very low	169 Å²	169	132.9 Å²	132.9	79%	0.79	68%	0.684	S	S	*	*	S	Bend	trans	-128	-44	174.3	-70.3	176.7	138.7	0	0	110.9	A182	E179-A182 PolarHBondContact O-N 3.31Å
180	E	41.8	Very low	36.6	Very low	182 Å²	182	132.4 Å²	132.4	85%	0.85	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-22.1	174.9	-68.2	176.2	131.7	0	0	114.5
181	Q	37.9	Very low	36.7	Very low	120 Å²	120	132.2 Å²	132.2	56%	0.561	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	15.6	176.3	-68.3	-170.3	-18.9	0	0	113.3	R185	Q181-R185 VanDerWaalsContact O-CZ 3.26Å; Q181-R185 PolarHBondContact O-NE 2.75Å; Q181-R185 PolarHBondContact O-NH2 3.31Å
182	A	39.1	Very low	36.8	Very low	33 Å²	33	130 Å²	130	27%	0.273	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.7	-48.2	171.5	0	0	0	0	0	110.6	E179 E184 R185 D186	E179-A182 PolarHBondContact O-N 3.31Å; A182-E184 VanDerWaalsContact C-N 3.29Å; A182-E184 PolarHBondContact O-N 2.84Å; A182-R185 PolarHBondContact O-N 3.27Å; A182-D186 PolarHBondContact O-N 2.79Å
183	E	40	Very low	37.2	Very low	162 Å²	162	134 Å²	134	76%	0.757	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-26.9	-173.5	-58.3	-170.4	148.1	0	0	113.9
184	E	42.2	Very low	37.4	Very low	149 Å²	149	133.8 Å²	133.8	70%	0.696	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-26	170.6	-71.7	-171.1	138.7	0	0	113.7	A182	A182-E184 VanDerWaalsContact C-N 3.29Å; A182-E184 PolarHBondContact O-N 2.84Å
185	R	38.1	Very low	37.9	Very low	129 Å²	129	131.4 Å²	131.4	49%	0.487	67%	0.665	S	S	.	*	H	α-helix	trans	-84.7	-36.9	177.7	-89.9	-179.4	-71.7	-178.4	-6.8	112.8	Q181 A182 A187 E188 E189	Q181-R185 VanDerWaalsContact O-CZ 3.26Å; Q181-R185 PolarHBondContact O-NE 2.75Å; Q181-R185 PolarHBondContact O-NH2 3.31Å; A182-R185 PolarHBondContact O-N 3.27Å; R185-A187 PolarHBondContact O-N 3.45Å; R185-E188 PolarHBondContact O-N 3.11Å; R185-E188 VanDerWaalsContact O-N 3.08Å; R185-E189 PolarHBondContact O-N 2.81Å
186	D	36.8	Very low	38.1	Very low	102 Å²	102	135.5 Å²	135.5	55%	0.545	68%	0.675	S	S	.	*	H	α-helix	trans	-60.9	-22.1	169.6	-69.5	-16	0	0	0	111.3	A182 L190	A182-D186 PolarHBondContact O-N 2.79Å; D186-L190 WeakPolarHBondContact O-CB 3.09Å; D186-L190 VanDerWaalsContact O-CD1 3.3Å; D186-L190 WeakPolarHBondContact O-CD1 3.49Å; D186-L190 WeakPolarHBondContact O-CG 3.14Å
187	A	39.3	Very low	38.4	Very low	61 Å²	61	131.7 Å²	131.7	50%	0.504	66%	0.663	S	S	.	*	H	α-helix	trans	-80.4	-26.2	174.2	0	0	0	0	0	114.5	R185	R185-A187 PolarHBondContact O-N 3.45Å
188	E	39	Very low	39	Very low	154 Å²	154	129.9 Å²	129.9	72%	0.72	66%	0.655	S	S	*	*	H	α-helix	trans	-93.4	-38.2	177.1	-67.3	-166.8	145.5	0	0	112.3	R185 L190 H191	R185-E188 PolarHBondContact O-N 3.11Å; R185-E188 VanDerWaalsContact O-N 3.08Å; E188-L190 PolarHBondContact O-N 3.08Å; E188-H191 PolarHBondContact O-N 3.5Å
189	E	36.6	Very low	39.5	Very low	158 Å²	158	131.3 Å²	131.3	74%	0.738	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-69.2	-15.4	175	-69.5	-167.6	172.8	0	0	113.2	R185 H191	R185-E189 PolarHBondContact O-N 2.81Å; E189-H191 PolarHBondContact O-N 3.01Å
190	L	35.5	Very low	40.4	Very low	142 Å²	142	125.6 Å²	125.6	74%	0.743	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-74.8	1	172.2	-89.9	176.6	0	0	0	114.8	D186 E188	D186-L190 WeakPolarHBondContact O-CB 3.09Å; D186-L190 VanDerWaalsContact O-CD1 3.3Å; D186-L190 WeakPolarHBondContact O-CD1 3.49Å; D186-L190 WeakPolarHBondContact O-CG 3.14Å; E188-L190 PolarHBondContact O-N 3.08Å
191	H	33.7	Very low	42	Very low	153 Å²	153	123.4 Å²	123.4	71%	0.708	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-112.7	-10	-167.8	-130.1	-54.2	0	0	0	117.6	E188 E189	E188-H191 PolarHBondContact O-N 3.5Å; E189-H191 PolarHBondContact O-N 3.01Å
192	D	35	Very low	44.3	Very low	127 Å²	127	121 Å²	121	68%	0.679	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	-30.5	-178.9	-86.7	-39.9	0	0	0	115.1	D194 S195	D192-D194 VanDerWaalsContact C-N 3.28Å; D192-D194 PolarHBondContact O-N 3.34Å; D192-S195 WeakPolarHBondContact O-CA 3.24Å; D192-S195 WeakPolarHBondContact O-CB 3.49Å; D192-S195 PolarHBondContact O-N 2.89Å
193	D	35.2	Very low	46.7	Very low	136 Å²	136	123 Å²	123	73%	0.727	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-20.9	-172.1	-140.4	4.8	0	0	0	113.2	S195	D193-S195 VanDerWaalsContact C-N 3.29Å
194	D	37.4	Very low	49	Very low	135 Å²	135	117.4 Å²	117.4	72%	0.722	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-7.2	169.7	-106.2	-20.9	0	0	0	112.9	D192	D192-D194 VanDerWaalsContact C-N 3.28Å; D192-D194 PolarHBondContact O-N 3.34Å
195	S	41	Very low	51.4	Low	80 Å²	80	116.8 Å²	116.8	56%	0.559	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-32.8	-176.2	-157.1	0	0	0	0	113.5	D192 D193 L197	D192-S195 WeakPolarHBondContact O-CA 3.24Å; D192-S195 WeakPolarHBondContact O-CB 3.49Å; D192-S195 PolarHBondContact O-N 2.89Å; D193-S195 VanDerWaalsContact C-N 3.29Å; S195-L197 PolarHBondContact O-N 2.84Å
196	E	41	Very low	54	Low	185 Å²	185	110.8 Å²	110.8	86%	0.864	57%	0.57	S	S	*	*	S	Bend	trans	-67	-14.5	167.6	-76.6	-149.7	139.5	0	0	112.2	L198	E196-L198 PolarHBondContact O-N 3.18Å; E196-L198 VanDerWaalsContact O-N 3.13Å
197	L	41.7	Very low	56.5	Low	114 Å²	114	112 Å²	112	60%	0.597	58%	0.581	S	S	*	*	S	Bend	trans	-79.5	91.7	171.6	-91.4	164.5	0	0	0	112.1	S195	S195-L197 PolarHBondContact O-N 2.84Å
198	L	48	Very low	59	Low	117 Å²	117	114 Å²	114	61%	0.613	58%	0.583	S	S	*	*			trans	101.9	30	157.9	-50.1	167.2	0	0	0	118.9	E196 E200	E196-L198 PolarHBondContact O-N 3.18Å; E196-L198 VanDerWaalsContact O-N 3.13Å; L198-E200 PolarHBondContact O-N 2.96Å
199	E	48.2	Very low	61.4	Low	150 Å²	150	107.9 Å²	107.9	70%	0.701	56%	0.561	S	S	*	*			trans	-67.9	83.7	151.2	-72.3	-140.6	141.8	0	0	110.5	H201	E199-H201 PolarHBondContact O-N 3.04Å; E199-H201 PolarHBondContact O-ND1 2.9Å; E199-H201 IonicContact OE2-CE1 2.71Å; E199-H201 PolarHBondContact OE2-CE1 3.18Å
200	E	61.6	Low	64.2	Low	49 Å²	49	103.1 Å²	103.1	23%	0.229	54%	0.536	C	S	.	.			trans	-66.8	79.3	175.4	-67.4	-170.9	150.2	0	0	110.8	R130 L198 F214 R228	R130-E200 IonicContact CZ-OE1 3.1Å; R130-E200 IonicContact NH1-OE1 3.74Å; R130-E200 PolarHBondContact NH1-OE1 2.91Å; R130-E200 IonicContact NH2-OE1 2.66Å; R130-E200 PolarHBondContact NH2-OE1 3.17Å; L198-E200 PolarHBondContact O-N 2.96Å; E200-F214 HydrophobicContact CB-CD1 4.09Å; E200-F214 HydrophobicContact CB-CE1 4.08Å; E200-F214 WeakPolarHBondContact O-CE1 3.49Å; E200-R228 IonicContact OE1-NH1 2.73Å
201	H	75.3	Confident	67.1	Low	135 Å²	135	96.5 Å²	96.5	63%	0.625	50%	0.502	S	S	*	.			trans	-57.7	123.4	178	-80.4	62.4	0	0	0	111	E199 I203	E199-H201 PolarHBondContact O-N 3.04Å; E199-H201 PolarHBondContact O-ND1 2.9Å; E199-H201 IonicContact OE2-CE1 2.71Å; E199-H201 PolarHBondContact OE2-CE1 3.18Å; H201-I203 PolarHBondContact O-N 3.1Å
202	P	85.4	Confident	70	Confident	70 Å²	70	91 Å²	91	46%	0.455	48%	0.477	S	S	.	.			trans	-71.5	131.3	178.1	30.2	-34.7	0	0	0	110.5	L212 K213 F214	P202-L212 HydrophobicContact CB-CB 3.99Å; P202-L212 HydrophobicContact CB-CD1 4.32Å; P202-L212 HydrophobicContact CB-CD2 4.2Å; P202-L212 HydrophobicContact CB-CG 4.39Å; P202-L212 HydrophobicContact CG-CD1 4.37Å; P202-L212 HydrophobicContact CG-CD2 4.42Å; P202-K213 CarbonylContact C-O 3.59Å; P202-K213 VanDerWaalsContact CA-O 3.26Å; P202-K213 WeakPolarHBondContact CA-O 3.26Å; P202-F214 HydrophobicContact CB-CE1 4.34Å
203	I	89.7	Confident	72.8	Confident	76 Å²	76	85.3 Å²	85.3	39%	0.39	45%	0.446	S	S	.	.	S	Bend	trans	-91.5	-13	-177.7	58.5	157.3	0	0	0	113.5	H201 K213 E215	H201-I203 PolarHBondContact O-N 3.1Å; I203-K213 HydrophobicContact CD1-CD 3.79Å; I203-K213 HydrophobicContact CD1-CG 4.18Å; I203-K213 HydrophobicContact CG1-CB 4.24Å; I203-K213 HydrophobicContact CG1-CD 3.93Å; I203-K213 HydrophobicContact CG1-CG 4.01Å; I203-K213 WeakPolarHBondContact CG1-O 3.33Å; I203-K213 PolarHBondContact N-O 2.71Å; I203-E215 HydrophobicContact CD1-CB 4.12Å; I203-E215 HydrophobicContact CG2-CB 4.33Å
204	D	89.1	Confident	75.6	Confident	43 Å²	43	79.6 Å²	79.6	23%	0.23	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.4	165.9	179.1	-138.7	-39.4	0	0	0	109.4	K213 W240 R285	D204-K213 HydrophobicContact CB-CB 3.68Å; D204-K213 HydrophobicContact CB-CD 3.61Å; D204-K213 HydrophobicContact CB-CG 4.29Å; D204-K213 PolarHBondContact O-N 3.36Å; D204-W240 HydrophobicContact CB-CH2 4.01Å; D204-W240 HydrophobicContact CB-CZ2 3.9Å; D204-R285 IonicContact OD2-NH1 2.83Å
205	K	92	Very high	78	Confident	136 Å²	136	76.6 Å²	76.6	59%	0.591	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.7	154.6	178.4	62.9	177.5	-179.5	175.6	0	112.5	F211 L212	K205-F211 CarbonylContact C-O 3.17Å; K205-F211 VanDerWaalsContact CA-O 3.3Å; K205-F211 WeakPolarHBondContact CA-O 3.4Å; K205-L212 HydrophobicContact CB-CD2 3.95Å
206	S	92.5	Very high	80.2	Confident	3 Å²	3	73.7 Å²	73.7	2%	0.021	38%	0.375	C	S	.	.			trans	-65.5	165.6	173.3	57.9	0	0	0	0	112.2	D208 G209 R210 F211	S206-D208 VanDerWaalsContact C-N 3.28Å; S206-D208 VanDerWaalsContact CB-OD1 3.23Å; S206-D208 WeakPolarHBondContact CB-OD1 3.43Å; S206-D208 PolarHBondContact O-N 3.34Å; S206-D208 PolarHBondContact OG-OD1 3.12Å; S206-G209 WeakPolarHBondContact O-CA 3.5Å; S206-G209 PolarHBondContact O-N 3.39Å; S206-G209 PolarHBondContact OG-N 2.97Å; S206-R210 PolarHBondContact OG-N 3.27Å; S206-R210 VanDerWaalsContact OG-N 3.09Å; S206-F211 PolarHBondContact N-O 3.42Å; S206-F211 PolarHBondContact OG-N 3.07Å; S206-F211 PolarHBondContact OG-O 2.8Å
207	V	89.8	Confident	82.5	Confident	129 Å²	129	65.5 Å²	65.5	78%	0.782	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-35.8	-175.1	-176	0	0	0	0	112.3	W278	V207-W278 HydrophobicContact CG2-CB 4.16Å; V207-W278 HydrophobicContact CG2-CG 3.9Å
208	D	90.4	Very high	84.6	Confident	101 Å²	101	61.8 Å²	61.8	54%	0.54	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-9.7	173.8	63.7	-12.2	0	0	0	113.7	S206 R210	S206-D208 VanDerWaalsContact C-N 3.28Å; S206-D208 VanDerWaalsContact CB-OD1 3.23Å; S206-D208 WeakPolarHBondContact CB-OD1 3.43Å; S206-D208 PolarHBondContact O-N 3.34Å; S206-D208 PolarHBondContact OG-OD1 3.12Å; D208-R210 VanDerWaalsContact C-N 3.27Å; D208-R210 VanDerWaalsContact CG-CB 3.49Å; D208-R210 PolarHBondContact O-N 3.2Å; D208-R210 WeakPolarHBondContact OD1-CB 3.43Å; D208-R210 PolarHBondContact OD1-N 3.46Å; D208-R210 WeakPolarHBondContact OD2-CB 3.37Å
209	G	91	Very high	86.2	Confident	26 Å²	26	57.3 Å²	57.3	27%	0.268	30%	0.299	S	S	.	.	S	Bend	trans	77.6	-0.7	-174	0	0	0	0	0	115.5	S206	S206-G209 WeakPolarHBondContact O-CA 3.5Å; S206-G209 PolarHBondContact O-N 3.39Å; S206-G209 PolarHBondContact OG-N 2.97Å
210	R	95.2	Very high	87.8	Confident	58 Å²	58	58 Å²	58	22%	0.219	30%	0.295	C	S	.	.			trans	-60.5	-47.7	-178.4	175.5	-179.3	174.8	137.3	11.2	113	S206 D208 D231 T232 E233	S206-R210 PolarHBondContact OG-N 3.27Å; S206-R210 VanDerWaalsContact OG-N 3.09Å; D208-R210 VanDerWaalsContact C-N 3.27Å; D208-R210 VanDerWaalsContact CG-CB 3.49Å; D208-R210 PolarHBondContact O-N 3.2Å; D208-R210 WeakPolarHBondContact OD1-CB 3.43Å; D208-R210 PolarHBondContact OD1-N 3.46Å; D208-R210 WeakPolarHBondContact OD2-CB 3.37Å; R210-D231 VanDerWaalsContact CG-OD1 3.28Å; R210-D231 WeakPolarHBondContact CG-OD1 3.34Å; R210-D231 IonicContact CZ-OD1 3.34Å; R210-D231 IonicContact CZ-OD2 2.79Å; R210-D231 IonicContact NE-OD1 3.18Å; R210-D231 PolarHBondContact NE-OD1 2.99Å; R210-D231 IonicContact NE-OD2 2.67Å; R210-D231 IonicContact NH2-OD1 3.14Å; R210-D231 PolarHBondContact NH2-OD1 3.39Å; R210-D231 IonicContact NH2-OD2 3.93Å; R210-D231 PolarHBondContact NH2-OD2 2.9Å; R210-T232 WeakPolarHBondContact O-CB 3.21Å; R210-T232 WeakPolarHBondContact O-CG2 3.09Å; R210-T232 PolarHBondContact O-N 2.94Å; R210-T232 PolarHBondContact O-OG1 3.12Å; R210-E233 WeakPolarHBondContact CD-OE1 3.43Å; R210-E233 HydrophobicContact CG-CG 4.25Å; R210-E233 IonicContact CZ-OE1 3.85Å; R210-E233 IonicContact CZ-OE2 2.75Å; R210-E233 IonicContact NE-OE1 3.8Å; R210-E233 IonicContact NE-OE2 3.9Å; R210-E233 IonicContact NH1-OE1 3.37Å; R210-E233 PolarHBondContact NH1-OE1 3.5Å; R210-E233 IonicContact NH1-OE2 2.7Å; R210-E233 PolarHBondContact NH1-OE2 2.9Å; R210-E233 IonicContact NH2-OE2 3.84Å; R210-E233 PolarHBondContact NH2-OE2 3.25Å; R210-E233 VanDerWaalsContact NH2-OE2 3.1Å
211	F	95.8	Very high	88.3	Confident	3 Å²	3	57.8 Å²	57.8	1%	0.013	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.2	-177	-54.8	-72.8	0	0	0	110.5	K205 S206 L230 D231 V238 W240 Y275 D276 W278 V291	K205-F211 CarbonylContact C-O 3.17Å; K205-F211 VanDerWaalsContact CA-O 3.3Å; K205-F211 WeakPolarHBondContact CA-O 3.4Å; S206-F211 PolarHBondContact N-O 3.42Å; S206-F211 PolarHBondContact OG-N 3.07Å; S206-F211 PolarHBondContact OG-O 2.8Å; F211-L230 WeakPolarHBondContact CA-O 3.49Å; F211-D231 HydrophobicContact CD1-CB 3.89Å; F211-D231 HydrophobicContact CE1-CB 3.8Å; F211-V238 HydrophobicContact CD1-CG2 4.23Å; F211-W240 HydrophobicContact CB-CZ3 4.36Å; F211-Y275 HydrophobicContact CE1-CG 4.45Å; F211-Y275 HydrophobicContact CZ-CG 4.41Å; F211-D276 HydrophobicContact CE2-CB 3.96Å; F211-W278 HydrophobicContact CB-CH2 4.42Å; F211-W278 HydrophobicContact CD2-CH2 4.35Å; F211-W278 HydrophobicContact CD2-CZ3 4.12Å; F211-V291 HydrophobicContact CB-CG2 4.4Å; F211-V291 HydrophobicContact CD1-CG1 3.75Å; F211-V291 HydrophobicContact CD2-CG1 4.49Å; F211-V291 HydrophobicContact CD2-CG2 4.17Å; F211-V291 HydrophobicContact CE1-CG1 3.89Å; F211-V291 HydrophobicContact CG-CG1 4.07Å; F211-V291 HydrophobicContact CG-CG2 4.17Å; F211-V291 HydrophobicContact CZ-CG1 4.32Å
212	L	94.6	Very high	87.8	Confident	38 Å²	38	55.5 Å²	55.5	20%	0.199	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	143.2	173.9	-60.1	179.1	0	0	0	110.3	P202 K205 G229 L230 T232	P202-L212 HydrophobicContact CB-CB 3.99Å; P202-L212 HydrophobicContact CB-CD1 4.32Å; P202-L212 HydrophobicContact CB-CD2 4.2Å; P202-L212 HydrophobicContact CB-CG 4.39Å; P202-L212 HydrophobicContact CG-CD1 4.37Å; P202-L212 HydrophobicContact CG-CD2 4.42Å; K205-L212 HydrophobicContact CB-CD2 3.95Å; L212-G229 CarbonylContact O-C 3.59Å; L212-G229 WeakPolarHBondContact O-CA 3.41Å; L212-L230 PolarHBondContact N-O 3.34Å; L212-L230 PolarHBondContact O-N 3.46Å; L212-T232 HydrophobicContact CD1-CG2 3.65Å; L212-T232 HydrophobicContact CG-CG2 3.71Å
213	K	94.7	Very high	86.9	Confident	7 Å²	7	55.5 Å²	55.5	3%	0.03	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.7	174	-170.4	-167.3	-176.8	-178.4	0	111	P202 I203 D204 Y227 W240 E242	P202-K213 CarbonylContact C-O 3.59Å; P202-K213 VanDerWaalsContact CA-O 3.26Å; P202-K213 WeakPolarHBondContact CA-O 3.26Å; I203-K213 HydrophobicContact CD1-CD 3.79Å; I203-K213 HydrophobicContact CD1-CG 4.18Å; I203-K213 HydrophobicContact CG1-CB 4.24Å; I203-K213 HydrophobicContact CG1-CD 3.93Å; I203-K213 HydrophobicContact CG1-CG 4.01Å; I203-K213 WeakPolarHBondContact CG1-O 3.33Å; I203-K213 PolarHBondContact N-O 2.71Å; D204-K213 HydrophobicContact CB-CB 3.68Å; D204-K213 HydrophobicContact CB-CD 3.61Å; D204-K213 HydrophobicContact CB-CG 4.29Å; D204-K213 PolarHBondContact O-N 3.36Å; K213-Y227 VanDerWaalsContact CE-CD2 3.4Å; K213-Y227 VanDerWaalsContact CE-CG 3.46Å; K213-W240 HydrophobicContact CB-CD2 3.72Å; K213-W240 HydrophobicContact CB-CE3 3.73Å; K213-W240 HydrophobicContact CB-CG 4.33Å; K213-W240 HydrophobicContact CB-CH2 3.84Å; K213-W240 HydrophobicContact CB-CZ2 3.88Å; K213-W240 HydrophobicContact CB-CZ3 3.8Å; K213-W240 HydrophobicContact CD-CD2 4.16Å; K213-W240 HydrophobicContact CD-CG 4.34Å; K213-W240 HydrophobicContact CD-CZ2 3.89Å; K213-W240 HydrophobicContact CG-CD2 3.77Å; K213-W240 HydrophobicContact CG-CE3 4.3Å; K213-W240 HydrophobicContact CG-CG 3.89Å; K213-W240 HydrophobicContact CG-CZ2 4.22Å; K213-E242 WeakPolarHBondContact CE-OE1 3.37Å; K213-E242 IonicContact NZ-OE1 3.52Å; K213-E242 PolarHBondContact NZ-OE1 3.03Å; K213-E242 IonicContact NZ-OE2 2.76Å; K213-E242 PolarHBondContact NZ-OE2 2.9Å
214	F	92.4	Very high	86.5	Confident	17 Å²	17	53.6 Å²	53.6	8%	0.075	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	161.3	167.2	-49.8	-68.2	0	0	0	111.2	E200 P202 E216 R228 L230 Y237	E200-F214 HydrophobicContact CB-CD1 4.09Å; E200-F214 HydrophobicContact CB-CE1 4.08Å; E200-F214 WeakPolarHBondContact O-CE1 3.49Å; P202-F214 HydrophobicContact CB-CE1 4.34Å; F214-E216 PolarHBondContact O-N 2.88Å; F214-R228 HydrophobicContact CD2-CB 4.49Å; F214-R228 HydrophobicContact CD2-CG 4.31Å; F214-R228 WeakPolarHBondContact CD2-O 3.49Å; F214-R228 PolarHBondContact N-O 2.95Å; F214-L230 HydrophobicContact CE2-CB 3.75Å; F214-L230 HydrophobicContact CZ-CB 3.85Å; F214-Y237 HydrophobicContact CE2-CD1 4.23Å; F214-Y237 AromaticContact CE2-CE1 3.96Å; F214-Y237 HydrophobicContact CE2-CE1 3.96Å
215	E	88.4	Confident	86.4	Confident	72 Å²	72	52 Å²	52	34%	0.336	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	-12.1	178.4	-166.9	-179.1	-119	0	0	113.5	R137 I203 E217	R137-E215 IonicContact CZ-OE1 3.26Å; R137-E215 IonicContact CZ-OE2 3.9Å; R137-E215 IonicContact NE-OE1 2.74Å; R137-E215 PolarHBondContact NE-OE1 3.26Å; R137-E215 IonicContact NE-OE2 2.9Å; R137-E215 PolarHBondContact NE-OE2 2.89Å; R137-E215 IonicContact NH2-OE1 2.9Å; R137-E215 PolarHBondContact NH2-OE1 3.34Å; R137-E215 IonicContact NH2-OE2 2.78Å; R137-E215 PolarHBondContact NH2-OE2 3.41Å; I203-E215 HydrophobicContact CD1-CB 4.12Å; I203-E215 HydrophobicContact CG2-CB 4.33Å; E215-E217 PolarHBondContact O-N 2.94Å
216	E	87	Confident	86.3	Confident	19 Å²	19	46.5 Å²	46.5	9%	0.089	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	88.8	-175.3	-168.6	161.7	-106.7	0	0	111.7	L126 R130 F214 I218 R228	L126-E216 HydrophobicContact CD1-CG 3.93Å; L126-E216 HydrophobicContact CG-CG 4.17Å; R130-E216 WeakPolarHBondContact CD-OE1 3.33Å; R130-E216 IonicContact CZ-OE1 2.62Å; R130-E216 IonicContact NH1-OE1 3.49Å; R130-E216 PolarHBondContact NH1-OE1 2.86Å; R130-E216 IonicContact NH1-OE2 3.3Å; F214-E216 PolarHBondContact O-N 2.88Å; E216-I218 PolarHBondContact O-N 2.77Å; E216-R228 HydrophobicContact CB-CB 4.14Å; E216-R228 PolarHBondContact O-N 2.77Å; E216-R228 WeakPolarHBondContact OE2-CD 3.47Å; E216-R228 IonicContact OE2-CZ 3.71Å; E216-R228 IonicContact OE2-NE 3.6Å; E216-R228 IonicContact OE2-NH1 3.27Å; E216-R228 PolarHBondContact OE2-NH1 3.29Å
217	E	89.4	Confident	86.3	Confident	13 Å²	13	48.1 Å²	48.1	6%	0.061	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	113.7	174.3	-165.2	-159.6	106.4	0	0	109.6	R129 E215 R220 T225 V226 Y227	R129-E217 WeakPolarHBondContact CD-O 3.43Å; R129-E217 IonicContact CZ-OE1 3.74Å; R129-E217 PolarHBondContact NH1-O 2.85Å; R129-E217 IonicContact NH1-OE1 2.75Å; R129-E217 PolarHBondContact NH1-OE1 3.34Å; R129-E217 IonicContact NH2-OE1 2.66Å; R129-E217 PolarHBondContact NH2-OE1 3.45Å; E215-E217 PolarHBondContact O-N 2.94Å; E217-R220 WeakPolarHBondContact OE1-CB 3.48Å; E217-R220 IonicContact OE1-NE 3.25Å; E217-R220 IonicContact OE2-CZ 2.6Å; E217-R220 VanDerWaalsContact OE2-CZ 3.25Å; E217-R220 IonicContact OE2-NE 3.88Å; E217-R220 PolarHBondContact OE2-NE 3.13Å; E217-R220 IonicContact OE2-NH2 3.87Å; E217-R220 PolarHBondContact OE2-NH2 3.29Å; E217-T225 HydrophobicContact CG-CG2 3.67Å; E217-T225 WeakPolarHBondContact OE2-CG2 3.41Å; E217-V226 CarbonylContact C-O 3.51Å; E217-V226 WeakPolarHBondContact CA-O 3.38Å; E217-V226 WeakPolarHBondContact CG-O 3.46Å; E217-Y227 HydrophobicContact CB-CD1 4.2Å; E217-Y227 HydrophobicContact CB-CE1 4.07Å; E217-Y227 HydrophobicContact CG-CE1 4.36Å
218	I	85.8	Confident	86.5	Confident	36 Å²	36	44 Å²	44	19%	0.185	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	-40.4	175.1	-61.7	159	0	0	0	110.1	W122 R129 E216 V226 R228 L294	W122-I218 HydrophobicContact CH2-CG2 3.95Å; W122-I218 HydrophobicContact CZ2-CG2 3.54Å; R129-I218 PolarHBondContact NH1-O 3.18Å; E216-I218 PolarHBondContact O-N 2.77Å; I218-V226 HydrophobicContact CB-CG1 4.29Å; I218-V226 HydrophobicContact CD1-CG1 4.21Å; I218-V226 PolarHBondContact N-O 2.91Å; I218-R228 HydrophobicContact CD1-CB 3.98Å; I218-R228 HydrophobicContact CG1-CB 4.25Å; I218-L294 HydrophobicContact CD1-CD1 3.39Å; I218-L294 HydrophobicContact CG1-CD1 4.45Å
219	G	81.8	Confident	86.7	Confident	23 Å²	23	39.1 Å²	39.1	24%	0.237	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169	167	-179.3	0	0	0	0	0	114	V226	G219-V226 PolarHBondContact N-O 3.4Å; G219-V226 PolarHBondContact O-N 2.76Å
220	R	82.8	Confident	86.9	Confident	163 Å²	163	39.2 Å²	39.2	62%	0.615	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-143	129.3	-179.9	-171.5	-177.4	-62.7	-151.6	-1.4	110.3	E217 T225	E217-R220 WeakPolarHBondContact OE1-CB 3.48Å; E217-R220 IonicContact OE1-NE 3.25Å; E217-R220 IonicContact OE2-CZ 2.6Å; E217-R220 VanDerWaalsContact OE2-CZ 3.25Å; E217-R220 IonicContact OE2-NE 3.88Å; E217-R220 PolarHBondContact OE2-NE 3.13Å; E217-R220 IonicContact OE2-NH2 3.87Å; E217-R220 PolarHBondContact OE2-NH2 3.29Å; R220-T225 HydrophobicContact CB-CG2 4.39Å; R220-T225 HydrophobicContact CG-CG2 4.29Å
221	G	70.3	Confident	86.9	Confident	45 Å²	45	36.5 Å²	36.5	46%	0.464	19%	0.191	S	C	.	.			trans	-106.8	-168.1	171.2	0	0	0	0	0	111.6	F223 K224	G221-F223 VanDerWaalsContact C-N 3.33Å; G221-K224 PolarHBondContact N-O 3.5Å
222	S	65.5	Low	86.8	Confident	87 Å²	87	38.4 Å²	38.4	61%	0.608	20%	0.203	S	C	*	.	S	Bend	trans	-72.7	-22.6	177.6	50.9	0	0	0	0	114.4
223	F	67.4	Low	86.7	Confident	70 Å²	70	42.2 Å²	42.2	31%	0.307	22%	0.22	S	C	.	.	S	Bend	trans	-126.9	-16.5	-175.1	-53.6	-64.6	0	0	0	114	G221 L243 Q244 K366 S369	G221-F223 VanDerWaalsContact C-N 3.33Å; F223-L243 WeakPolarHBondContact O-CA 3.37Å; F223-Q244 PolarHBondContact O-N 3.31Å; F223-K366 HydrophobicContact CD2-CG 4.26Å; F223-K366 HydrophobicContact CE2-CG 4.01Å; F223-S369 WeakPolarHBondContact CE1-OG 3.46Å; F223-S369 WeakPolarHBondContact CZ-OG 3.49Å
224	K	80.4	Confident	86.6	Confident	37 Å²	37	45 Å²	45	16%	0.161	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	147.2	-176.8	73	173.1	176.1	175.6	0	113.2	G221 V226 E242 L243 D359 L362	G221-K224 PolarHBondContact N-O 3.5Å; K224-V226 HydrophobicContact CD-CG2 4.16Å; K224-V226 HydrophobicContact CG-CG2 4.42Å; K224-E242 CarbonylContact C-O 3.54Å; K224-E242 VanDerWaalsContact CA-O 3.26Å; K224-E242 WeakPolarHBondContact CA-O 3.43Å; K224-L243 HydrophobicContact CB-CD2 3.88Å; K224-D359 VanDerWaalsContact CE-OD2 3.26Å; K224-D359 WeakPolarHBondContact CE-OD2 3.29Å; K224-D359 IonicContact NZ-OD1 2.72Å; K224-D359 PolarHBondContact NZ-OD1 3.29Å; K224-D359 IonicContact NZ-OD2 2.85Å; K224-D359 PolarHBondContact NZ-OD2 2.67Å; K224-L362 HydrophobicContact CD-CD1 3.93Å
225	T	86.5	Confident	86.5	Confident	8 Å²	8	45.2 Å²	45.2	5%	0.049	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	128.9	167	-49.2	0	0	0	0	108.8	E217 R220 Y227 C241 E242	E217-T225 HydrophobicContact CG-CG2 3.67Å; E217-T225 WeakPolarHBondContact OE2-CG2 3.41Å; R220-T225 HydrophobicContact CB-CG2 4.39Å; R220-T225 HydrophobicContact CG-CG2 4.29Å; T225-Y227 HydrophobicContact CG2-CD2 4.25Å; T225-Y227 HydrophobicContact CG2-CE2 3.49Å; T225-Y227 VanDerWaalsContact CG2-CE2 3.49Å; T225-C241 WeakPolarHBondContact O-CA 3.44Å; T225-E242 PolarHBondContact N-O 3.43Å; T225-E242 PolarHBondContact O-N 3.2Å
226	V	90.4	Very high	86.6	Confident	21 Å²	21	43.5 Å²	43.5	13%	0.127	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	119.5	-174.5	-172.9	0	0	0	0	109.2	E217 I218 G219 K224 A239 W240 C241	E217-V226 CarbonylContact C-O 3.51Å; E217-V226 WeakPolarHBondContact CA-O 3.38Å; E217-V226 WeakPolarHBondContact CG-O 3.46Å; I218-V226 HydrophobicContact CB-CG1 4.29Å; I218-V226 HydrophobicContact CD1-CG1 4.21Å; I218-V226 PolarHBondContact N-O 2.91Å; G219-V226 PolarHBondContact N-O 3.4Å; G219-V226 PolarHBondContact O-N 2.76Å; K224-V226 HydrophobicContact CD-CG2 4.16Å; K224-V226 HydrophobicContact CG-CG2 4.42Å; V226-A239 HydrophobicContact CG1-CB 3.96Å; V226-W240 WeakPolarHBondContact CA-O 3.5Å; V226-C241 HydrophobicContact CG2-CB 4.5Å
227	Y	92.9	Very high	86.9	Confident	38 Å²	38	45.2 Å²	45.2	15%	0.149	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	154.1	177.4	-65	-88	0	0	0	110.4	K213 E217 T225 W240 E242	K213-Y227 VanDerWaalsContact CE-CD2 3.4Å; K213-Y227 VanDerWaalsContact CE-CG 3.46Å; E217-Y227 HydrophobicContact CB-CD1 4.2Å; E217-Y227 HydrophobicContact CB-CE1 4.07Å; E217-Y227 HydrophobicContact CG-CE1 4.36Å; T225-Y227 HydrophobicContact CG2-CD2 4.25Å; T225-Y227 HydrophobicContact CG2-CE2 3.49Å; T225-Y227 VanDerWaalsContact CG2-CE2 3.49Å; Y227-W240 PolarHBondContact N-O 3.4Å; Y227-W240 PolarHBondContact O-N 3.18Å; Y227-E242 HydrophobicContact CD2-CG 4.14Å; Y227-E242 HydrophobicContact CE2-CG 4.2Å; Y227-E242 WeakPolarHBondContact CE2-OE2 3.37Å
228	R	93.5	Very high	87.2	Confident	41 Å²	41	44.6 Å²	44.6	16%	0.155	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	137.7	167.6	-168.6	176.5	178	-159.8	-5	109.6	E200 F214 E216 I218 Y237 L294	E200-R228 IonicContact OE1-NH1 2.73Å; F214-R228 HydrophobicContact CD2-CB 4.49Å; F214-R228 HydrophobicContact CD2-CG 4.31Å; F214-R228 WeakPolarHBondContact CD2-O 3.49Å; F214-R228 PolarHBondContact N-O 2.95Å; E216-R228 HydrophobicContact CB-CB 4.14Å; E216-R228 PolarHBondContact O-N 2.77Å; E216-R228 WeakPolarHBondContact OE2-CD 3.47Å; E216-R228 IonicContact OE2-CZ 3.71Å; E216-R228 IonicContact OE2-NE 3.6Å; E216-R228 IonicContact OE2-NH1 3.27Å; E216-R228 PolarHBondContact OE2-NH1 3.29Å; I218-R228 HydrophobicContact CD1-CB 3.98Å; I218-R228 HydrophobicContact CG1-CB 4.25Å; R228-Y237 HydrophobicContact CG-CD1 4.03Å; R228-Y237 VanDerWaalsContact NE-CD1 3.31Å; R228-Y237 PolarHBondContact NH2-OH 2.89Å; R228-L294 HydrophobicContact CG-CD2 4.25Å
229	G	94.6	Very high	87.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	179	169.7	0	0	0	0	0	112.3	L212 Y237 V238	L212-G229 CarbonylContact O-C 3.59Å; L212-G229 WeakPolarHBondContact O-CA 3.41Å; G229-Y237 CarbonylContact O-C 3.57Å; G229-Y237 VanDerWaalsContact O-CA 3.29Å; G229-Y237 WeakPolarHBondContact O-CA 3.48Å; G229-Y237 WeakPolarHBondContact O-CD1 3.34Å; G229-V238 PolarHBondContact N-O 2.98Å; G229-V238 PolarHBondContact O-N 3.17Å
230	L	95.3	Very high	88.2	Confident	28 Å²	28	42.1 Å²	42.1	15%	0.147	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	131.2	176.5	180	71.3	0	0	0	109.7	F211 L212 F214 Y237	F211-L230 WeakPolarHBondContact CA-O 3.49Å; L212-L230 PolarHBondContact N-O 3.34Å; L212-L230 PolarHBondContact O-N 3.46Å; F214-L230 HydrophobicContact CE2-CB 3.75Å; F214-L230 HydrophobicContact CZ-CB 3.85Å; L230-Y237 HydrophobicContact CD1-CD1 4.25Å; L230-Y237 HydrophobicContact CD1-CE1 4.38Å; L230-Y237 HydrophobicContact CD1-CG 4.48Å
231	D	95.6	Very high	88.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	113.7	163.3	177.8	15.4	0	0	0	109.2	R210 F211 E233 T234 G235 V236 V238	R210-D231 VanDerWaalsContact CG-OD1 3.28Å; R210-D231 WeakPolarHBondContact CG-OD1 3.34Å; R210-D231 IonicContact CZ-OD1 3.34Å; R210-D231 IonicContact CZ-OD2 2.79Å; R210-D231 IonicContact NE-OD1 3.18Å; R210-D231 PolarHBondContact NE-OD1 2.99Å; R210-D231 IonicContact NE-OD2 2.67Å; R210-D231 IonicContact NH2-OD1 3.14Å; R210-D231 PolarHBondContact NH2-OD1 3.39Å; R210-D231 IonicContact NH2-OD2 3.93Å; R210-D231 PolarHBondContact NH2-OD2 2.9Å; F211-D231 HydrophobicContact CD1-CB 3.89Å; F211-D231 HydrophobicContact CE1-CB 3.8Å; D231-E233 VanDerWaalsContact C-N 3.33Å; D231-E233 PolarHBondContact O-N 2.8Å; D231-E233 PolarHBondContact OD1-N 2.84Å; D231-T234 WeakPolarHBondContact CB-OG1 3.48Å; D231-T234 WeakPolarHBondContact OD2-CB 3.32Å; D231-T234 WeakPolarHBondContact OD2-CG2 3.26Å; D231-T234 PolarHBondContact OD2-OG1 3.44Å; D231-G235 VanDerWaalsContact O-CA 3.31Å; D231-G235 WeakPolarHBondContact O-CA 3.46Å; D231-G235 PolarHBondContact O-N 3.01Å; D231-V236 PolarHBondContact N-O 3.17Å; D231-V238 HydrophobicContact CB-CG1 4.08Å
232	T	93.2	Very high	89.4	Confident	44 Å²	44	33.6 Å²	33.6	27%	0.27	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-19.5	-174.2	58.3	0	0	0	0	113.8	R210 L212	R210-T232 WeakPolarHBondContact O-CB 3.21Å; R210-T232 WeakPolarHBondContact O-CG2 3.09Å; R210-T232 PolarHBondContact O-N 2.94Å; R210-T232 PolarHBondContact O-OG1 3.12Å; L212-T232 HydrophobicContact CD1-CG2 3.65Å; L212-T232 HydrophobicContact CG-CG2 3.71Å
233	E	93	Very high	90.1	Very high	118 Å²	118	29.9 Å²	29.9	55%	0.551	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-51.6	173.1	-72.1	178.1	-158.3	0	0	111	R210 D231	R210-E233 WeakPolarHBondContact CD-OE1 3.43Å; R210-E233 HydrophobicContact CG-CG 4.25Å; R210-E233 IonicContact CZ-OE1 3.85Å; R210-E233 IonicContact CZ-OE2 2.75Å; R210-E233 IonicContact NE-OE1 3.8Å; R210-E233 IonicContact NE-OE2 3.9Å; R210-E233 IonicContact NH1-OE1 3.37Å; R210-E233 PolarHBondContact NH1-OE1 3.5Å; R210-E233 IonicContact NH1-OE2 2.7Å; R210-E233 PolarHBondContact NH1-OE2 2.9Å; R210-E233 IonicContact NH2-OE2 3.84Å; R210-E233 PolarHBondContact NH2-OE2 3.25Å; R210-E233 VanDerWaalsContact NH2-OE2 3.1Å; D231-E233 VanDerWaalsContact C-N 3.33Å; D231-E233 PolarHBondContact O-N 2.8Å; D231-E233 PolarHBondContact OD1-N 2.84Å
234	T	92.2	Very high	90.3	Very high	66 Å²	66	32.3 Å²	32.3	41%	0.405	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-20.4	-173.2	61.9	0	0	0	0	113.8	D231 V236	D231-T234 WeakPolarHBondContact CB-OG1 3.48Å; D231-T234 WeakPolarHBondContact OD2-CB 3.32Å; D231-T234 WeakPolarHBondContact OD2-CG2 3.26Å; D231-T234 PolarHBondContact OD2-OG1 3.44Å; T234-V236 VanDerWaalsContact C-N 3.25Å; T234-V236 PolarHBondContact OG1-N 2.86Å
235	G	89.9	Confident	89.5	Confident	20 Å²	20	31 Å²	31	21%	0.206	16%	0.16	C	C	.	.			trans	73.3	14.3	-172.6	0	0	0	0	0	114	D231	D231-G235 VanDerWaalsContact O-CA 3.31Å; D231-G235 WeakPolarHBondContact O-CA 3.46Å; D231-G235 PolarHBondContact O-N 3.01Å
236	V	91.6	Very high	88.2	Confident	37 Å²	37	35.8 Å²	35.8	22%	0.224	19%	0.194	C	C	.	.			trans	-96.1	136.6	-176.9	-179.3	0	0	0	0	110.5	M95 D231 T234	M95-V236 HydrophobicContact CE-CG1 4.31Å; M95-V236 HydrophobicContact CE-CG2 4.18Å; M95-V236 HydrophobicContact SD-CG2 4.4Å; D231-V236 PolarHBondContact N-O 3.17Å; T234-V236 VanDerWaalsContact C-N 3.25Å; T234-V236 PolarHBondContact OG1-N 2.86Å
237	Y	93.5	Very high	86.7	Confident	54 Å²	54	41.2 Å²	41.2	21%	0.212	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	136.9	174.6	-70.7	-79.5	0	0	0	111.1	R88 F214 R228 G229 L230 L294	R88-Y237 PolarHBondContact NH2-OH 3.08Å; F214-Y237 HydrophobicContact CE2-CD1 4.23Å; F214-Y237 AromaticContact CE2-CE1 3.96Å; F214-Y237 HydrophobicContact CE2-CE1 3.96Å; R228-Y237 HydrophobicContact CG-CD1 4.03Å; R228-Y237 VanDerWaalsContact NE-CD1 3.31Å; R228-Y237 PolarHBondContact NH2-OH 2.89Å; G229-Y237 CarbonylContact O-C 3.57Å; G229-Y237 VanDerWaalsContact O-CA 3.29Å; G229-Y237 WeakPolarHBondContact O-CA 3.48Å; G229-Y237 WeakPolarHBondContact O-CD1 3.34Å; L230-Y237 HydrophobicContact CD1-CD1 4.25Å; L230-Y237 HydrophobicContact CD1-CE1 4.38Å; L230-Y237 HydrophobicContact CD1-CG 4.48Å; Y237-L294 WeakPolarHBondContact O-CB 3.45Å
238	V	94.9	Very high	85.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	164.1	-177.3	-65.6	0	0	0	0	111.2	F211 G229 D231 Y275 V291 T292	F211-V238 HydrophobicContact CD1-CG2 4.23Å; G229-V238 PolarHBondContact N-O 2.98Å; G229-V238 PolarHBondContact O-N 3.17Å; D231-V238 HydrophobicContact CB-CG1 4.08Å; V238-Y275 HydrophobicContact CG1-CD2 4.06Å; V238-Y275 HydrophobicContact CG1-CE2 3.77Å; V238-V291 HydrophobicContact CB-CG1 3.74Å; V238-V291 HydrophobicContact CG1-CG1 4.16Å; V238-V291 HydrophobicContact CG2-CG1 3.67Å; V238-T292 WeakPolarHBondContact CB-O 3.29Å
239	A	94.3	Very high	84.2	Confident	7 Å²	7	41.5 Å²	41.5	6%	0.058	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	111.7	171.2	0	0	0	0	0	109.7	V226 V291 T292 L294	V226-A239 HydrophobicContact CG1-CB 3.96Å; A239-V291 WeakPolarHBondContact O-CA 3.26Å; A239-T292 PolarHBondContact N-O 3.34Å; A239-T292 PolarHBondContact O-N 3.44Å; A239-L294 HydrophobicContact CB-CD1 4.31Å
240	W	94	Very high	83.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	106.8	175.5	177.9	-64.9	0	0	0	108.8	D204 F211 K213 V226 Y227 E242 W278 I280 V289	D204-W240 HydrophobicContact CB-CH2 4.01Å; D204-W240 HydrophobicContact CB-CZ2 3.9Å; F211-W240 HydrophobicContact CB-CZ3 4.36Å; K213-W240 HydrophobicContact CB-CD2 3.72Å; K213-W240 HydrophobicContact CB-CE3 3.73Å; K213-W240 HydrophobicContact CB-CG 4.33Å; K213-W240 HydrophobicContact CB-CH2 3.84Å; K213-W240 HydrophobicContact CB-CZ2 3.88Å; K213-W240 HydrophobicContact CB-CZ3 3.8Å; K213-W240 HydrophobicContact CD-CD2 4.16Å; K213-W240 HydrophobicContact CD-CG 4.34Å; K213-W240 HydrophobicContact CD-CZ2 3.89Å; K213-W240 HydrophobicContact CG-CD2 3.77Å; K213-W240 HydrophobicContact CG-CE3 4.3Å; K213-W240 HydrophobicContact CG-CG 3.89Å; K213-W240 HydrophobicContact CG-CZ2 4.22Å; V226-W240 WeakPolarHBondContact CA-O 3.5Å; Y227-W240 PolarHBondContact N-O 3.4Å; Y227-W240 PolarHBondContact O-N 3.18Å; W240-E242 VanDerWaalsContact CD1-CG 3.5Å; W240-E242 PolarHBondContact NE1-OE1 3.42Å; W240-W278 HydrophobicContact CE3-CH2 4.18Å; W240-W278 HydrophobicContact CE3-CZ2 4.23Å; W240-W278 HydrophobicContact CH2-CH2 4.21Å; W240-W278 AromaticContact CH2-CZ2 3.52Å; W240-W278 HydrophobicContact CH2-CZ2 3.52Å; W240-W278 AromaticContact CZ2-CZ2 3.91Å; W240-W278 HydrophobicContact CZ2-CZ2 3.91Å; W240-W278 AromaticContact CZ3-CH2 3.87Å; W240-W278 HydrophobicContact CZ3-CH2 3.87Å; W240-W278 AromaticContact CZ3-CZ2 3.67Å; W240-W278 HydrophobicContact CZ3-CZ2 3.67Å; W240-I280 HydrophobicContact CZ2-CD1 4.37Å; W240-V289 HydrophobicContact CD2-CG1 3.82Å; W240-V289 HydrophobicContact CE3-CG1 4.45Å; W240-V289 HydrophobicContact CG-CG1 4.07Å; W240-V289 HydrophobicContact CZ2-CG1 4.14Å; W240-V289 HydrophobicContact CZ2-CG2 4.2Å
241	C	91.2	Very high	82.2	Confident	7 Å²	7	53.8 Å²	53.8	5%	0.047	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	118.4	-175.9	-59.5	0	0	0	0	110.9	T225 V226 V289 L290	T225-C241 WeakPolarHBondContact O-CA 3.44Å; V226-C241 HydrophobicContact CG2-CB 4.5Å; C241-V289 CarbonylContact O-C 3.53Å; C241-V289 WeakPolarHBondContact O-CA 3.44Å; C241-L290 HydrophobicContact CB-CB 4.18Å; C241-L290 PolarHBondContact N-O 3Å; C241-L290 PolarHBondContact O-N 2.82Å
242	E	88.2	Confident	80.8	Confident	23 Å²	23	55.1 Å²	55.1	11%	0.107	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.3	178.4	-52.6	-166.3	135.7	0	0	111	K213 K224 T225 Y227 W240 V289	K213-E242 WeakPolarHBondContact CE-OE1 3.37Å; K213-E242 IonicContact NZ-OE1 3.52Å; K213-E242 PolarHBondContact NZ-OE1 3.03Å; K213-E242 IonicContact NZ-OE2 2.76Å; K213-E242 PolarHBondContact NZ-OE2 2.9Å; K224-E242 CarbonylContact C-O 3.54Å; K224-E242 VanDerWaalsContact CA-O 3.26Å; K224-E242 WeakPolarHBondContact CA-O 3.43Å; T225-E242 PolarHBondContact N-O 3.43Å; T225-E242 PolarHBondContact O-N 3.2Å; Y227-E242 HydrophobicContact CD2-CG 4.14Å; Y227-E242 HydrophobicContact CE2-CG 4.2Å; Y227-E242 WeakPolarHBondContact CE2-OE2 3.37Å; W240-E242 VanDerWaalsContact CD1-CG 3.5Å; W240-E242 PolarHBondContact NE1-OE1 3.42Å; E242-V289 HydrophobicContact CG-CG2 4.44Å
243	L	79.2	Confident	79.8	Confident	8 Å²	8	55.9 Å²	55.9	4%	0.042	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	129.8	176.4	-66.2	169.3	0	0	0	111	F223 K224 E245 F256 C287 I288 L290 L362 L365	F223-L243 WeakPolarHBondContact O-CA 3.37Å; K224-L243 HydrophobicContact CB-CD2 3.88Å; L243-E245 PolarHBondContact O-N 3.41Å; L243-F256 HydrophobicContact CD1-CE1 3.68Å; L243-F256 HydrophobicContact CD1-CE2 4.37Å; L243-F256 HydrophobicContact CD1-CZ 3.51Å; L243-C287 WeakPolarHBondContact O-CA 3.36Å; L243-C287 WeakPolarHBondContact O-CB 3.26Å; L243-I288 HydrophobicContact CB-CB 4.37Å; L243-I288 WeakPolarHBondContact CB-O 3.46Å; L243-I288 HydrophobicContact CD1-CB 4.27Å; L243-I288 PolarHBondContact N-O 2.75Å; L243-I288 PolarHBondContact O-N 3.18Å; L243-L290 HydrophobicContact CD1-CD1 3.86Å; L243-L290 HydrophobicContact CD1-CD2 4.35Å; L243-L290 HydrophobicContact CD1-CG 4.12Å; L243-L290 HydrophobicContact CG-CD1 4.34Å; L243-L362 HydrophobicContact CD1-CD2 4.43Å; L243-L362 HydrophobicContact CD2-CD2 4.02Å; L243-L365 HydrophobicContact CD1-CD1 3.57Å; L243-L365 HydrophobicContact CD2-CD1 4.12Å; L243-L365 HydrophobicContact CG-CD1 4.42Å
244	Q	71.2	Confident	79.1	Confident	121 Å²	121	54.7 Å²	54.7	57%	0.565	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	115.8	178.8	-64.8	-172.7	0.3	0	0	111.2	F223 S246	F223-Q244 PolarHBondContact O-N 3.31Å; Q244-S246 PolarHBondContact O-N 3.19Å
245	E	64.6	Low	78.3	Confident	11 Å²	11	58.2 Å²	58.2	5%	0.051	29%	0.287	C	S	.	.			trans	-88.6	-3.7	-164.5	-162.7	173.2	-173.3	0	0	115.1	L243 K247 L248 R253 K286 C287	L243-E245 PolarHBondContact O-N 3.41Å; E245-K247 PolarHBondContact O-N 3.23Å; E245-L248 HydrophobicContact CG-CD1 4.4Å; E245-L248 PolarHBondContact O-N 3.17Å; E245-R253 IonicContact OE1-CZ 3.17Å; E245-R253 IonicContact OE1-NE 2.7Å; E245-R253 PolarHBondContact OE1-NE 3.1Å; E245-R253 IonicContact OE1-NH2 2.7Å; E245-R253 PolarHBondContact OE1-NH2 3.35Å; E245-K286 HydrophobicContact CB-CB 4.35Å; E245-K286 VanDerWaalsContact CB-O 3.28Å; E245-K286 WeakPolarHBondContact CB-O 3.42Å; E245-K286 WeakPolarHBondContact OE2-CB 3.36Å; E245-C287 PolarHBondContact OE2-N 3.21Å
246	S	58.6	Low	77.7	Confident	107 Å²	107	57.5 Å²	57.5	75%	0.748	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	12.6	-166	56.9	0	0	0	0	117.1	Q244	Q244-S246 PolarHBondContact O-N 3.19Å
247	K	59.2	Low	77.1	Confident	135 Å²	135	60.3 Å²	60.3	59%	0.587	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.1	-1.9	-178.4	-67.3	-175.1	170.1	-174.5	0	115.4	E245 S369	E245-K247 PolarHBondContact O-N 3.23Å; K247-S369 WeakPolarHBondContact CD-O 3.41Å; K247-S369 PolarHBondContact NZ-O 3.39Å
248	L	64.1	Low	76.5	Confident	39 Å²	39	62 Å²	62	20%	0.204	30%	0.298	C	S	.	.			trans	-95.5	134.3	-170.6	-59.9	178.2	0	0	0	113.2	E245 E252 L365	E245-L248 HydrophobicContact CG-CD1 4.4Å; E245-L248 PolarHBondContact O-N 3.17Å; L248-E252 HydrophobicContact CB-CB 4.35Å; L248-E252 HydrophobicContact CD2-CB 4.23Å; L248-L365 HydrophobicContact CD1-CD2 3.77Å; L248-L365 HydrophobicContact CD2-CD2 3.95Å
249	S	69.5	Low	75.8	Confident	47 Å²	47	63.7 Å²	63.7	33%	0.329	31%	0.306	S	S	.	.			trans	-74.9	164.1	171.7	89.8	0	0	0	0	112	L251 E252 R253	S249-L251 PolarHBondContact O-N 3.24Å; S249-L251 PolarHBondContact OG-N 3.36Å; S249-E252 WeakPolarHBondContact CB-OE1 3.26Å; S249-E252 VanDerWaalsContact CB-OE2 3.23Å; S249-E252 WeakPolarHBondContact CB-OE2 3.35Å; S249-E252 PolarHBondContact N-OE2 2.69Å; S249-E252 PolarHBondContact O-N 2.73Å; S249-E252 PolarHBondContact OG-N 3.39Å; S249-E252 VanDerWaalsContact OG-N 3.17Å; S249-E252 PolarHBondContact OG-OE1 3.09Å; S249-E252 PolarHBondContact OG-OE2 3.46Å; S249-R253 PolarHBondContact O-N 3.14Å
250	K	73.8	Confident	75.3	Confident	184 Å²	184	63.3 Å²	63.3	80%	0.8	30%	0.303	S	S	*	.	H	α-helix	trans	-56.8	-34.5	173.7	-70	-174.5	178.6	-178.3	0	112.4	Q254	K250-Q254 PolarHBondContact O-N 2.97Å; K250-Q254 VanDerWaalsContact O-N 3.15Å
251	L	73.4	Confident	74.9	Confident	102 Å²	102	67.7 Å²	67.7	53%	0.534	32%	0.323	S	S	.	.	H	α-helix	trans	-76.5	-36.5	180	-177.2	62.5	0	0	0	112	S249 R255	S249-L251 PolarHBondContact O-N 3.24Å; S249-L251 PolarHBondContact OG-N 3.36Å; L251-R255 WeakPolarHBondContact O-CG 3.4Å; L251-R255 PolarHBondContact O-N 3.16Å; L251-R255 VanDerWaalsContact O-N 3.11Å
252	E	67.8	Low	74.6	Confident	28 Å²	28	70.3 Å²	70.3	13%	0.131	34%	0.335	C	S	.	.	H	α-helix	trans	-63.9	-43.5	169.9	-77.2	101.3	-111.6	0	0	111.5	L248 S249 Q254 R255 F256 K368	L248-E252 HydrophobicContact CB-CB 4.35Å; L248-E252 HydrophobicContact CD2-CB 4.23Å; S249-E252 WeakPolarHBondContact CB-OE1 3.26Å; S249-E252 VanDerWaalsContact CB-OE2 3.23Å; S249-E252 WeakPolarHBondContact CB-OE2 3.35Å; S249-E252 PolarHBondContact N-OE2 2.69Å; S249-E252 PolarHBondContact O-N 2.73Å; S249-E252 PolarHBondContact OG-N 3.39Å; S249-E252 VanDerWaalsContact OG-N 3.17Å; S249-E252 PolarHBondContact OG-OE1 3.09Å; S249-E252 PolarHBondContact OG-OE2 3.46Å; E252-Q254 VanDerWaalsContact C-N 3.31Å; E252-Q254 PolarHBondContact O-N 2.79Å; E252-R255 PolarHBondContact O-N 3.22Å; E252-F256 WeakPolarHBondContact O-CB 3.49Å; E252-F256 PolarHBondContact O-N 3.23Å; E252-K368 HydrophobicContact CG-CD 3.82Å; E252-K368 WeakPolarHBondContact OE1-CD 2.78Å; E252-K368 IonicContact OE1-NZ 2.63Å; E252-K368 PolarHBondContact OE1-NZ 3.26Å
253	R	72.6	Confident	74.5	Confident	60 Å²	60	69.5 Å²	69.5	23%	0.226	33%	0.332	C	S	.	.	H	α-helix	trans	-58.2	-44.6	177.6	-173.6	-170.8	-68.5	125.7	4.3	111.2	E245 S249 F256 R257 D279 I288	E245-R253 IonicContact OE1-CZ 3.17Å; E245-R253 IonicContact OE1-NE 2.7Å; E245-R253 PolarHBondContact OE1-NE 3.1Å; E245-R253 IonicContact OE1-NH2 2.7Å; E245-R253 PolarHBondContact OE1-NH2 3.35Å; S249-R253 PolarHBondContact O-N 3.14Å; R253-F256 PolarHBondContact O-N 2.79Å; R253-R257 WeakPolarHBondContact O-CG 3.35Å; R253-R257 PolarHBondContact O-N 2.78Å; R253-D279 WeakPolarHBondContact CD-OD2 3.39Å; R253-D279 IonicContact NE-OD2 2.88Å; R253-I288 HydrophobicContact CG-CD1 4.48Å
254	Q	77.9	Confident	74.9	Confident	92 Å²	92	71.6 Å²	71.6	43%	0.43	34%	0.341	S	S	.	.	H	α-helix	trans	-63.2	-52.3	178.3	-170.2	58.2	45.1	0	0	111.3	K250 E252 F256 R257 D258	K250-Q254 PolarHBondContact O-N 2.97Å; K250-Q254 VanDerWaalsContact O-N 3.15Å; E252-Q254 VanDerWaalsContact C-N 3.31Å; E252-Q254 PolarHBondContact O-N 2.79Å; Q254-F256 PolarHBondContact O-N 3.02Å; Q254-F256 VanDerWaalsContact O-N 3.16Å; Q254-R257 WeakPolarHBondContact O-CA 3.12Å; Q254-R257 WeakPolarHBondContact O-CB 3.31Å; Q254-R257 PolarHBondContact O-N 3.07Å; Q254-D258 PolarHBondContact NE2-OD1 3.07Å; Q254-D258 PolarHBondContact O-N 3.46Å; Q254-D258 VanDerWaalsContact O-OD2 3.11Å
255	R	75.1	Confident	75.7	Confident	141 Å²	141	70.3 Å²	70.3	53%	0.532	34%	0.341	S	S	.	.	H	α-helix	trans	-53.8	-39.1	176.9	-72	178.5	178.8	-160.4	-1.5	112.7	L251 E252 D258 E259	L251-R255 WeakPolarHBondContact O-CG 3.4Å; L251-R255 PolarHBondContact O-N 3.16Å; L251-R255 VanDerWaalsContact O-N 3.11Å; E252-R255 PolarHBondContact O-N 3.22Å; R255-D258 PolarHBondContact O-N 2.83Å; R255-E259 WeakPolarHBondContact O-CB 3.49Å; R255-E259 PolarHBondContact O-N 3.48Å
256	F	76.6	Confident	76.8	Confident	4 Å²	4	70.1 Å²	70.1	2%	0.018	34%	0.34	C	S	.	.	H	α-helix	trans	-70.7	-34.5	177.7	-175.4	-103.2	0	0	0	113.2	L243 E252 R253 Q254 A260 I288 L290 L365	L243-F256 HydrophobicContact CD1-CE1 3.68Å; L243-F256 HydrophobicContact CD1-CE2 4.37Å; L243-F256 HydrophobicContact CD1-CZ 3.51Å; E252-F256 WeakPolarHBondContact O-CB 3.49Å; E252-F256 PolarHBondContact O-N 3.23Å; R253-F256 PolarHBondContact O-N 2.79Å; Q254-F256 PolarHBondContact O-N 3.02Å; Q254-F256 VanDerWaalsContact O-N 3.16Å; F256-A260 HydrophobicContact CE1-CB 4.49Å; F256-A260 VanDerWaalsContact O-CB 3.22Å; F256-A260 WeakPolarHBondContact O-CB 3.36Å; F256-A260 PolarHBondContact O-N 3.29Å; F256-I288 HydrophobicContact CD1-CD1 3.65Å; F256-I288 HydrophobicContact CD1-CG2 4.39Å; F256-I288 HydrophobicContact CE1-CB 4.45Å; F256-I288 HydrophobicContact CE1-CD1 4.09Å; F256-I288 HydrophobicContact CE1-CG2 3.93Å; F256-L290 HydrophobicContact CE1-CD2 3.87Å; F256-L290 HydrophobicContact CZ-CD1 4.23Å; F256-L290 HydrophobicContact CZ-CD2 3.74Å; F256-L365 HydrophobicContact CB-CD2 4.07Å; F256-L365 HydrophobicContact CD2-CD1 3.65Å; F256-L365 HydrophobicContact CD2-CD2 3.73Å; F256-L365 HydrophobicContact CD2-CG 3.56Å; F256-L365 HydrophobicContact CE1-CD1 4.37Å; F256-L365 HydrophobicContact CE2-CD1 3.46Å; F256-L365 VanDerWaalsContact CE2-CD1 3.46Å; F256-L365 HydrophobicContact CE2-CD2 4.42Å; F256-L365 HydrophobicContact CE2-CG 3.84Å; F256-L365 HydrophobicContact CG-CD1 4.19Å; F256-L365 HydrophobicContact CG-CD2 3.86Å; F256-L365 HydrophobicContact CG-CG 4.18Å; F256-L365 HydrophobicContact CZ-CD1 3.86Å
257	R	80	Confident	78.4	Confident	96 Å²	96	69.5 Å²	69.5	36%	0.362	33%	0.325	S	S	.	.	H	α-helix	trans	-66.7	-42.5	171.6	-69.4	174	165.8	-153.6	-0.4	111.4	R253 Q254 E259 A260 E261 F277 D279	R253-R257 WeakPolarHBondContact O-CG 3.35Å; R253-R257 PolarHBondContact O-N 2.78Å; Q254-R257 WeakPolarHBondContact O-CA 3.12Å; Q254-R257 WeakPolarHBondContact O-CB 3.31Å; Q254-R257 PolarHBondContact O-N 3.07Å; R257-E259 VanDerWaalsContact C-N 3.31Å; R257-E259 PolarHBondContact O-N 3.13Å; R257-A260 PolarHBondContact O-N 3.43Å; R257-E261 PolarHBondContact O-N 3.49Å; R257-F277 HydrophobicContact CB-CE2 4.08Å; R257-F277 HydrophobicContact CB-CZ 4.32Å; R257-F277 HydrophobicContact CG-CE2 3.96Å; R257-D279 IonicContact CZ-OD2 3.38Å; R257-D279 IonicContact NE-OD1 3.83Å; R257-D279 IonicContact NE-OD2 3.61Å; R257-D279 PolarHBondContact NE-OD2 3.19Å; R257-D279 IonicContact NH2-OD2 3.12Å; R257-D279 PolarHBondContact NH2-OD2 3.1Å
258	D	80.7	Confident	80.1	Confident	89 Å²	89	65 Å²	65	48%	0.476	31%	0.307	S	S	.	.	H	α-helix	trans	-60.8	-43.5	176.8	-50.9	-32.8	0	0	0	110.4	Q254 R255 M262	Q254-D258 PolarHBondContact NE2-OD1 3.07Å; Q254-D258 PolarHBondContact O-N 3.46Å; Q254-D258 VanDerWaalsContact O-OD2 3.11Å; R255-D258 PolarHBondContact O-N 2.83Å; D258-M262 PolarHBondContact O-N 3.41Å; D258-M262 VanDerWaalsContact O-N 3.16Å
259	E	80.5	Confident	81.5	Confident	36 Å²	36	67.6 Å²	67.6	17%	0.168	33%	0.325	C	S	.	.	H	α-helix	trans	-66.4	-41.8	174.6	-175.3	168.6	-151.2	0	0	112.4	R255 R257 M262 L263 G361 T364	R255-E259 WeakPolarHBondContact O-CB 3.49Å; R255-E259 PolarHBondContact O-N 3.48Å; R257-E259 VanDerWaalsContact C-N 3.31Å; R257-E259 PolarHBondContact O-N 3.13Å; E259-M262 HydrophobicContact CG-CE 4.39Å; E259-M262 WeakPolarHBondContact O-CB 3.14Å; E259-M262 PolarHBondContact O-N 2.99Å; E259-L263 WeakPolarHBondContact O-CG 3.36Å; E259-L263 PolarHBondContact O-N 3.13Å; E259-G361 VanDerWaalsContact OE1-CA 3.26Å; E259-G361 WeakPolarHBondContact OE1-CA 3.42Å; E259-T364 VanDerWaalsContact CD-OG1 3.29Å; E259-T364 PolarHBondContact OE1-OG1 3.32Å; E259-T364 WeakPolarHBondContact OE2-CB 3.43Å; E259-T364 PolarHBondContact OE2-OG1 3.15Å
260	A	83.7	Confident	82.7	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-68.8	-34	179.1	0	0	0	0	0	113.1	F256 R257 L263 K264 F274 F277	F256-A260 HydrophobicContact CE1-CB 4.49Å; F256-A260 VanDerWaalsContact O-CB 3.22Å; F256-A260 WeakPolarHBondContact O-CB 3.36Å; F256-A260 PolarHBondContact O-N 3.29Å; R257-A260 PolarHBondContact O-N 3.43Å; A260-L263 WeakPolarHBondContact O-CB 3.27Å; A260-L263 PolarHBondContact O-N 3.24Å; A260-K264 PolarHBondContact O-N 3.4Å; A260-K264 VanDerWaalsContact O-N 3.14Å; A260-F274 HydrophobicContact CB-CZ 4.28Å; A260-F277 HydrophobicContact CB-CB 4.33Å; A260-F277 HydrophobicContact CB-CD1 3.43Å; A260-F277 VanDerWaalsContact CB-CD1 3.43Å; A260-F277 HydrophobicContact CB-CD2 4.01Å; A260-F277 HydrophobicContact CB-CE1 3.63Å; A260-F277 HydrophobicContact CB-CE2 4.19Å; A260-F277 HydrophobicContact CB-CG 3.64Å; A260-F277 HydrophobicContact CB-CZ 4.01Å
261	E	85.2	Confident	83.7	Confident	92 Å²	92	57.2 Å²	57.2	43%	0.43	28%	0.275	S	S	.	.	H	α-helix	trans	-70.1	-38	173.1	-166	59.6	-138.3	0	0	111.2	R257 L263 K264 F277	R257-E261 PolarHBondContact O-N 3.49Å; E261-L263 VanDerWaalsContact C-N 3.32Å; E261-L263 PolarHBondContact O-N 2.71Å; E261-K264 WeakPolarHBondContact O-CB 3.47Å; E261-K264 PolarHBondContact O-N 2.97Å; E261-K264 WeakPolarHBondContact OE1-CE 3.06Å; E261-K264 IonicContact OE1-NZ 2.74Å; E261-K264 PolarHBondContact OE1-NZ 3.33Å; E261-K264 WeakPolarHBondContact OE2-CD 3.45Å; E261-K264 WeakPolarHBondContact OE2-CE 3.44Å; E261-K264 IonicContact OE2-NZ 3.76Å; E261-K264 PolarHBondContact OE2-NZ 2.9Å; E261-F277 HydrophobicContact CB-CE1 4.03Å; E261-F277 HydrophobicContact CB-CZ 4.32Å; E261-F277 WeakPolarHBondContact OE2-CE1 3.25Å
262	M	84.1	Confident	84.7	Confident	61 Å²	61	53.2 Å²	53.2	30%	0.3	26%	0.255	S	S	.	.	H	α-helix	trans	-57.2	-44.7	167.7	179.9	-156.9	71.7	0	0	111.3	D258 E259 K264 T265 V336	D258-M262 PolarHBondContact O-N 3.41Å; D258-M262 VanDerWaalsContact O-N 3.16Å; E259-M262 HydrophobicContact CG-CE 4.39Å; E259-M262 WeakPolarHBondContact O-CB 3.14Å; E259-M262 PolarHBondContact O-N 2.99Å; M262-K264 VanDerWaalsContact C-N 3.31Å; M262-K264 PolarHBondContact O-N 3.02Å; M262-T265 WeakPolarHBondContact O-CB 3.32Å; M262-T265 PolarHBondContact O-N 3.28Å; M262-T265 VanDerWaalsContact O-N 3.09Å; M262-T265 PolarHBondContact O-OG1 3.3Å; M262-V336 HydrophobicContact CE-CG1 4.15Å; M262-V336 HydrophobicContact CE-CG2 3.95Å; M262-V336 HydrophobicContact SD-CG2 3.72Å
263	L	86.2	Confident	85.8	Confident	7 Å²	7	57.1 Å²	57.1	4%	0.037	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-35	178.4	-68	-179.9	0	0	0	113.2	E259 A260 E261 T265 L266 F274 L360	E259-L263 WeakPolarHBondContact O-CG 3.36Å; E259-L263 PolarHBondContact O-N 3.13Å; A260-L263 WeakPolarHBondContact O-CB 3.27Å; A260-L263 PolarHBondContact O-N 3.24Å; E261-L263 VanDerWaalsContact C-N 3.32Å; E261-L263 PolarHBondContact O-N 2.71Å; L263-T265 PolarHBondContact O-N 3.01Å; L263-L266 HydrophobicContact CD2-CD1 3.74Å; L263-L266 WeakPolarHBondContact O-CB 3.31Å; L263-L266 PolarHBondContact O-N 3.29Å; L263-F274 HydrophobicContact CB-CB 4.38Å; L263-F274 HydrophobicContact CB-CD1 4.26Å; L263-F274 HydrophobicContact CB-CD2 3.95Å; L263-F274 HydrophobicContact CB-CE2 4.23Å; L263-F274 HydrophobicContact CB-CG 3.96Å; L263-F274 HydrophobicContact CB-CZ 4.5Å; L263-F274 HydrophobicContact CD1-CD2 4.08Å; L263-F274 HydrophobicContact CD1-CE2 3.94Å; L263-L360 HydrophobicContact CD1-CB 4.49Å; L263-L360 HydrophobicContact CD2-CB 3.68Å; L263-L360 HydrophobicContact CD2-CD1 4.25Å
264	K	88.3	Confident	86.8	Confident	52 Å²	52	55.1 Å²	55.1	23%	0.226	26%	0.261	C	S	.	.	H	α-helix	trans	-59.7	-27.2	174.8	-73.2	167.4	59.3	176.8	0	113.2	A260 E261 M262 L266 H267 F274 D276 F277	A260-K264 PolarHBondContact O-N 3.4Å; A260-K264 VanDerWaalsContact O-N 3.14Å; E261-K264 WeakPolarHBondContact O-CB 3.47Å; E261-K264 PolarHBondContact O-N 2.97Å; E261-K264 WeakPolarHBondContact OE1-CE 3.06Å; E261-K264 IonicContact OE1-NZ 2.74Å; E261-K264 PolarHBondContact OE1-NZ 3.33Å; E261-K264 WeakPolarHBondContact OE2-CD 3.45Å; E261-K264 WeakPolarHBondContact OE2-CE 3.44Å; E261-K264 IonicContact OE2-NZ 3.76Å; E261-K264 PolarHBondContact OE2-NZ 2.9Å; M262-K264 VanDerWaalsContact C-N 3.31Å; M262-K264 PolarHBondContact O-N 3.02Å; K264-L266 VanDerWaalsContact C-N 3.33Å; K264-H267 PolarHBondContact O-CE1 3.33Å; K264-F274 HydrophobicContact CB-CD1 4.39Å; K264-F274 HydrophobicContact CD-CE1 4.31Å; K264-F274 HydrophobicContact CG-CD1 3.5Å; K264-F274 HydrophobicContact CG-CE1 3.59Å; K264-D276 WeakPolarHBondContact CD-OD1 3.18Å; K264-D276 WeakPolarHBondContact CE-OD1 3.49Å; K264-D276 IonicContact NZ-OD1 3.01Å; K264-D276 PolarHBondContact NZ-OD1 3.09Å; K264-F277 HydrophobicContact CD-CD1 3.72Å; K264-F277 HydrophobicContact CD-CE1 3.81Å; K264-F277 HydrophobicContact CG-CD1 4.5Å
265	T	87	Confident	87.5	Confident	93 Å²	93	53 Å²	53	57%	0.571	25%	0.249	S	C	*	.	H	α-helix	trans	-74.1	-22.7	176.8	74	0	0	0	0	113.2	M262 L263 H267	M262-T265 WeakPolarHBondContact O-CB 3.32Å; M262-T265 PolarHBondContact O-N 3.28Å; M262-T265 VanDerWaalsContact O-N 3.09Å; M262-T265 PolarHBondContact O-OG1 3.3Å; L263-T265 PolarHBondContact O-N 3.01Å; T265-H267 PolarHBondContact O-N 2.84Å; T265-H267 VanDerWaalsContact O-N 3.09Å; T265-H267 PolarHBondContact O-ND1 3.23Å
266	L	89.3	Confident	88.3	Confident	7 Å²	7	48.2 Å²	48.2	4%	0.037	24%	0.235	C	C	.	.			trans	-79.3	97.7	-166.7	-59.6	-176.8	0	0	0	113.1	L263 K264 F328 L329 R332 V336 L360	L263-L266 HydrophobicContact CD2-CD1 3.74Å; L263-L266 WeakPolarHBondContact O-CB 3.31Å; L263-L266 PolarHBondContact O-N 3.29Å; K264-L266 VanDerWaalsContact C-N 3.33Å; L266-F328 HydrophobicContact CB-CE1 4.25Å; L266-F328 HydrophobicContact CD2-CE1 4.13Å; L266-F328 HydrophobicContact CD2-CZ 4.46Å; L266-L329 HydrophobicContact CD1-CD2 3.86Å; L266-R332 HydrophobicContact CD2-CG 3.85Å; L266-V336 HydrophobicContact CD1-CG1 4.46Å; L266-L360 HydrophobicContact CD1-CD1 4.2Å
267	H	91.5	Very high	88.9	Confident	94 Å²	94	49.5 Å²	49.5	44%	0.435	24%	0.24	S	C	.	.			trans	-113.7	108.9	178.1	-68.9	79.3	0	0	0	111.6	K264 T265 R273 F328	K264-H267 PolarHBondContact O-CE1 3.33Å; T265-H267 PolarHBondContact O-N 2.84Å; T265-H267 VanDerWaalsContact O-N 3.09Å; T265-H267 PolarHBondContact O-ND1 3.23Å; H267-R273 PolarHBondContact CD2-NE 2.61Å; H267-R273 VanDerWaalsContact CD2-NE 3.33Å; H267-R273 PolarHBondContact CD2-NH2 3.04Å; H267-R273 PolarHBondContact NE2-NE 3.08Å; H267-R273 PolarHBondContact NE2-NH2 2.83Å; H267-F328 WeakPolarHBondContact O-CZ 3.48Å
268	H	93.8	Very high	89.4	Confident	42 Å²	42	46.2 Å²	46.2	19%	0.194	23%	0.228	C	C	.	.			trans	-154.5	138.9	176.1	179.1	-97.1	0	0	0	110.9	N270 I271 F328	H268-N270 PolarHBondContact ND1-N 2.58Å; H268-N270 VanDerWaalsContact ND1-N 3.2Å; H268-N270 PolarHBondContact O-N 2.71Å; H268-N270 VanDerWaalsContact O-N 3.1Å; H268-I271 HydrophobicContact CB-CB 4.29Å; H268-I271 HydrophobicContact CB-CG1 3.87Å; H268-I271 PolarHBondContact O-N 2.91Å; H268-F328 HydrophobicContact CB-CB 4.38Å; H268-F328 HydrophobicContact CB-CD1 3.57Å; H268-F328 HydrophobicContact CB-CD2 3.93Å; H268-F328 HydrophobicContact CB-CE1 3.71Å; H268-F328 HydrophobicContact CB-CE2 4.05Å; H268-F328 HydrophobicContact CB-CG 3.68Å; H268-F328 HydrophobicContact CB-CZ 3.95Å; H268-F328 AromaticContact CD2-CD2 3.84Å; H268-F328 AromaticContact CD2-CG 3.78Å; H268-F328 AromaticContact CG-CD1 3.99Å; H268-F328 AromaticContact CG-CG 3.7Å
269	P	93.7	Very high	89.6	Confident	92 Å²	92	43.1 Å²	43.1	60%	0.597	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-22	-173.5	22.7	-35.7	0	0	0	115.3	K356	P269-K356 VanDerWaalsContact O-CE 3.26Å; P269-K356 WeakPolarHBondContact O-CE 3.48Å
270	N	95.8	Very high	89.6	Confident	11 Å²	11	42.2 Å²	42.2	6%	0.059	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	18.1	174.4	-54.6	115.8	0	0	0	113.9	H268 Q321 V355 K356 I357	H268-N270 PolarHBondContact ND1-N 2.58Å; H268-N270 VanDerWaalsContact ND1-N 3.2Å; H268-N270 PolarHBondContact O-N 2.71Å; H268-N270 VanDerWaalsContact O-N 3.1Å; N270-Q321 VanDerWaalsContact CB-O 3.27Å; N270-Q321 WeakPolarHBondContact CB-O 3.46Å; N270-Q321 WeakPolarHBondContact ND2-CB 3.24Å; N270-Q321 PolarHBondContact ND2-OE1 2.76Å; N270-V355 WeakPolarHBondContact CA-O 3.47Å; N270-V355 WeakPolarHBondContact CB-O 3.44Å; N270-V355 PolarHBondContact ND2-O 3.47Å; N270-K356 WeakPolarHBondContact O-CA 3.24Å; N270-I357 PolarHBondContact O-N 2.92Å
271	I	94.4	Very high	89.2	Confident	3 Å²	3	46.4 Å²	46.4	2%	0.015	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-116.8	140	169.1	-58.1	-60.5	0	0	0	107.9	H268 R273 F328 L329 I357 L360	H268-I271 HydrophobicContact CB-CB 4.29Å; H268-I271 HydrophobicContact CB-CG1 3.87Å; H268-I271 PolarHBondContact O-N 2.91Å; I271-R273 PolarHBondContact O-N 3.38Å; I271-F328 HydrophobicContact CG1-CD1 4.17Å; I271-L329 HydrophobicContact CD1-CD1 3.79Å; I271-L329 HydrophobicContact CD1-CD2 4.22Å; I271-L329 HydrophobicContact CD1-CG 3.96Å; I271-I357 WeakPolarHBondContact CA-O 3.43Å; I271-I357 HydrophobicContact CD1-CB 3.99Å; I271-I357 HydrophobicContact CD1-CD1 4.21Å; I271-I357 HydrophobicContact CD1-CG1 4.41Å; I271-L360 HydrophobicContact CG2-CD1 3.66Å
272	V	93.7	Very high	88.2	Confident	17 Å²	17	45.3 Å²	45.3	10%	0.103	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-67.7	119.6	173.3	175.1	0	0	0	0	107.9	F274 E293 M295 F347 K356 I357	V272-F274 PolarHBondContact O-N 3.11Å; V272-E293 HydrophobicContact CG1-CB 4.03Å; V272-M295 HydrophobicContact CG1-CG 4.33Å; V272-M295 HydrophobicContact CG2-CG 3.97Å; V272-M295 HydrophobicContact CG2-SD 4.14Å; V272-F347 HydrophobicContact CG2-CD2 3.83Å; V272-F347 HydrophobicContact CG2-CE2 4.45Å; V272-F347 HydrophobicContact CG2-CG 4.45Å; V272-K356 HydrophobicContact CG2-CB 3.68Å; V272-I357 PolarHBondContact N-O 3.46Å
273	R	92.3	Very high	87.3	Confident	110 Å²	110	45.8 Å²	45.8	42%	0.415	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-63.2	128.5	-173.7	-170.8	175	-171.7	-172.6	3	111.1	H267 I271 Y275 T292 E293	H267-R273 PolarHBondContact CD2-NE 2.61Å; H267-R273 VanDerWaalsContact CD2-NE 3.33Å; H267-R273 PolarHBondContact CD2-NH2 3.04Å; H267-R273 PolarHBondContact NE2-NE 3.08Å; H267-R273 PolarHBondContact NE2-NH2 2.83Å; I271-R273 PolarHBondContact O-N 3.38Å; R273-Y275 HydrophobicContact CG-CE1 4.26Å; R273-T292 CarbonylContact O-C 3.49Å; R273-T292 VanDerWaalsContact O-CA 3.22Å; R273-T292 WeakPolarHBondContact O-CA 3.43Å; R273-T292 WeakPolarHBondContact O-CB 3.33Å; R273-E293 HydrophobicContact CB-CB 4.17Å; R273-E293 PolarHBondContact N-OE2 3.49Å; R273-E293 PolarHBondContact O-N 2.95Å
274	F	92.4	Very high	86.3	Confident	18 Å²	18	56 Å²	56	8%	0.079	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	132	167.2	-163.4	-80	0	0	0	108.2	A260 L263 K264 V272 F277 L290 T292	A260-F274 HydrophobicContact CB-CZ 4.28Å; L263-F274 HydrophobicContact CB-CB 4.38Å; L263-F274 HydrophobicContact CB-CD1 4.26Å; L263-F274 HydrophobicContact CB-CD2 3.95Å; L263-F274 HydrophobicContact CB-CE2 4.23Å; L263-F274 HydrophobicContact CB-CG 3.96Å; L263-F274 HydrophobicContact CB-CZ 4.5Å; L263-F274 HydrophobicContact CD1-CD2 4.08Å; L263-F274 HydrophobicContact CD1-CE2 3.94Å; K264-F274 HydrophobicContact CB-CD1 4.39Å; K264-F274 HydrophobicContact CD-CE1 4.31Å; K264-F274 HydrophobicContact CG-CD1 3.5Å; K264-F274 HydrophobicContact CG-CE1 3.59Å; V272-F274 PolarHBondContact O-N 3.11Å; F274-F277 HydrophobicContact CE1-CB 4.28Å; F274-F277 HydrophobicContact CE1-CD1 4.18Å; F274-F277 HydrophobicContact CZ-CB 4.06Å; F274-F277 HydrophobicContact CZ-CD1 4.45Å; F274-L290 HydrophobicContact CE2-CB 4.05Å; F274-L290 HydrophobicContact CE2-CD1 4.46Å; F274-L290 HydrophobicContact CE2-CD2 4.11Å; F274-L290 HydrophobicContact CE2-CG 4.44Å; F274-L290 HydrophobicContact CZ-CB 4.18Å; F274-L290 HydrophobicContact CZ-CD2 3.85Å; F274-T292 HydrophobicContact CD2-CG2 3.96Å
275	Y	92.5	Very high	85.3	Confident	47 Å²	47	60.7 Å²	60.7	18%	0.184	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-58.3	-179.2	-67.9	-75.3	0	0	0	111.6	F211 V238 R273 V291 E293	F211-Y275 HydrophobicContact CE1-CG 4.45Å; F211-Y275 HydrophobicContact CZ-CG 4.41Å; V238-Y275 HydrophobicContact CG1-CD2 4.06Å; V238-Y275 HydrophobicContact CG1-CE2 3.77Å; R273-Y275 HydrophobicContact CG-CE1 4.26Å; Y275-V291 HydrophobicContact CD2-CG1 4.17Å; Y275-V291 PolarHBondContact N-O 2.95Å; Y275-E293 HydrophobicContact CE2-CB 4.34Å
276	D	91.9	Very high	84.6	Confident	42 Å²	42	62.2 Å²	62.2	23%	0.225	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	171.3	-177.6	-144.1	-14.4	0	0	0	113.4	F211 K264 V291	F211-D276 HydrophobicContact CE2-CB 3.96Å; K264-D276 WeakPolarHBondContact CD-OD1 3.18Å; K264-D276 WeakPolarHBondContact CE-OD1 3.49Å; K264-D276 IonicContact NZ-OD1 3.01Å; K264-D276 PolarHBondContact NZ-OD1 3.09Å; D276-V291 PolarHBondContact O-N 3.43Å
277	F	90.5	Very high	84.2	Confident	30 Å²	30	62.4 Å²	62.4	13%	0.132	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	155.2	172.6	73.7	-83.9	0	0	0	112.7	R257 A260 E261 K264 F274 V289 L290	R257-F277 HydrophobicContact CB-CE2 4.08Å; R257-F277 HydrophobicContact CB-CZ 4.32Å; R257-F277 HydrophobicContact CG-CE2 3.96Å; A260-F277 HydrophobicContact CB-CB 4.33Å; A260-F277 HydrophobicContact CB-CD1 3.43Å; A260-F277 VanDerWaalsContact CB-CD1 3.43Å; A260-F277 HydrophobicContact CB-CD2 4.01Å; A260-F277 HydrophobicContact CB-CE1 3.63Å; A260-F277 HydrophobicContact CB-CE2 4.19Å; A260-F277 HydrophobicContact CB-CG 3.64Å; A260-F277 HydrophobicContact CB-CZ 4.01Å; E261-F277 HydrophobicContact CB-CE1 4.03Å; E261-F277 HydrophobicContact CB-CZ 4.32Å; E261-F277 WeakPolarHBondContact OE2-CE1 3.25Å; K264-F277 HydrophobicContact CD-CD1 3.72Å; K264-F277 HydrophobicContact CD-CE1 3.81Å; K264-F277 HydrophobicContact CG-CD1 4.5Å; F274-F277 HydrophobicContact CE1-CB 4.28Å; F274-F277 HydrophobicContact CE1-CD1 4.18Å; F274-F277 HydrophobicContact CZ-CB 4.06Å; F274-F277 HydrophobicContact CZ-CD1 4.45Å; F277-V289 WeakPolarHBondContact CA-O 3.45Å; F277-V289 VanDerWaalsContact CB-O 3.3Å; F277-V289 WeakPolarHBondContact CB-O 3.49Å; F277-L290 HydrophobicContact CB-CD2 3.81Å
278	W	89.6	Confident	83.8	Confident	27 Å²	27	58 Å²	58	10%	0.102	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	160.4	169.4	61.5	92.4	0	0	0	111.9	V207 F211 W240 V289 V291	V207-W278 HydrophobicContact CG2-CB 4.16Å; V207-W278 HydrophobicContact CG2-CG 3.9Å; F211-W278 HydrophobicContact CB-CH2 4.42Å; F211-W278 HydrophobicContact CD2-CH2 4.35Å; F211-W278 HydrophobicContact CD2-CZ3 4.12Å; W240-W278 HydrophobicContact CE3-CH2 4.18Å; W240-W278 HydrophobicContact CE3-CZ2 4.23Å; W240-W278 HydrophobicContact CH2-CH2 4.21Å; W240-W278 AromaticContact CH2-CZ2 3.52Å; W240-W278 HydrophobicContact CH2-CZ2 3.52Å; W240-W278 AromaticContact CZ2-CZ2 3.91Å; W240-W278 HydrophobicContact CZ2-CZ2 3.91Å; W240-W278 AromaticContact CZ3-CH2 3.87Å; W240-W278 HydrophobicContact CZ3-CH2 3.87Å; W240-W278 AromaticContact CZ3-CZ2 3.67Å; W240-W278 HydrophobicContact CZ3-CZ2 3.67Å; W278-V289 HydrophobicContact CD2-CB 4.25Å; W278-V289 HydrophobicContact CH2-CB 4.42Å; W278-V289 HydrophobicContact CH2-CG1 3.74Å; W278-V289 HydrophobicContact CZ2-CB 3.88Å; W278-V289 HydrophobicContact CZ2-CG1 3.51Å; W278-V289 HydrophobicContact CZ2-CG2 4.34Å; W278-V289 HydrophobicContact CZ3-CG1 4.39Å; W278-V289 PolarHBondContact N-O 2.95Å; W278-V289 VanDerWaalsContact N-O 3.09Å; W278-V289 PolarHBondContact O-N 3.35Å; W278-V291 HydrophobicContact CH2-CG2 3.44Å; W278-V291 VanDerWaalsContact CH2-CG2 3.44Å; W278-V291 HydrophobicContact CZ3-CG2 3.55Å
279	D	85.2	Confident	83.6	Confident	25 Å²	25	56 Å²	56	13%	0.134	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122.5	176.2	-59.5	-3.9	0	0	0	110.9	R253 R257 N281	R253-D279 WeakPolarHBondContact CD-OD2 3.39Å; R253-D279 IonicContact NE-OD2 2.88Å; R257-D279 IonicContact CZ-OD2 3.38Å; R257-D279 IonicContact NE-OD1 3.83Å; R257-D279 IonicContact NE-OD2 3.61Å; R257-D279 PolarHBondContact NE-OD2 3.19Å; R257-D279 IonicContact NH2-OD2 3.12Å; R257-D279 PolarHBondContact NH2-OD2 3.1Å; D279-N281 WeakPolarHBondContact CB-ND2 3.32Å; D279-N281 PolarHBondContact O-N 3.34Å
280	I	81.5	Confident	83.5	Confident	17 Å²	17	52 Å²	52	9%	0.087	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	109.8	166.5	-64.7	-179.6	0	0	0	108.4	W240 A282 K286 C287 V289	W240-I280 HydrophobicContact CZ2-CD1 4.37Å; I280-A282 HydrophobicContact CG2-CB 3.88Å; I280-K286 WeakPolarHBondContact O-CA 3.33Å; I280-C287 PolarHBondContact N-O 3.01Å; I280-C287 PolarHBondContact O-N 3.27Å; I280-V289 HydrophobicContact CD1-CG2 3.51Å; I280-V289 HydrophobicContact CG1-CG2 3.92Å
281	N	74.9	Confident	83.4	Confident	87 Å²	87	51.5 Å²	51.5	47%	0.465	26%	0.26	S	S	.	.			trans	-104.6	25.3	175.8	-78.6	-84.4	0	0	0	112.7	D279 G283	D279-N281 WeakPolarHBondContact CB-ND2 3.32Å; D279-N281 PolarHBondContact O-N 3.34Å; N281-G283 PolarHBondContact O-N 2.86Å
282	A	63.4	Low	83.3	Confident	69 Å²	69	52.6 Å²	52.6	57%	0.57	27%	0.266	S	S	*	.			trans	-80.6	102.2	-170.4	0	0	0	0	0	113.1	I280 K284 R285	I280-A282 HydrophobicContact CG2-CB 3.88Å; A282-K284 PolarHBondContact O-N 3.45Å; A282-R285 PolarHBondContact N-O 3.12Å; A282-R285 PolarHBondContact O-N 3.26Å; A282-R285 VanDerWaalsContact O-N 3.13Å
283	G	65.9	Low	83.3	Confident	71 Å²	71	53.9 Å²	53.9	73%	0.732	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	-122	172.5	0	0	0	0	0	112.8	N281 R285	N281-G283 PolarHBondContact O-N 2.86Å; G283-R285 VanDerWaalsContact C-N 3.33Å
284	K	63.9	Low	83.2	Confident	221 Å²	221	50 Å²	50	96%	0.961	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-8.1	178	-66.1	-175.5	-178.9	178.1	0	113.7	A282	A282-K284 PolarHBondContact O-N 3.45Å
285	R	67.2	Low	83.2	Confident	151 Å²	151	49.9 Å²	49.9	57%	0.57	26%	0.258	S	S	*	.			trans	-98.3	117.5	176.8	-76.2	-167.8	-89	143	-7.7	110	D204 A282 G283	D204-R285 IonicContact OD2-NH1 2.83Å; A282-R285 PolarHBondContact N-O 3.12Å; A282-R285 PolarHBondContact O-N 3.26Å; A282-R285 VanDerWaalsContact O-N 3.13Å; G283-R285 VanDerWaalsContact C-N 3.33Å
286	K	73.7	Confident	82.9	Confident	125 Å²	125	50.6 Å²	50.6	54%	0.543	27%	0.268	S	S	.	.			trans	-120.4	111.3	170.4	-74.6	-172.6	178.5	179.3	0	107.9	E245 I280	E245-K286 HydrophobicContact CB-CB 4.35Å; E245-K286 VanDerWaalsContact CB-O 3.28Å; E245-K286 WeakPolarHBondContact CB-O 3.42Å; E245-K286 WeakPolarHBondContact OE2-CB 3.36Å; I280-K286 WeakPolarHBondContact O-CA 3.33Å
287	C	80.4	Confident	82.6	Confident	12 Å²	12	48.6 Å²	48.6	8%	0.081	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	149.4	-178.4	48.2	0	0	0	0	110.7	L243 E245 I280	L243-C287 WeakPolarHBondContact O-CA 3.36Å; L243-C287 WeakPolarHBondContact O-CB 3.26Å; E245-C287 PolarHBondContact OE2-N 3.21Å; I280-C287 PolarHBondContact N-O 3.01Å; I280-C287 PolarHBondContact O-N 3.27Å
288	I	83.6	Confident	82.4	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	130.1	171.7	-46.9	179.2	0	0	0	107.6	L243 R253 F256	L243-I288 HydrophobicContact CB-CB 4.37Å; L243-I288 WeakPolarHBondContact CB-O 3.46Å; L243-I288 HydrophobicContact CD1-CB 4.27Å; L243-I288 PolarHBondContact N-O 2.75Å; L243-I288 PolarHBondContact O-N 3.18Å; R253-I288 HydrophobicContact CG-CD1 4.48Å; F256-I288 HydrophobicContact CD1-CD1 3.65Å; F256-I288 HydrophobicContact CD1-CG2 4.39Å; F256-I288 HydrophobicContact CE1-CB 4.45Å; F256-I288 HydrophobicContact CE1-CD1 4.09Å; F256-I288 HydrophobicContact CE1-CG2 3.93Å
289	V	89.8	Confident	82.6	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	137.1	175.7	-178.8	0	0	0	0	109.2	W240 C241 E242 F277 W278 I280 V291	W240-V289 HydrophobicContact CD2-CG1 3.82Å; W240-V289 HydrophobicContact CE3-CG1 4.45Å; W240-V289 HydrophobicContact CG-CG1 4.07Å; W240-V289 HydrophobicContact CZ2-CG1 4.14Å; W240-V289 HydrophobicContact CZ2-CG2 4.2Å; C241-V289 CarbonylContact O-C 3.53Å; C241-V289 WeakPolarHBondContact O-CA 3.44Å; E242-V289 HydrophobicContact CG-CG2 4.44Å; F277-V289 WeakPolarHBondContact CA-O 3.45Å; F277-V289 VanDerWaalsContact CB-O 3.3Å; F277-V289 WeakPolarHBondContact CB-O 3.49Å; W278-V289 HydrophobicContact CD2-CB 4.25Å; W278-V289 HydrophobicContact CH2-CB 4.42Å; W278-V289 HydrophobicContact CH2-CG1 3.74Å; W278-V289 HydrophobicContact CZ2-CB 3.88Å; W278-V289 HydrophobicContact CZ2-CG1 3.51Å; W278-V289 HydrophobicContact CZ2-CG2 4.34Å; W278-V289 HydrophobicContact CZ3-CG1 4.39Å; W278-V289 PolarHBondContact N-O 2.95Å; W278-V289 VanDerWaalsContact N-O 3.09Å; W278-V289 PolarHBondContact O-N 3.35Å; I280-V289 HydrophobicContact CD1-CG2 3.51Å; I280-V289 HydrophobicContact CG1-CG2 3.92Å; V289-V291 HydrophobicContact CG1-CG2 4.37Å
290	L	89.9	Confident	82.9	Confident	9 Å²	9	46.3 Å²	46.3	5%	0.047	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136.9	169.5	-42.8	169.6	0	0	0	108.1	C241 L243 F256 F274 F277 L362	C241-L290 HydrophobicContact CB-CB 4.18Å; C241-L290 PolarHBondContact N-O 3Å; C241-L290 PolarHBondContact O-N 2.82Å; L243-L290 HydrophobicContact CD1-CD1 3.86Å; L243-L290 HydrophobicContact CD1-CD2 4.35Å; L243-L290 HydrophobicContact CD1-CG 4.12Å; L243-L290 HydrophobicContact CG-CD1 4.34Å; F256-L290 HydrophobicContact CE1-CD2 3.87Å; F256-L290 HydrophobicContact CZ-CD1 4.23Å; F256-L290 HydrophobicContact CZ-CD2 3.74Å; F274-L290 HydrophobicContact CE2-CB 4.05Å; F274-L290 HydrophobicContact CE2-CD1 4.46Å; F274-L290 HydrophobicContact CE2-CD2 4.11Å; F274-L290 HydrophobicContact CE2-CG 4.44Å; F274-L290 HydrophobicContact CZ-CB 4.18Å; F274-L290 HydrophobicContact CZ-CD2 3.85Å; F277-L290 HydrophobicContact CB-CD2 3.81Å; L290-L362 HydrophobicContact CD1-CD2 4Å
291	V	93.8	Very high	83.5	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.5	174.9	-175.5	0	0	0	0	109.5	F211 V238 A239 Y275 D276 W278 V289	F211-V291 HydrophobicContact CB-CG2 4.4Å; F211-V291 HydrophobicContact CD1-CG1 3.75Å; F211-V291 HydrophobicContact CD2-CG1 4.49Å; F211-V291 HydrophobicContact CD2-CG2 4.17Å; F211-V291 HydrophobicContact CE1-CG1 3.89Å; F211-V291 HydrophobicContact CG-CG1 4.07Å; F211-V291 HydrophobicContact CG-CG2 4.17Å; F211-V291 HydrophobicContact CZ-CG1 4.32Å; V238-V291 HydrophobicContact CB-CG1 3.74Å; V238-V291 HydrophobicContact CG1-CG1 4.16Å; V238-V291 HydrophobicContact CG2-CG1 3.67Å; A239-V291 WeakPolarHBondContact O-CA 3.26Å; Y275-V291 HydrophobicContact CD2-CG1 4.17Å; Y275-V291 PolarHBondContact N-O 2.95Å; D276-V291 PolarHBondContact O-N 3.43Å; W278-V291 HydrophobicContact CH2-CG2 3.44Å; W278-V291 VanDerWaalsContact CH2-CG2 3.44Å; W278-V291 HydrophobicContact CZ3-CG2 3.55Å; V289-V291 HydrophobicContact CG1-CG2 4.37Å
292	T	93.6	Very high	84.2	Confident	26 Å²	26	46.1 Å²	46.1	16%	0.16	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	170.5	179.5	72.5	0	0	0	0	112.1	V238 A239 R273 F274	V238-T292 WeakPolarHBondContact CB-O 3.29Å; A239-T292 PolarHBondContact N-O 3.34Å; A239-T292 PolarHBondContact O-N 3.44Å; R273-T292 CarbonylContact O-C 3.49Å; R273-T292 VanDerWaalsContact O-CA 3.22Å; R273-T292 WeakPolarHBondContact O-CA 3.43Å; R273-T292 WeakPolarHBondContact O-CB 3.33Å; F274-T292 HydrophobicContact CD2-CG2 3.96Å
293	E	92.7	Very high	85.5	Confident	44 Å²	44	42.8 Å²	42.8	21%	0.206	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	140.1	168.5	-176.5	177.9	-175.4	0	0	111.9	V272 R273 Y275 M295 K356	V272-E293 HydrophobicContact CG1-CB 4.03Å; R273-E293 HydrophobicContact CB-CB 4.17Å; R273-E293 PolarHBondContact N-OE2 3.49Å; R273-E293 PolarHBondContact O-N 2.95Å; Y275-E293 HydrophobicContact CE2-CB 4.34Å; E293-M295 HydrophobicContact CG-SD 4Å; E293-K356 IonicContact OE1-NZ 3.35Å; E293-K356 PolarHBondContact OE1-NZ 2.97Å; E293-K356 IonicContact OE2-NZ 3.88Å; E293-K356 PolarHBondContact OE2-NZ 2.96Å
294	L	91.7	Very high	86.8	Confident	27 Å²	27	39.8 Å²	39.8	14%	0.141	19%	0.187	C	C	.	.			trans	-89.3	105.8	179	178.3	56	0	0	0	111.4	W122 I218 R228 Y237 A239 T296	W122-L294 HydrophobicContact CH2-CD1 4.41Å; I218-L294 HydrophobicContact CD1-CD1 3.39Å; I218-L294 HydrophobicContact CG1-CD1 4.45Å; R228-L294 HydrophobicContact CG-CD2 4.25Å; Y237-L294 WeakPolarHBondContact O-CB 3.45Å; A239-L294 HydrophobicContact CB-CD1 4.31Å; L294-T296 HydrophobicContact CG-CG2 4.36Å; L294-T296 PolarHBondContact O-N 3.1Å
295	M	91.3	Very high	88	Confident	16 Å²	16	34 Å²	34	8%	0.079	16%	0.162	C	C	.	.			trans	-85	98.4	178.8	-56.5	-52.6	-58.4	0	0	111.6	V272 E293 F347 T349 K356	V272-M295 HydrophobicContact CG1-CG 4.33Å; V272-M295 HydrophobicContact CG2-CG 3.97Å; V272-M295 HydrophobicContact CG2-SD 4.14Å; E293-M295 HydrophobicContact CG-SD 4Å; M295-F347 HydrophobicContact CB-CB 3.76Å; M295-F347 HydrophobicContact CB-CD1 3.47Å; M295-F347 VanDerWaalsContact CB-CD1 3.47Å; M295-F347 HydrophobicContact CB-CE1 4.27Å; M295-F347 HydrophobicContact CB-CG 3.78Å; M295-F347 HydrophobicContact CE-CB 3.78Å; M295-F347 HydrophobicContact CG-CB 3.62Å; M295-F347 HydrophobicContact CG-CD1 3.84Å; M295-F347 HydrophobicContact CG-CD2 4.29Å; M295-F347 HydrophobicContact CG-CG 3.66Å; M295-F347 HydrophobicContact SD-CB 4.43Å; M295-T349 WeakPolarHBondContact CE-OG1 3.4Å; M295-K356 HydrophobicContact CE-CB 4.2Å; M295-K356 HydrophobicContact CE-CD 3.9Å; M295-K356 HydrophobicContact CE-CG 4.17Å; M295-K356 HydrophobicContact SD-CD 4.02Å
296	T	85.6	Confident	88.9	Confident	62 Å²	62	30.8 Å²	30.8	38%	0.38	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-31.7	-172.9	48.6	0	0	0	0	115	W122 L294 G298	W122-T296 HydrophobicContact CZ3-CG2 4.27Å; L294-T296 HydrophobicContact CG-CG2 4.36Å; L294-T296 PolarHBondContact O-N 3.1Å; T296-G298 VanDerWaalsContact C-N 3.25Å; T296-G298 PolarHBondContact O-N 2.76Å
297	S	85.6	Confident	89.4	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.007	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	1.6	-172.1	-22.7	0	0	0	0	113.4	E119 I348 G350	E119-S297 WeakPolarHBondContact OE1-CB 3.5Å; E119-S297 PolarHBondContact OE1-OG 3.48Å; S297-I348 VanDerWaalsContact CB-O 3.29Å; S297-I348 WeakPolarHBondContact CB-O 3.43Å; S297-I348 PolarHBondContact OG-O 2.73Å; S297-G350 WeakPolarHBondContact OG-CA 3.49Å; S297-G350 PolarHBondContact OG-N 2.62Å
298	G	87.5	Confident	89.2	Confident	6 Å²	6	33.8 Å²	33.8	6%	0.062	16%	0.161	C	C	.	.			trans	81.1	-161.1	176.9	0	0	0	0	0	114.2	T296 F347 I348	T296-G298 VanDerWaalsContact C-N 3.25Å; T296-G298 PolarHBondContact O-N 2.76Å; G298-F347 WeakPolarHBondContact O-CA 3.48Å; G298-I348 PolarHBondContact O-N 3.39Å
299	T	92.4	Very high	89.2	Confident	28 Å²	28	42 Å²	42	17%	0.172	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-102.3	157.1	-171.8	65.5	0	0	0	0	112	K301 L302 Y303 D344 I346 F347	T299-K301 PolarHBondContact O-N 3.32Å; T299-L302 WeakPolarHBondContact O-CA 3.4Å; T299-L302 WeakPolarHBondContact O-CB 3.5Å; T299-L302 PolarHBondContact O-N 3.29Å; T299-L302 PolarHBondContact OG1-N 2.75Å; T299-Y303 PolarHBondContact O-N 3.17Å; T299-D344 WeakPolarHBondContact CG2-O 3.44Å; T299-I346 CarbonylContact C-O 3.59Å; T299-I346 WeakPolarHBondContact CA-O 3.38Å; T299-F347 HydrophobicContact CG2-CD1 3.85Å; T299-F347 HydrophobicContact CG2-CE1 3.68Å; T299-F347 HydrophobicContact CG2-CZ 4.31Å
300	L	93.1	Very high	89.1	Confident	0 Å²	0	43 Å²	43	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-56.6	-36.5	176	178.5	58	0	0	0	111.8	L302 Y303 I304 I310 W318 I322 C343 I346 M406	L300-L302 PolarHBondContact O-N 3.21Å; L300-Y303 VanDerWaalsContact O-CB 3.3Å; L300-Y303 WeakPolarHBondContact O-CB 3.49Å; L300-Y303 PolarHBondContact O-N 3.46Å; L300-I304 HydrophobicContact CD1-CD1 4.35Å; L300-I304 HydrophobicContact CD1-CG1 4.46Å; L300-I304 HydrophobicContact CG-CD1 4.06Å; L300-I304 VanDerWaalsContact O-CG1 3.31Å; L300-I304 WeakPolarHBondContact O-CG1 3.44Å; L300-I304 PolarHBondContact O-N 3.1Å; L300-I310 HydrophobicContact CD1-CD1 4.5Å; L300-W318 HydrophobicContact CD1-CE3 3.57Å; L300-W318 HydrophobicContact CD1-CH2 4.48Å; L300-W318 HydrophobicContact CD1-CZ3 3.54Å; L300-I322 HydrophobicContact CD2-CD1 4.48Å; L300-C343 HydrophobicContact CB-CB 4.13Å; L300-C343 HydrophobicContact CD2-CB 4.2Å; L300-C343 HydrophobicContact CG-CB 4.07Å; L300-C343 PolarHBondContact N-O 2.87Å; L300-I346 HydrophobicContact CB-CB 4.18Å; L300-I346 HydrophobicContact CB-CG2 4.18Å; L300-I346 HydrophobicContact CD2-CB 4.26Å; L300-I346 HydrophobicContact CD2-CD1 4.23Å; L300-I346 HydrophobicContact CD2-CG2 4.02Å; L300-I346 PolarHBondContact N-O 3.5Å; L300-M406 HydrophobicContact CD1-CG 4.09Å; L300-M406 HydrophobicContact CD1-SD 3.91Å; L300-M406 HydrophobicContact CD2-CE 4.09Å; L300-M406 HydrophobicContact CD2-CG 4.01Å; L300-M406 HydrophobicContact CD2-SD 3.71Å; L300-M406 HydrophobicContact CG-CG 4.27Å; L300-M406 HydrophobicContact CG-SD 4.32Å
301	K	92.5	Very high	88.9	Confident	50 Å²	50	46.9 Å²	46.9	22%	0.217	22%	0.223	C	C	.	.	H	α-helix	trans	-64.9	-37.5	173.3	-165.1	178.2	-150.1	172.4	0	113	T299 Y303 K305 C343 D344	T299-K301 PolarHBondContact O-N 3.32Å; K301-Y303 VanDerWaalsContact C-N 3.28Å; K301-Y303 PolarHBondContact O-N 3.47Å; K301-K305 WeakPolarHBondContact O-CB 3.47Å; K301-K305 PolarHBondContact O-N 3Å; K301-C343 HydrophobicContact CB-CB 3.95Å; K301-C343 WeakPolarHBondContact CB-O 3.48Å; K301-C343 PolarHBondContact N-O 3.2Å; K301-D344 WeakPolarHBondContact CD-OD1 3.27Å; K301-D344 VanDerWaalsContact CD-OD2 3.26Å; K301-D344 WeakPolarHBondContact CD-OD2 3.45Å; K301-D344 IonicContact NZ-OD1 2.72Å; K301-D344 IonicContact NZ-OD2 3.93Å; K301-D344 PolarHBondContact NZ-OD2 3.33Å
302	L	90.5	Very high	88.6	Confident	49 Å²	49	49.7 Å²	49.7	26%	0.257	24%	0.24	S	C	.	.	H	α-helix	trans	-65.8	-34.4	173.8	-175.5	63.7	0	0	0	111.3	L118 T299 L300 R306	L118-L302 HydrophobicContact CD2-CD2 4.25Å; L118-L302 HydrophobicContact CD2-CG 3.99Å; T299-L302 WeakPolarHBondContact O-CA 3.4Å; T299-L302 WeakPolarHBondContact O-CB 3.5Å; T299-L302 PolarHBondContact O-N 3.29Å; T299-L302 PolarHBondContact OG1-N 2.75Å; L300-L302 PolarHBondContact O-N 3.21Å; L302-R306 WeakPolarHBondContact O-CB 3.3Å; L302-R306 PolarHBondContact O-N 3.31Å
303	Y	91.3	Very high	88.2	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.2	-54.9	173.2	-165.9	-82.4	0	0	0	112.2	E111 R114 I115 L118 T299 L300 K301 K305 R306 F307 I310 W318 I348	E111-Y303 PolarHBondContact OE1-OH 3.1Å; E111-Y303 PolarHBondContact OE2-OH 3.4Å; R114-Y303 HydrophobicContact CB-CE2 4.42Å; R114-Y303 WeakPolarHBondContact CB-OH 3.24Å; R114-Y303 WeakPolarHBondContact CD-OH 3.47Å; I115-Y303 HydrophobicContact CG1-CD2 4.38Å; I115-Y303 HydrophobicContact CG1-CE2 3.73Å; L118-Y303 HydrophobicContact CD1-CD2 3.26Å; L118-Y303 HydrophobicContact CD1-CE2 3.9Å; L118-Y303 HydrophobicContact CD1-CG 4.08Å; T299-Y303 PolarHBondContact O-N 3.17Å; L300-Y303 VanDerWaalsContact O-CB 3.3Å; L300-Y303 WeakPolarHBondContact O-CB 3.49Å; L300-Y303 PolarHBondContact O-N 3.46Å; K301-Y303 VanDerWaalsContact C-N 3.28Å; K301-Y303 PolarHBondContact O-N 3.47Å; Y303-K305 VanDerWaalsContact C-N 3.31Å; Y303-K305 PolarHBondContact O-N 2.89Å; Y303-R306 PolarHBondContact O-N 3.07Å; Y303-F307 HydrophobicContact CD1-CD2 4.02Å; Y303-F307 AromaticContact CD2-CD2 3.93Å; Y303-F307 HydrophobicContact CD2-CD2 3.93Å; Y303-F307 HydrophobicContact CD2-CE2 4.08Å; Y303-F307 HydrophobicContact CE1-CB 4.16Å; Y303-F307 AromaticContact CE1-CD2 3.7Å; Y303-F307 HydrophobicContact CE1-CD2 3.7Å; Y303-F307 HydrophobicContact CE1-CG 4.3Å; Y303-F307 AromaticContact CE2-CD2 3.54Å; Y303-F307 HydrophobicContact CE2-CD2 3.54Å; Y303-F307 AromaticContact CE2-CE2 3.63Å; Y303-F307 HydrophobicContact CE2-CE2 3.63Å; Y303-F307 HydrophobicContact CG-CD2 4.11Å; Y303-F307 AromaticContact CZ-CD2 3.41Å; Y303-F307 VanDerWaalsContact CZ-CD2 3.41Å; Y303-F307 AromaticContact CZ-CE2 3.92Å; Y303-F307 PolarHBondContact O-N 3.48Å; Y303-I310 HydrophobicContact CD1-CD1 4.38Å; Y303-I310 HydrophobicContact CD1-CG1 4.21Å; Y303-I310 HydrophobicContact CE1-CG1 4.13Å; Y303-W318 AromaticContact CD1-CH2 3.69Å; Y303-W318 HydrophobicContact CD1-CH2 3.69Å; Y303-W318 AromaticContact CD1-CZ3 3.85Å; Y303-W318 HydrophobicContact CD1-CZ3 3.85Å; Y303-W318 AromaticContact CD2-CH2 3.94Å; Y303-W318 HydrophobicContact CD2-CH2 3.94Å; Y303-W318 AromaticContact CE1-CH2 3.7Å; Y303-W318 HydrophobicContact CE1-CH2 3.7Å; Y303-W318 HydrophobicContact CE1-CZ3 4.07Å; Y303-W318 HydrophobicContact CE2-CH2 4.01Å; Y303-W318 AromaticContact CG-CH2 3.83Å; Y303-W318 HydrophobicContact CG-CH2 3.83Å; Y303-W318 HydrophobicContact CG-CZ3 4.26Å; Y303-W318 AromaticContact CZ-CH2 3.9Å; Y303-I348 HydrophobicContact CD2-CD1 3.64Å; Y303-I348 HydrophobicContact CG-CD1 3.77Å
304	I	91.9	Very high	88	Confident	7 Å²	7	52.4 Å²	52.4	4%	0.036	25%	0.25	C	C	.	.	H	α-helix	trans	-54.1	-49	178.1	-66.6	162.8	0	0	0	110.1	L300 R306 F307 K308 I310 C343 E405 M406	L300-I304 HydrophobicContact CD1-CD1 4.35Å; L300-I304 HydrophobicContact CD1-CG1 4.46Å; L300-I304 HydrophobicContact CG-CD1 4.06Å; L300-I304 VanDerWaalsContact O-CG1 3.31Å; L300-I304 WeakPolarHBondContact O-CG1 3.44Å; L300-I304 PolarHBondContact O-N 3.1Å; I304-R306 PolarHBondContact O-N 3.41Å; I304-F307 PolarHBondContact O-N 2.98Å; I304-K308 WeakPolarHBondContact O-CA 3.27Å; I304-K308 PolarHBondContact O-N 3.25Å; I304-I310 HydrophobicContact CG1-CD1 3.76Å; I304-C343 HydrophobicContact CD1-CB 4.34Å; I304-E405 HydrophobicContact CD1-CB 4.44Å; I304-E405 HydrophobicContact CD1-CG 4.02Å; I304-M406 HydrophobicContact CD1-CG 3.9Å
305	K	89.6	Confident	88	Confident	101 Å²	101	51.1 Å²	51.1	44%	0.439	24%	0.243	S	C	.	.	H	α-helix	trans	-59.1	-27.8	178	178.6	168.3	175.7	162.8	0	114.1	K301 Y303 Y852	K301-K305 WeakPolarHBondContact O-CB 3.47Å; K301-K305 PolarHBondContact O-N 3Å; Y303-K305 VanDerWaalsContact C-N 3.31Å; Y303-K305 PolarHBondContact O-N 2.89Å; K305-Y852 PolarHBondContact NZ-OH 3.1Å; K305-Y852 VanDerWaalsContact NZ-OH 3.12Å
306	R	85.6	Confident	88	Confident	82 Å²	82	51.9 Å²	51.9	31%	0.309	25%	0.246	S	C	.	.	H	α-helix	trans	-86.2	-51.3	178.4	-177.9	174.5	-178.4	130.8	16.3	112.4	Q117 L118 D121 L302 Y303 I304	Q117-R306 PolarHBondContact O-NH1 3.01Å; L118-R306 HydrophobicContact CD2-CB 4.3Å; L118-R306 VanDerWaalsContact CD2-CD 3.44Å; D121-R306 IonicContact OD2-CZ 2.82Å; D121-R306 IonicContact OD2-NH1 3.28Å; D121-R306 PolarHBondContact OD2-NH1 3.31Å; D121-R306 IonicContact OD2-NH2 3.76Å; D121-R306 PolarHBondContact OD2-NH2 3.16Å; L302-R306 WeakPolarHBondContact O-CB 3.3Å; L302-R306 PolarHBondContact O-N 3.31Å; Y303-R306 PolarHBondContact O-N 3.07Å; I304-R306 PolarHBondContact O-N 3.41Å
307	F	84.3	Confident	88.2	Confident	41 Å²	41	49.2 Å²	49.2	18%	0.18	23%	0.23	C	C	.	.	H	α-helix	trans	-99.5	-16.4	-167.2	-63.9	-65.5	0	0	0	114.6	R114 L118 Y303 I304 K309	R114-F307 HydrophobicContact CB-CD1 4.3Å; R114-F307 HydrophobicContact CB-CD2 4.25Å; R114-F307 HydrophobicContact CB-CE1 3.79Å; R114-F307 HydrophobicContact CB-CE2 3.69Å; R114-F307 HydrophobicContact CB-CZ 3.45Å; R114-F307 VanDerWaalsContact CB-CZ 3.45Å; R114-F307 HydrophobicContact CG-CD1 3.92Å; R114-F307 HydrophobicContact CG-CE1 3.6Å; R114-F307 HydrophobicContact CG-CE2 4.36Å; R114-F307 HydrophobicContact CG-CG 4.46Å; R114-F307 HydrophobicContact CG-CZ 3.85Å; R114-F307 WeakPolarHBondContact O-CE2 3.35Å; R114-F307 WeakPolarHBondContact O-CZ 3.33Å; L118-F307 HydrophobicContact CD1-CD2 4.5Å; L118-F307 HydrophobicContact CD1-CE2 3.82Å; L118-F307 HydrophobicContact CG-CE2 4.01Å; Y303-F307 HydrophobicContact CD1-CD2 4.02Å; Y303-F307 AromaticContact CD2-CD2 3.93Å; Y303-F307 HydrophobicContact CD2-CD2 3.93Å; Y303-F307 HydrophobicContact CD2-CE2 4.08Å; Y303-F307 HydrophobicContact CE1-CB 4.16Å; Y303-F307 AromaticContact CE1-CD2 3.7Å; Y303-F307 HydrophobicContact CE1-CD2 3.7Å; Y303-F307 HydrophobicContact CE1-CG 4.3Å; Y303-F307 AromaticContact CE2-CD2 3.54Å; Y303-F307 HydrophobicContact CE2-CD2 3.54Å; Y303-F307 AromaticContact CE2-CE2 3.63Å; Y303-F307 HydrophobicContact CE2-CE2 3.63Å; Y303-F307 HydrophobicContact CG-CD2 4.11Å; Y303-F307 AromaticContact CZ-CD2 3.41Å; Y303-F307 VanDerWaalsContact CZ-CD2 3.41Å; Y303-F307 AromaticContact CZ-CE2 3.92Å; Y303-F307 PolarHBondContact O-N 3.48Å; I304-F307 PolarHBondContact O-N 2.98Å; F307-K309 PolarHBondContact O-N 2.9Å
308	K	77.1	Confident	88.6	Confident	159 Å²	159	49.2 Å²	49.2	69%	0.691	23%	0.23	S	C	*	.	S	Bend	trans	58.8	-28	177.3	-61.9	-170.4	174	-168.3	0	118	I304	I304-K308 WeakPolarHBondContact O-CA 3.27Å; I304-K308 PolarHBondContact O-N 3.25Å
309	K	83	Confident	89	Confident	174 Å²	174	48.9 Å²	48.9	76%	0.757	23%	0.227	S	C	*	.			trans	-129.5	112.3	178.6	-67.3	-172.3	176.2	-173.2	0	109.7	R114 F307	R114-K309 PolarHBondContact NH1-O 2.97Å; F307-K309 PolarHBondContact O-N 2.9Å
310	I	87.3	Confident	89.1	Confident	21 Å²	21	49.5 Å²	49.5	11%	0.108	23%	0.226	C	C	.	.			trans	-88.5	138.8	172.7	-62.2	170.8	0	0	0	108.3	L300 Y303 I304 V314 L315 W318 M406	L300-I310 HydrophobicContact CD1-CD1 4.5Å; Y303-I310 HydrophobicContact CD1-CD1 4.38Å; Y303-I310 HydrophobicContact CD1-CG1 4.21Å; Y303-I310 HydrophobicContact CE1-CG1 4.13Å; I304-I310 HydrophobicContact CG1-CD1 3.76Å; I310-V314 HydrophobicContact CG2-CB 3.95Å; I310-V314 HydrophobicContact CG2-CG1 3.94Å; I310-L315 HydrophobicContact CG2-CB 4.05Å; I310-W318 HydrophobicContact CD1-CE3 4.39Å; I310-W318 HydrophobicContact CD1-CZ3 3.93Å; I310-W318 HydrophobicContact CG1-CZ3 4.41Å; I310-W318 HydrophobicContact CG2-CE3 4.49Å; I310-W318 HydrophobicContact CG2-CZ3 4.32Å; I310-M406 HydrophobicContact CD1-CB 3.98Å; I310-M406 HydrophobicContact CD1-CG 3.8Å; I310-M406 HydrophobicContact CD1-SD 4.41Å
311	N	86.2	Confident	89.2	Confident	91 Å²	91	50.5 Å²	50.5	49%	0.487	23%	0.23	S	C	.	.			trans	-68.9	136.9	174	-177.7	-33.3	0	0	0	109.7	K313 V314 L315	N311-K313 PolarHBondContact O-N 3.44Å; N311-K313 VanDerWaalsContact O-N 3.13Å; N311-K313 PolarHBondContact OD1-N 3.43Å; N311-V314 HydrophobicContact CB-CB 4.42Å; N311-V314 HydrophobicContact CB-CG2 4.03Å; N311-V314 WeakPolarHBondContact O-CA 3.32Å; N311-V314 WeakPolarHBondContact O-CB 3.22Å; N311-V314 PolarHBondContact O-N 3.3Å; N311-L315 PolarHBondContact O-N 2.86Å
312	V	87.5	Confident	89.4	Confident	58 Å²	58	48.1 Å²	48.1	35%	0.352	22%	0.22	S	C	.	.	H	α-helix	trans	-53.1	-36.4	-180	-176.9	0	0	0	0	112.2	V314 L315 K316 I456 F482	V312-V314 PolarHBondContact O-N 3.21Å; V312-L315 PolarHBondContact O-N 3.16Å; V312-K316 WeakPolarHBondContact O-CB 3.32Å; V312-K316 PolarHBondContact O-N 2.96Å; V312-I456 HydrophobicContact CG1-CD1 4.31Å; V312-F482 HydrophobicContact CG1-CE2 4.12Å; V312-F482 HydrophobicContact CG1-CZ 4.12Å
313	K	85.1	Confident	89.7	Confident	117 Å²	117	45.8 Å²	45.8	51%	0.509	21%	0.208	S	C	.	.	H	α-helix	trans	-63.3	-39.8	175.1	-67.6	-159.9	172.4	-150.8	0	113	F106 N311 K316 S317 E486	F106-K313 HydrophobicContact CE1-CB 4.42Å; F106-K313 WeakPolarHBondContact CE1-O 3.36Å; F106-K313 HydrophobicContact CZ-CB 4.27Å; N311-K313 PolarHBondContact O-N 3.44Å; N311-K313 VanDerWaalsContact O-N 3.13Å; N311-K313 PolarHBondContact OD1-N 3.43Å; K313-K316 WeakPolarHBondContact O-CB 3.28Å; K313-K316 PolarHBondContact O-N 3.31Å; K313-S317 PolarHBondContact O-N 3.24Å; K313-S317 VanDerWaalsContact O-N 3.1Å; K313-E486 IonicContact NZ-OE2 2.69Å
314	V	88.7	Confident	89.9	Confident	10 Å²	10	50.4 Å²	50.4	6%	0.061	23%	0.228	C	C	.	.	H	α-helix	trans	-69.2	-44.8	177.8	177.6	0	0	0	0	110	F107 E111 I310 N311 V312 K316 S317 W318	F107-V314 HydrophobicContact CE1-CG1 4.35Å; F107-V314 HydrophobicContact CZ-CG1 3.89Å; F107-V314 HydrophobicContact CZ-CG2 4.48Å; E111-V314 HydrophobicContact CB-CG2 4.46Å; E111-V314 HydrophobicContact CG-CG1 4.36Å; E111-V314 HydrophobicContact CG-CG2 3.79Å; I310-V314 HydrophobicContact CG2-CB 3.95Å; I310-V314 HydrophobicContact CG2-CG1 3.94Å; N311-V314 HydrophobicContact CB-CB 4.42Å; N311-V314 HydrophobicContact CB-CG2 4.03Å; N311-V314 WeakPolarHBondContact O-CA 3.32Å; N311-V314 WeakPolarHBondContact O-CB 3.22Å; N311-V314 PolarHBondContact O-N 3.3Å; V312-V314 PolarHBondContact O-N 3.21Å; V314-K316 PolarHBondContact O-N 2.81Å; V314-S317 PolarHBondContact O-N 2.86Å; V314-W318 HydrophobicContact CG1-CD2 3.75Å; V314-W318 HydrophobicContact CG1-CE3 3.89Å; V314-W318 HydrophobicContact CG1-CG 4.41Å; V314-W318 HydrophobicContact CG1-CH2 3.91Å; V314-W318 HydrophobicContact CG1-CZ2 3.76Å; V314-W318 HydrophobicContact CG1-CZ3 3.97Å; V314-W318 PolarHBondContact O-N 3.46Å
315	L	92	Very high	90.1	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-58.5	-45.1	173.4	-173.8	155.7	0	0	0	111.4	I310 N311 V312 S317 W318 C319 M403 M406 I407 I456 F482	I310-L315 HydrophobicContact CG2-CB 4.05Å; N311-L315 PolarHBondContact O-N 2.86Å; V312-L315 PolarHBondContact O-N 3.16Å; L315-S317 VanDerWaalsContact C-N 3.31Å; L315-S317 PolarHBondContact O-N 3.38Å; L315-W318 PolarHBondContact O-N 2.95Å; L315-C319 VanDerWaalsContact O-CB 3.27Å; L315-C319 WeakPolarHBondContact O-CB 3.45Å; L315-C319 PolarHBondContact O-N 3.35Å; L315-C319 PolarHBondContact O-SG 3.17Å; L315-M403 HydrophobicContact CD2-CE 4.2Å; L315-M403 HydrophobicContact CD2-CG 4.42Å; L315-M406 HydrophobicContact CD1-CB 3.88Å; L315-M406 HydrophobicContact CG-CB 4.39Å; L315-I407 HydrophobicContact CD1-CB 3.89Å; L315-I407 HydrophobicContact CD1-CD1 4.05Å; L315-I456 HydrophobicContact CD2-CD1 4.43Å; L315-F482 HydrophobicContact CD2-CE1 4.08Å; L315-F482 HydrophobicContact CD2-CZ 4.17Å
316	K	90.6	Very high	90.5	Very high	31 Å²	31	45.3 Å²	45.3	14%	0.135	21%	0.206	C	C	.	.	H	α-helix	trans	-53.4	-48.6	174.6	-154.1	-171.1	-166.2	-169.1	0	110.9	V312 K313 V314 R320 F482 M484 E486	V312-K316 WeakPolarHBondContact O-CB 3.32Å; V312-K316 PolarHBondContact O-N 2.96Å; K313-K316 WeakPolarHBondContact O-CB 3.28Å; K313-K316 PolarHBondContact O-N 3.31Å; V314-K316 PolarHBondContact O-N 2.81Å; K316-R320 VanDerWaalsContact O-CB 3.24Å; K316-R320 WeakPolarHBondContact O-CB 3.42Å; K316-R320 PolarHBondContact O-N 3.06Å; K316-R320 VanDerWaalsContact O-N 3.1Å; K316-F482 VanDerWaalsContact CE-C 3.48Å; K316-F482 WeakPolarHBondContact CE-O 3.13Å; K316-F482 HydrophobicContact CG-CE1 4.4Å; K316-F482 HydrophobicContact CG-CZ 4.37Å; K316-F482 WeakPolarHBondContact CG-O 3.42Å; K316-M484 PolarHBondContact NZ-O 3.02Å; K316-E486 IonicContact NZ-OE1 2.73Å; K316-E486 PolarHBondContact NZ-OE1 3.39Å
317	S	90.2	Very high	91	Very high	7 Å²	7	42.1 Å²	42.1	5%	0.049	20%	0.197	C	C	.	.	H	α-helix	trans	-69.8	-44.6	-179	-167.1	0	0	0	0	113.2	K313 V314 L315 R320 Q321	K313-S317 PolarHBondContact O-N 3.24Å; K313-S317 VanDerWaalsContact O-N 3.1Å; V314-S317 PolarHBondContact O-N 2.86Å; L315-S317 VanDerWaalsContact C-N 3.31Å; L315-S317 PolarHBondContact O-N 3.38Å; S317-R320 PolarHBondContact O-N 3.19Å; S317-Q321 WeakPolarHBondContact O-CB 3.39Å; S317-Q321 VanDerWaalsContact O-CG 3.27Å; S317-Q321 WeakPolarHBondContact O-CG 3.47Å; S317-Q321 PolarHBondContact O-N 2.6Å; S317-Q321 PolarHBondContact O-NE2 3Å; S317-Q321 PolarHBondContact OG-NE2 2.94Å
318	W	94.2	Very high	91.5	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-67.4	-44.8	179	-73.2	-11.9	0	0	0	112.5	F107 I115 L300 Y303 I310 V314 L315 R320 Q321 I322 I348 G353 V355 M406	F107-W318 AromaticContact CZ-CE2 4Å; F107-W318 HydrophobicContact CZ-CZ2 4.07Å; F107-W318 AromaticContact CZ-NE1 3.59Å; I115-W318 HydrophobicContact CD1-CZ2 4.41Å; L300-W318 HydrophobicContact CD1-CE3 3.57Å; L300-W318 HydrophobicContact CD1-CH2 4.48Å; L300-W318 HydrophobicContact CD1-CZ3 3.54Å; Y303-W318 AromaticContact CD1-CH2 3.69Å; Y303-W318 HydrophobicContact CD1-CH2 3.69Å; Y303-W318 AromaticContact CD1-CZ3 3.85Å; Y303-W318 HydrophobicContact CD1-CZ3 3.85Å; Y303-W318 AromaticContact CD2-CH2 3.94Å; Y303-W318 HydrophobicContact CD2-CH2 3.94Å; Y303-W318 AromaticContact CE1-CH2 3.7Å; Y303-W318 HydrophobicContact CE1-CH2 3.7Å; Y303-W318 HydrophobicContact CE1-CZ3 4.07Å; Y303-W318 HydrophobicContact CE2-CH2 4.01Å; Y303-W318 AromaticContact CG-CH2 3.83Å; Y303-W318 HydrophobicContact CG-CH2 3.83Å; Y303-W318 HydrophobicContact CG-CZ3 4.26Å; Y303-W318 AromaticContact CZ-CH2 3.9Å; I310-W318 HydrophobicContact CD1-CE3 4.39Å; I310-W318 HydrophobicContact CD1-CZ3 3.93Å; I310-W318 HydrophobicContact CG1-CZ3 4.41Å; I310-W318 HydrophobicContact CG2-CE3 4.49Å; I310-W318 HydrophobicContact CG2-CZ3 4.32Å; V314-W318 HydrophobicContact CG1-CD2 3.75Å; V314-W318 HydrophobicContact CG1-CE3 3.89Å; V314-W318 HydrophobicContact CG1-CG 4.41Å; V314-W318 HydrophobicContact CG1-CH2 3.91Å; V314-W318 HydrophobicContact CG1-CZ2 3.76Å; V314-W318 HydrophobicContact CG1-CZ3 3.97Å; V314-W318 PolarHBondContact O-N 3.46Å; L315-W318 PolarHBondContact O-N 2.95Å; W318-R320 PolarHBondContact O-N 3.43Å; W318-Q321 WeakPolarHBondContact O-CB 3.41Å; W318-Q321 PolarHBondContact O-N 3.33Å; W318-I322 WeakPolarHBondContact O-CD1 3.45Å; W318-I322 VanDerWaalsContact O-CG1 3.3Å; W318-I322 WeakPolarHBondContact O-CG1 3.43Å; W318-I322 PolarHBondContact O-N 3.3Å; W318-I348 HydrophobicContact CH2-CD1 3.76Å; W318-I348 HydrophobicContact CZ2-CD1 3.96Å; W318-I348 HydrophobicContact CZ2-CG1 4.34Å; W318-I348 HydrophobicContact CZ3-CD1 4.38Å; W318-G353 PolarHBondContact NE1-O 3.06Å; W318-V355 HydrophobicContact CB-CG1 4.34Å; W318-V355 HydrophobicContact CB-CG2 4.13Å; W318-V355 HydrophobicContact CD2-CG1 4.03Å; W318-V355 HydrophobicContact CG-CG1 3.75Å; W318-V355 HydrophobicContact CG-CG2 4.24Å; W318-M406 HydrophobicContact CB-SD 4.49Å; W318-M406 HydrophobicContact CE3-SD 4.18Å
319	C	96.1	Very high	92.3	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.8	-46.9	173.5	-76.5	0	0	0	0	111.7	L315 Q321 I322 L323 F399 M406 F483	L315-C319 VanDerWaalsContact O-CB 3.27Å; L315-C319 WeakPolarHBondContact O-CB 3.45Å; L315-C319 PolarHBondContact O-N 3.35Å; L315-C319 PolarHBondContact O-SG 3.17Å; C319-Q321 VanDerWaalsContact C-N 3.27Å; C319-Q321 PolarHBondContact O-N 3.2Å; C319-I322 PolarHBondContact O-N 3.43Å; C319-L323 WeakPolarHBondContact O-CB 3.47Å; C319-L323 VanDerWaalsContact O-CG 3.26Å; C319-L323 WeakPolarHBondContact O-CG 3.43Å; C319-L323 PolarHBondContact O-N 3.02Å; C319-F399 HydrophobicContact CB-CE2 3.92Å; C319-F399 HydrophobicContact CB-CZ 3.91Å; C319-M406 WeakPolarHBondContact SG-CE 3.42Å; C319-F483 HydrophobicContact CB-CD1 4.14Å; C319-F483 HydrophobicContact CB-CE1 3.27Å; C319-F483 HydrophobicContact CB-CZ 3.76Å
320	R	94.1	Very high	92.8	Very high	41 Å²	41	27.2 Å²	27.2	16%	0.155	13%	0.133	C	C	.	.	H	α-helix	trans	-57.4	-38.2	175.2	-178.6	-176.3	62.6	136.9	-4.7	112.4	K316 S317 W318 K324 L478 F483	K316-R320 VanDerWaalsContact O-CB 3.24Å; K316-R320 WeakPolarHBondContact O-CB 3.42Å; K316-R320 PolarHBondContact O-N 3.06Å; K316-R320 VanDerWaalsContact O-N 3.1Å; S317-R320 PolarHBondContact O-N 3.19Å; W318-R320 PolarHBondContact O-N 3.43Å; R320-K324 WeakPolarHBondContact O-CG 3.37Å; R320-K324 PolarHBondContact O-N 3.19Å; R320-L478 HydrophobicContact CG-CD2 4.18Å; R320-F483 WeakPolarHBondContact CD-O 3.37Å
321	Q	94.9	Very high	93	Very high	20 Å²	20	28.8 Å²	28.8	9%	0.093	15%	0.146	C	C	.	.	H	α-helix	trans	-70.9	-41.8	177	-77.4	176.5	67.6	0	0	112.9	N270 S317 W318 C319 L323 K324 G325 S354 V355	N270-Q321 VanDerWaalsContact CB-O 3.27Å; N270-Q321 WeakPolarHBondContact CB-O 3.46Å; N270-Q321 WeakPolarHBondContact ND2-CB 3.24Å; N270-Q321 PolarHBondContact ND2-OE1 2.76Å; S317-Q321 WeakPolarHBondContact O-CB 3.39Å; S317-Q321 VanDerWaalsContact O-CG 3.27Å; S317-Q321 WeakPolarHBondContact O-CG 3.47Å; S317-Q321 PolarHBondContact O-N 2.6Å; S317-Q321 PolarHBondContact O-NE2 3Å; S317-Q321 PolarHBondContact OG-NE2 2.94Å; W318-Q321 WeakPolarHBondContact O-CB 3.41Å; W318-Q321 PolarHBondContact O-N 3.33Å; C319-Q321 VanDerWaalsContact C-N 3.27Å; C319-Q321 PolarHBondContact O-N 3.2Å; Q321-L323 VanDerWaalsContact C-N 3.32Å; Q321-K324 PolarHBondContact O-N 3.47Å; Q321-G325 PolarHBondContact O-N 2.79Å; Q321-S354 VanDerWaalsContact OE1-CB 3.26Å; Q321-V355 HydrophobicContact CB-CG2 3.47Å; Q321-V355 VanDerWaalsContact CB-CG2 3.47Å; Q321-V355 HydrophobicContact CG-CG2 4.4Å
322	I	97.3	Very high	93.2	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-61	-44.6	172.7	-63.7	155.6	0	0	0	109.7	L300 W318 C319 K324 G325 L326 I346 V355 I357 F399 M406	L300-I322 HydrophobicContact CD2-CD1 4.48Å; W318-I322 WeakPolarHBondContact O-CD1 3.45Å; W318-I322 VanDerWaalsContact O-CG1 3.3Å; W318-I322 WeakPolarHBondContact O-CG1 3.43Å; W318-I322 PolarHBondContact O-N 3.3Å; C319-I322 PolarHBondContact O-N 3.43Å; I322-K324 PolarHBondContact O-N 3.01Å; I322-G325 WeakPolarHBondContact O-CA 3.44Å; I322-G325 PolarHBondContact O-N 3.5Å; I322-L326 HydrophobicContact CG2-CD1 4.35Å; I322-L326 HydrophobicContact CG2-CG 4.47Å; I322-L326 PolarHBondContact O-N 2.67Å; I322-I346 HydrophobicContact CD1-CD1 3.89Å; I322-I346 HydrophobicContact CD1-CG2 4.27Å; I322-I346 HydrophobicContact CG1-CD1 4.22Å; I322-I346 HydrophobicContact CG1-CG2 4.22Å; I322-I346 HydrophobicContact CG2-CD1 4.49Å; I322-V355 HydrophobicContact CG1-CG2 4.1Å; I322-I357 HydrophobicContact CG2-CD1 4.02Å; I322-I357 HydrophobicContact CG2-CG1 4.47Å; I322-F399 HydrophobicContact CB-CD2 4.38Å; I322-F399 HydrophobicContact CB-CE2 4.41Å; I322-F399 HydrophobicContact CG2-CD2 3.83Å; I322-F399 HydrophobicContact CG2-CE2 4.35Å; I322-M406 HydrophobicContact CD1-CE 4.12Å
323	L	97.3	Very high	93	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.2	-37.4	177.5	-71	168.6	0	0	0	113.2	C319 Q321 G325 L326 A327 F399 A474 L477 L478 F483	C319-L323 WeakPolarHBondContact O-CB 3.47Å; C319-L323 VanDerWaalsContact O-CG 3.26Å; C319-L323 WeakPolarHBondContact O-CG 3.43Å; C319-L323 PolarHBondContact O-N 3.02Å; Q321-L323 VanDerWaalsContact C-N 3.32Å; L323-G325 VanDerWaalsContact C-N 3.35Å; L323-L326 PolarHBondContact O-N 3.26Å; L323-A327 VanDerWaalsContact O-CB 3.26Å; L323-A327 WeakPolarHBondContact O-CB 3.44Å; L323-A327 PolarHBondContact O-N 2.92Å; L323-F399 HydrophobicContact CD1-CE1 4.22Å; L323-F399 HydrophobicContact CD1-CE2 4.16Å; L323-F399 HydrophobicContact CD1-CZ 3.66Å; L323-F399 HydrophobicContact CD2-CD1 4.03Å; L323-F399 HydrophobicContact CD2-CD2 4.11Å; L323-F399 HydrophobicContact CD2-CE1 3.86Å; L323-F399 HydrophobicContact CD2-CE2 3.93Å; L323-F399 HydrophobicContact CD2-CG 4.17Å; L323-F399 HydrophobicContact CD2-CZ 3.81Å; L323-F399 HydrophobicContact CG-CD2 4.27Å; L323-F399 HydrophobicContact CG-CE1 4.22Å; L323-F399 HydrophobicContact CG-CE2 3.68Å; L323-F399 HydrophobicContact CG-CZ 3.65Å; L323-A474 HydrophobicContact CD2-CB 4.45Å; L323-L477 HydrophobicContact CD1-CB 3.7Å; L323-L477 HydrophobicContact CD2-CB 3.81Å; L323-L477 HydrophobicContact CD2-CD1 3.6Å; L323-L477 HydrophobicContact CD2-CG 4.34Å; L323-L477 HydrophobicContact CG-CB 4.38Å; L323-L478 HydrophobicContact CB-CD2 3.67Å; L323-L478 HydrophobicContact CB-CG 3.91Å; L323-F483 HydrophobicContact CD1-CD1 4.43Å; L323-F483 HydrophobicContact CD1-CD2 3.77Å; L323-F483 HydrophobicContact CD1-CE2 3.83Å; L323-F483 HydrophobicContact CD1-CG 4.07Å; L323-F483 HydrophobicContact CD1-CZ 4.21Å
324	K	95.6	Very high	93	Very high	97 Å²	97	33.5 Å²	33.5	42%	0.422	17%	0.167	S	C	.	.	H	α-helix	trans	-60.2	-44.5	169.3	-77.4	-176.4	174.1	-168.6	0	111.5	R320 Q321 I322 A327 F328 L478	R320-K324 WeakPolarHBondContact O-CG 3.37Å; R320-K324 PolarHBondContact O-N 3.19Å; Q321-K324 PolarHBondContact O-N 3.47Å; I322-K324 PolarHBondContact O-N 3.01Å; K324-A327 PolarHBondContact O-N 3.48Å; K324-F328 WeakPolarHBondContact O-CB 3.31Å; K324-F328 PolarHBondContact O-N 3.48Å; K324-L478 HydrophobicContact CG-CD2 4.09Å
325	G	96.1	Very high	93	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.7	-48.9	175.3	0	0	0	0	0	112.7	Q321 I322 L323 F328 L329	Q321-G325 PolarHBondContact O-N 2.79Å; I322-G325 WeakPolarHBondContact O-CA 3.44Å; I322-G325 PolarHBondContact O-N 3.5Å; L323-G325 VanDerWaalsContact C-N 3.35Å; G325-F328 WeakPolarHBondContact O-CB 3.46Å; G325-F328 PolarHBondContact O-N 3.17Å; G325-L329 WeakPolarHBondContact O-CG 3.19Å; G325-L329 PolarHBondContact O-N 2.9Å; G325-L329 VanDerWaalsContact O-N 3.13Å
326	L	96.9	Very high	92.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.5	-47.9	176.8	-66.6	-178.9	0	0	0	112.1	I322 L323 F328 L329 H330 L341 I357 D395 F399 A474	I322-L326 HydrophobicContact CG2-CD1 4.35Å; I322-L326 HydrophobicContact CG2-CG 4.47Å; I322-L326 PolarHBondContact O-N 2.67Å; L323-L326 PolarHBondContact O-N 3.26Å; L326-F328 PolarHBondContact O-N 3.48Å; L326-L329 HydrophobicContact CD2-CD1 4.48Å; L326-L329 PolarHBondContact O-N 2.88Å; L326-H330 WeakPolarHBondContact O-CB 3.19Å; L326-H330 PolarHBondContact O-N 2.82Å; L326-H330 PolarHBondContact O-ND1 3.28Å; L326-L341 HydrophobicContact CD1-CD2 3.92Å; L326-L341 HydrophobicContact CD2-CD2 4.16Å; L326-I357 HydrophobicContact CD2-CD1 4.01Å; L326-I357 HydrophobicContact CG-CD1 4.1Å; L326-D395 HydrophobicContact CD1-CB 4.31Å; L326-D395 HydrophobicContact CD2-CB 3.98Å; L326-F399 HydrophobicContact CD1-CB 4.11Å; L326-A474 HydrophobicContact CB-CB 4.07Å
327	A	95.6	Very high	92.7	Very high	16 Å²	16	36.8 Å²	36.8	13%	0.132	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-29.9	177.5	0	0	0	0	0	113.1	L323 K324 S331 A474 L478	L323-A327 VanDerWaalsContact O-CB 3.26Å; L323-A327 WeakPolarHBondContact O-CB 3.44Å; L323-A327 PolarHBondContact O-N 2.92Å; K324-A327 PolarHBondContact O-N 3.48Å; A327-S331 WeakPolarHBondContact O-CB 3.42Å; A327-S331 PolarHBondContact O-N 3.18Å; A327-S331 PolarHBondContact O-OG 3.04Å; A327-A474 HydrophobicContact CB-CB 4.08Å; A327-L478 HydrophobicContact CB-CD1 3.88Å
328	F	95.3	Very high	92.7	Very high	30 Å²	30	36.6 Å²	36.6	13%	0.132	19%	0.188	C	C	.	.	H	α-helix	trans	-67.2	-47.4	170.4	170.4	-96	0	0	0	112.1	L266 H267 H268 I271 K324 G325 L326 S331 R332	L266-F328 HydrophobicContact CB-CE1 4.25Å; L266-F328 HydrophobicContact CD2-CE1 4.13Å; L266-F328 HydrophobicContact CD2-CZ 4.46Å; H267-F328 WeakPolarHBondContact O-CZ 3.48Å; H268-F328 HydrophobicContact CB-CB 4.38Å; H268-F328 HydrophobicContact CB-CD1 3.57Å; H268-F328 HydrophobicContact CB-CD2 3.93Å; H268-F328 HydrophobicContact CB-CE1 3.71Å; H268-F328 HydrophobicContact CB-CE2 4.05Å; H268-F328 HydrophobicContact CB-CG 3.68Å; H268-F328 HydrophobicContact CB-CZ 3.95Å; H268-F328 AromaticContact CD2-CD2 3.84Å; H268-F328 AromaticContact CD2-CG 3.78Å; H268-F328 AromaticContact CG-CD1 3.99Å; H268-F328 AromaticContact CG-CG 3.7Å; I271-F328 HydrophobicContact CG1-CD1 4.17Å; K324-F328 WeakPolarHBondContact O-CB 3.31Å; K324-F328 PolarHBondContact O-N 3.48Å; G325-F328 WeakPolarHBondContact O-CB 3.46Å; G325-F328 PolarHBondContact O-N 3.17Å; L326-F328 PolarHBondContact O-N 3.48Å; F328-S331 WeakPolarHBondContact CA-OG 3.39Å; F328-S331 PolarHBondContact O-N 3.22Å; F328-S331 PolarHBondContact O-OG 2.83Å; F328-R332 PolarHBondContact O-N 3.13Å; F328-R332 PolarHBondContact O-NE 3.03Å
329	L	93.7	Very high	92.4	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.8	-45.8	178.7	-64.4	169.9	0	0	0	111.9	L266 I271 G325 L326 S331 R332 V336 L360	L266-L329 HydrophobicContact CD1-CD2 3.86Å; I271-L329 HydrophobicContact CD1-CD1 3.79Å; I271-L329 HydrophobicContact CD1-CD2 4.22Å; I271-L329 HydrophobicContact CD1-CG 3.96Å; G325-L329 WeakPolarHBondContact O-CG 3.19Å; G325-L329 PolarHBondContact O-N 2.9Å; G325-L329 VanDerWaalsContact O-N 3.13Å; L326-L329 HydrophobicContact CD2-CD1 4.48Å; L326-L329 PolarHBondContact O-N 2.88Å; L329-S331 PolarHBondContact O-N 3.13Å; L329-R332 WeakPolarHBondContact O-CB 3.4Å; L329-R332 WeakPolarHBondContact O-CG 3.4Å; L329-R332 PolarHBondContact O-N 3.36Å; L329-V336 CarbonylContact C-O 3.5Å; L329-V336 HydrophobicContact CB-CB 4.19Å; L329-V336 WeakPolarHBondContact CB-O 3.42Å; L329-V336 HydrophobicContact CD2-CB 4.26Å; L329-V336 HydrophobicContact CD2-CG1 4.03Å; L329-V336 PolarHBondContact O-N 3.04Å; L329-L360 HydrophobicContact CD1-CD2 3.77Å; L329-L360 HydrophobicContact CD2-CD1 4.05Å; L329-L360 HydrophobicContact CD2-CD2 4.24Å
330	H	93.9	Very high	92.1	Very high	31 Å²	31	40.7 Å²	40.7	14%	0.144	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-8.8	177.3	-54.6	159.8	0	0	0	113.4	L326 V336 E392 D395	L326-H330 WeakPolarHBondContact O-CB 3.19Å; L326-H330 PolarHBondContact O-N 2.82Å; L326-H330 PolarHBondContact O-ND1 3.28Å; H330-V336 PolarHBondContact CD2-O 3.36Å; H330-E392 HydrophobicContact CB-CB 4.39Å; H330-D395 IonicContact CD2-OD2 4Å; H330-D395 IonicContact CE1-OD2 3.21Å; H330-D395 IonicContact NE2-OD2 2.99Å; H330-D395 PolarHBondContact NE2-OD2 2.92Å
331	S	92.1	Very high	92.1	Very high	54 Å²	54	38.8 Å²	38.8	38%	0.378	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	8.8	173	63.9	0	0	0	0	114.1	A327 F328 L329	A327-S331 WeakPolarHBondContact O-CB 3.42Å; A327-S331 PolarHBondContact O-N 3.18Å; A327-S331 PolarHBondContact O-OG 3.04Å; F328-S331 WeakPolarHBondContact CA-OG 3.39Å; F328-S331 PolarHBondContact O-N 3.22Å; F328-S331 PolarHBondContact O-OG 2.83Å; L329-S331 PolarHBondContact O-N 3.13Å
332	R	89.7	Confident	92	Very high	89 Å²	89	38.7 Å²	38.7	34%	0.336	20%	0.196	S	C	.	.	S	Bend	trans	-74.7	161.7	168.2	-58.7	-52.8	84.6	-157.8	-7.1	109.7	L266 F328 L329 P334 P335 V336	L266-R332 HydrophobicContact CD2-CG 3.85Å; F328-R332 PolarHBondContact O-N 3.13Å; F328-R332 PolarHBondContact O-NE 3.03Å; L329-R332 WeakPolarHBondContact O-CB 3.4Å; L329-R332 WeakPolarHBondContact O-CG 3.4Å; L329-R332 PolarHBondContact O-N 3.36Å; R332-P334 VanDerWaalsContact C-C 3.45Å; R332-P334 CarbonylContact C-O 3.52Å; R332-P334 WeakPolarHBondContact CB-O 3.48Å; R332-P334 CarbonylContact O-C 3.48Å; R332-P335 VanDerWaalsContact O-CA 3.31Å; R332-P335 WeakPolarHBondContact O-CA 3.5Å; R332-P335 VanDerWaalsContact O-N 3.1Å; R332-V336 HydrophobicContact CB-CG2 3.99Å; R332-V336 HydrophobicContact CG-CG2 4Å
333	Q	83.6	Confident	91.9	Very high	180 Å²	180	38.6 Å²	38.6	84%	0.841	20%	0.196	S	C	*	.	S	Bend	trans	-123.4	110.6	172.1	-174.6	63.5	4.4	0	0	109
334	P	85.4	Confident	91.6	Very high	95 Å²	95	41.3 Å²	41.3	62%	0.617	21%	0.21	S	C	*	.	S	Bend	cis	-65.2	159.5	-6.5	30.9	-36.8	0	0	0	112.7	R332	R332-P334 VanDerWaalsContact C-C 3.45Å; R332-P334 CarbonylContact C-O 3.52Å; R332-P334 WeakPolarHBondContact CB-O 3.48Å; R332-P334 CarbonylContact O-C 3.48Å
335	P	88.5	Confident	91.5	Very high	63 Å²	63	37.2 Å²	37.2	41%	0.409	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-60.5	137.1	176.2	-26.2	35.7	0	0	0	112.8	R332	R332-P335 VanDerWaalsContact O-CA 3.31Å; R332-P335 WeakPolarHBondContact O-CA 3.5Å; R332-P335 VanDerWaalsContact O-N 3.1Å
336	V	87.9	Confident	91.4	Very high	12 Å²	12	37.2 Å²	37.2	7%	0.073	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-98.4	119.7	178.9	179	0	0	0	0	109.6	M262 L266 L329 H330 R332	M262-V336 HydrophobicContact CE-CG1 4.15Å; M262-V336 HydrophobicContact CE-CG2 3.95Å; M262-V336 HydrophobicContact SD-CG2 3.72Å; L266-V336 HydrophobicContact CD1-CG1 4.46Å; L329-V336 CarbonylContact C-O 3.5Å; L329-V336 HydrophobicContact CB-CB 4.19Å; L329-V336 WeakPolarHBondContact CB-O 3.42Å; L329-V336 HydrophobicContact CD2-CB 4.26Å; L329-V336 HydrophobicContact CD2-CG1 4.03Å; L329-V336 PolarHBondContact O-N 3.04Å; H330-V336 PolarHBondContact CD2-O 3.36Å; R332-V336 HydrophobicContact CB-CG2 3.99Å; R332-V336 HydrophobicContact CG-CG2 4Å
337	I	89.4	Confident	91.3	Very high	37 Å²	37	39 Å²	39	19%	0.19	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-102.6	132.6	178.1	-52.9	168.2	0	0	0	108.8	R339 V394	I337-R339 HydrophobicContact CB-CG 4.27Å; I337-R339 HydrophobicContact CG2-CG 3.79Å; I337-V394 HydrophobicContact CG2-CG2 3.59Å
338	H	89.9	Confident	91.2	Very high	3 Å²	3	38.3 Å²	38.3	1%	0.014	20%	0.195	C	C	.	.			trans	-77.7	-37.6	-176	-171.6	-57.9	0	0	0	113.2	D340 L341 I357 G358 L360 D395	H338-D340 PolarHBondContact CE1-O 3.28Å; H338-D340 PolarHBondContact O-N 2.89Å; H338-L341 PolarHBondContact ND1-N 3.34Å; H338-I357 WeakPolarHBondContact CD2-CG2 3.22Å; H338-I357 WeakPolarHBondContact NE2-CG2 3.44Å; H338-G358 PolarHBondContact NE2-O 3.48Å; H338-L360 HydrophobicContact CB-CD2 4.27Å; H338-L360 WeakPolarHBondContact CD2-CD2 3.44Å; H338-D395 WeakPolarHBondContact CB-OD1 3.36Å; H338-D395 PolarHBondContact N-OD1 2.95Å; H338-D395 PolarHBondContact N-OD2 3.08Å
339	R	88.2	Confident	90.8	Very high	73 Å²	73	37.9 Å²	37.9	28%	0.275	19%	0.194	S	C	.	.	S	Bend	trans	65.7	-36.3	175.5	-50	176.5	-173.5	173.6	-1.2	116.7	I337 A363 M385 Y390 D395	I337-R339 HydrophobicContact CB-CG 4.27Å; I337-R339 HydrophobicContact CG2-CG 3.79Å; R339-A363 HydrophobicContact CB-CB 3.95Å; R339-M385 WeakPolarHBondContact O-CE 3.3Å; R339-Y390 HydrophobicContact CG-CE2 4.07Å; R339-Y390 VanDerWaalsContact CZ-OH 3.31Å; R339-Y390 PolarHBondContact NE-OH 3.37Å; R339-Y390 PolarHBondContact NH1-OH 2.9Å; R339-D395 PolarHBondContact N-OD1 3.47Å
340	D	88.4	Confident	89.8	Confident	12 Å²	12	38.7 Å²	38.7	6%	0.064	20%	0.203	C	C	.	.	S	Bend	trans	-117.9	44.7	177.5	-169.1	34.3	0	0	0	112.2	H338 K342 N345 K366 T377	H338-D340 PolarHBondContact CE1-O 3.28Å; H338-D340 PolarHBondContact O-N 2.89Å; D340-K342 IonicContact OD1-NZ 3.35Å; D340-K342 PolarHBondContact OD1-NZ 2.9Å; D340-K342 IonicContact OD2-NZ 2.67Å; D340-K342 PolarHBondContact OD2-NZ 2.87Å; D340-N345 PolarHBondContact O-ND2 3.45Å; D340-N345 PolarHBondContact OD2-ND2 3.34Å; D340-K366 IonicContact OD2-NZ 3.48Å; D340-K366 PolarHBondContact OD2-NZ 3.49Å; D340-T377 PolarHBondContact OD1-OG1 3.35Å
341	L	93.8	Very high	88.6	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	23%	0.226	C	C	.	.			trans	-73.7	128.7	177.9	-175.9	75.2	0	0	0	110.4	L326 H338 I346 I357 D395 A398 F399	L326-L341 HydrophobicContact CD1-CD2 3.92Å; L326-L341 HydrophobicContact CD2-CD2 4.16Å; H338-L341 PolarHBondContact ND1-N 3.34Å; L341-I346 HydrophobicContact CD1-CD1 4.18Å; L341-I346 HydrophobicContact CD1-CG1 4.18Å; L341-I357 HydrophobicContact CD1-CD1 4.38Å; L341-I357 HydrophobicContact CD1-CG2 3.67Å; L341-D395 WeakPolarHBondContact CD2-O 3.42Å; L341-A398 HydrophobicContact CB-CB 3.87Å; L341-A398 HydrophobicContact CD2-CB 4.22Å; L341-A398 HydrophobicContact CG-CB 4.44Å; L341-F399 HydrophobicContact CD2-CB 4.18Å
342	K	93.5	Very high	87.6	Confident	18 Å²	18	41.1 Å²	41.1	8%	0.078	22%	0.218	C	C	.	.	S	Bend	trans	-165.7	166.1	178.2	53	168.8	173.8	-79.7	0	111	D340 D344 N345 I346 T377 F380 C402	D340-K342 IonicContact OD1-NZ 3.35Å; D340-K342 PolarHBondContact OD1-NZ 2.9Å; D340-K342 IonicContact OD2-NZ 2.67Å; D340-K342 PolarHBondContact OD2-NZ 2.87Å; K342-D344 HydrophobicContact CD-CB 3.8Å; K342-D344 HydrophobicContact CG-CB 4.11Å; K342-D344 PolarHBondContact O-N 3.48Å; K342-D344 VanDerWaalsContact O-N 3.11Å; K342-N345 WeakPolarHBondContact CE-OD1 3.36Å; K342-N345 HydrophobicContact CG-CB 4.21Å; K342-N345 PolarHBondContact NZ-ND2 3.22Å; K342-N345 PolarHBondContact O-N 2.98Å; K342-I346 PolarHBondContact O-N 2.88Å; K342-T377 HydrophobicContact CD-CG2 4.09Å; K342-T377 PolarHBondContact NZ-OG1 3.33Å; K342-F380 HydrophobicContact CB-CD1 3.87Å; K342-F380 HydrophobicContact CB-CD2 4.07Å; K342-F380 HydrophobicContact CB-CE1 3.9Å; K342-F380 HydrophobicContact CB-CE2 4.11Å; K342-F380 HydrophobicContact CB-CG 3.97Å; K342-F380 HydrophobicContact CB-CZ 4.04Å; K342-C402 VanDerWaalsContact CA-SG 3.55Å
343	C	94.4	Very high	87.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-13.9	177.5	-59.8	0	0	0	0	115	L300 K301 I304 E405	L300-C343 HydrophobicContact CB-CB 4.13Å; L300-C343 HydrophobicContact CD2-CB 4.2Å; L300-C343 HydrophobicContact CG-CB 4.07Å; L300-C343 PolarHBondContact N-O 2.87Å; K301-C343 HydrophobicContact CB-CB 3.95Å; K301-C343 WeakPolarHBondContact CB-O 3.48Å; K301-C343 PolarHBondContact N-O 3.2Å; I304-C343 HydrophobicContact CD1-CB 4.34Å; C343-E405 WeakPolarHBondContact CB-OE2 3.24Å; C343-E405 PolarHBondContact SG-OE2 3.2Å
344	D	91.4	Very high	87.5	Confident	56 Å²	56	29.6 Å²	29.6	30%	0.299	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-28.9	167.3	-74.1	-65.1	0	0	0	112.8	T299 K301 K342	T299-D344 WeakPolarHBondContact CG2-O 3.44Å; K301-D344 WeakPolarHBondContact CD-OD1 3.27Å; K301-D344 VanDerWaalsContact CD-OD2 3.26Å; K301-D344 WeakPolarHBondContact CD-OD2 3.45Å; K301-D344 IonicContact NZ-OD1 2.72Å; K301-D344 IonicContact NZ-OD2 3.93Å; K301-D344 PolarHBondContact NZ-OD2 3.33Å; K342-D344 HydrophobicContact CD-CB 3.8Å; K342-D344 HydrophobicContact CG-CB 4.11Å; K342-D344 PolarHBondContact O-N 3.48Å; K342-D344 VanDerWaalsContact O-N 3.11Å
345	N	93.2	Very high	88	Confident	11 Å²	11	25.2 Å²	25.2	6%	0.059	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-0.4	-173.3	-65.8	1.6	0	0	0	112.2	D340 K342 F347 G358 D359	D340-N345 PolarHBondContact O-ND2 3.45Å; D340-N345 PolarHBondContact OD2-ND2 3.34Å; K342-N345 WeakPolarHBondContact CE-OD1 3.36Å; K342-N345 HydrophobicContact CG-CB 4.21Å; K342-N345 PolarHBondContact NZ-ND2 3.22Å; K342-N345 PolarHBondContact O-N 2.98Å; N345-F347 WeakPolarHBondContact O-CD2 3.48Å; N345-F347 WeakPolarHBondContact O-CE2 3.26Å; N345-G358 PolarHBondContact O-N 3.49Å; N345-D359 HydrophobicContact CB-CB 4.29Å
346	I	95.4	Very high	88.4	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.2	173	-61.6	161.2	0	0	0	107.8	T299 L300 I322 L341 K342 V355 C402	T299-I346 CarbonylContact C-O 3.59Å; T299-I346 WeakPolarHBondContact CA-O 3.38Å; L300-I346 HydrophobicContact CB-CB 4.18Å; L300-I346 HydrophobicContact CB-CG2 4.18Å; L300-I346 HydrophobicContact CD2-CB 4.26Å; L300-I346 HydrophobicContact CD2-CD1 4.23Å; L300-I346 HydrophobicContact CD2-CG2 4.02Å; L300-I346 PolarHBondContact N-O 3.5Å; I322-I346 HydrophobicContact CD1-CD1 3.89Å; I322-I346 HydrophobicContact CD1-CG2 4.27Å; I322-I346 HydrophobicContact CG1-CD1 4.22Å; I322-I346 HydrophobicContact CG1-CG2 4.22Å; I322-I346 HydrophobicContact CG2-CD1 4.49Å; L341-I346 HydrophobicContact CD1-CD1 4.18Å; L341-I346 HydrophobicContact CD1-CG1 4.18Å; K342-I346 PolarHBondContact O-N 2.88Å; I346-V355 HydrophobicContact CG2-CB 4.11Å; I346-V355 HydrophobicContact CG2-CG1 4.38Å; I346-C402 HydrophobicContact CD1-CB 4.45Å
347	F	94.5	Very high	88.7	Confident	39 Å²	39	23 Å²	23	17%	0.171	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	151.1	-175.2	-63.8	-92.5	0	0	0	111.6	V272 M295 G298 T299 N345 V355 K356	V272-F347 HydrophobicContact CG2-CD2 3.83Å; V272-F347 HydrophobicContact CG2-CE2 4.45Å; V272-F347 HydrophobicContact CG2-CG 4.45Å; M295-F347 HydrophobicContact CB-CB 3.76Å; M295-F347 HydrophobicContact CB-CD1 3.47Å; M295-F347 VanDerWaalsContact CB-CD1 3.47Å; M295-F347 HydrophobicContact CB-CE1 4.27Å; M295-F347 HydrophobicContact CB-CG 3.78Å; M295-F347 HydrophobicContact CE-CB 3.78Å; M295-F347 HydrophobicContact CG-CB 3.62Å; M295-F347 HydrophobicContact CG-CD1 3.84Å; M295-F347 HydrophobicContact CG-CD2 4.29Å; M295-F347 HydrophobicContact CG-CG 3.66Å; M295-F347 HydrophobicContact SD-CB 4.43Å; G298-F347 WeakPolarHBondContact O-CA 3.48Å; T299-F347 HydrophobicContact CG2-CD1 3.85Å; T299-F347 HydrophobicContact CG2-CE1 3.68Å; T299-F347 HydrophobicContact CG2-CZ 4.31Å; N345-F347 WeakPolarHBondContact O-CD2 3.48Å; N345-F347 WeakPolarHBondContact O-CE2 3.26Å; F347-V355 CarbonylContact O-C 3.58Å; F347-V355 VanDerWaalsContact O-CA 3.22Å; F347-V355 WeakPolarHBondContact O-CA 3.42Å; F347-K356 PolarHBondContact N-O 3.1Å; F347-K356 PolarHBondContact O-N 2.88Å
348	I	92.1	Very high	88.8	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	144.2	176	-62.2	167.6	0	0	0	109.4	I115 S297 G298 Y303 W318 V355	I115-I348 HydrophobicContact CD1-CG2 4.02Å; I115-I348 HydrophobicContact CG1-CG2 4.33Å; I115-I348 HydrophobicContact CG2-CG2 3.89Å; S297-I348 VanDerWaalsContact CB-O 3.29Å; S297-I348 WeakPolarHBondContact CB-O 3.43Å; S297-I348 PolarHBondContact OG-O 2.73Å; G298-I348 PolarHBondContact O-N 3.39Å; Y303-I348 HydrophobicContact CD2-CD1 3.64Å; Y303-I348 HydrophobicContact CG-CD1 3.77Å; W318-I348 HydrophobicContact CH2-CD1 3.76Å; W318-I348 HydrophobicContact CZ2-CD1 3.96Å; W318-I348 HydrophobicContact CZ2-CG1 4.34Å; W318-I348 HydrophobicContact CZ3-CD1 4.38Å; I348-V355 HydrophobicContact CG1-CG1 3.95Å
349	T	87.4	Confident	88.5	Confident	21 Å²	21	23.2 Å²	23.2	13%	0.129	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	106.3	175.3	-40	0	0	0	0	109.4	M295 T351 T352 G353 S354	M295-T349 WeakPolarHBondContact CE-OG1 3.4Å; T349-T351 PolarHBondContact O-N 3.27Å; T349-T352 PolarHBondContact O-N 3.49Å; T349-T352 PolarHBondContact O-OG1 3.12Å; T349-G353 WeakPolarHBondContact O-CA 3.26Å; T349-G353 PolarHBondContact O-N 3.1Å; T349-S354 WeakPolarHBondContact CB-O 3.27Å; T349-S354 WeakPolarHBondContact CB-OG 3.33Å; T349-S354 PolarHBondContact N-O 3.24Å; T349-S354 PolarHBondContact OG1-O 2.85Å; T349-S354 PolarHBondContact OG1-OG 2.9Å
350	G	73.4	Confident	87.9	Confident	17 Å²	17	20.7 Å²	20.7	18%	0.175	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-27	-167.3	0	0	0	0	0	115.6	I115 E119 S297 T352	I115-G350 VanDerWaalsContact CG2-CA 3.46Å; E119-G350 WeakPolarHBondContact OE1-CA 3.49Å; S297-G350 WeakPolarHBondContact OG-CA 3.49Å; S297-G350 PolarHBondContact OG-N 2.62Å; G350-T352 PolarHBondContact O-N 2.71Å
351	T	69.3	Low	86.6	Confident	103 Å²	103	20.5 Å²	20.5	63%	0.632	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.7	173	53.4	0	0	0	0	113.3	T349	T349-T351 PolarHBondContact O-N 3.27Å
352	T	71.2	Confident	85	Confident	34 Å²	34	21.2 Å²	21.2	21%	0.209	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-14	-171.6	51.4	0	0	0	0	114.6	T99 T349 G350 S354	T99-T352 HydrophobicContact CG2-CG2 4.46Å; T349-T352 PolarHBondContact O-N 3.49Å; T349-T352 PolarHBondContact O-OG1 3.12Å; G350-T352 PolarHBondContact O-N 2.71Å; T352-S354 PolarHBondContact O-N 3.07Å; T352-S354 WeakPolarHBondContact OG1-CB 3.47Å; T352-S354 PolarHBondContact OG1-N 2.95Å; T352-S354 PolarHBondContact OG1-OG 2.88Å
353	G	80.5	Confident	83.2	Confident	4 Å²	4	20.7 Å²	20.7	4%	0.041	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.5	7.3	-168.7	0	0	0	0	0	114.3	F107 W318 T349	F107-G353 WeakPolarHBondContact CE2-O 3.42Å; F107-G353 WeakPolarHBondContact CZ-O 3.47Å; W318-G353 PolarHBondContact NE1-O 3.06Å; T349-G353 WeakPolarHBondContact O-CA 3.26Å; T349-G353 PolarHBondContact O-N 3.1Å
354	S	90.6	Very high	81.4	Confident	23 Å²	23	22.2 Å²	22.2	16%	0.161	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	154.1	-177.1	65.9	0	0	0	0	113	Q321 T349 T352	Q321-S354 VanDerWaalsContact OE1-CB 3.26Å; T349-S354 WeakPolarHBondContact CB-O 3.27Å; T349-S354 WeakPolarHBondContact CB-OG 3.33Å; T349-S354 PolarHBondContact N-O 3.24Å; T349-S354 PolarHBondContact OG1-O 2.85Å; T349-S354 PolarHBondContact OG1-OG 2.9Å; T352-S354 PolarHBondContact O-N 3.07Å; T352-S354 WeakPolarHBondContact OG1-CB 3.47Å; T352-S354 PolarHBondContact OG1-N 2.95Å; T352-S354 PolarHBondContact OG1-OG 2.88Å
355	V	95.2	Very high	79.4	Confident	2 Å²	2	20.6 Å²	20.6	1%	0.012	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	144.5	176.6	-72	0	0	0	0	112.6	N270 W318 Q321 I322 I346 F347 I348	N270-V355 WeakPolarHBondContact CA-O 3.47Å; N270-V355 WeakPolarHBondContact CB-O 3.44Å; N270-V355 PolarHBondContact ND2-O 3.47Å; W318-V355 HydrophobicContact CB-CG1 4.34Å; W318-V355 HydrophobicContact CB-CG2 4.13Å; W318-V355 HydrophobicContact CD2-CG1 4.03Å; W318-V355 HydrophobicContact CG-CG1 3.75Å; W318-V355 HydrophobicContact CG-CG2 4.24Å; Q321-V355 HydrophobicContact CB-CG2 3.47Å; Q321-V355 VanDerWaalsContact CB-CG2 3.47Å; Q321-V355 HydrophobicContact CG-CG2 4.4Å; I322-V355 HydrophobicContact CG1-CG2 4.1Å; I346-V355 HydrophobicContact CG2-CB 4.11Å; I346-V355 HydrophobicContact CG2-CG1 4.38Å; F347-V355 CarbonylContact O-C 3.58Å; F347-V355 VanDerWaalsContact O-CA 3.22Å; F347-V355 WeakPolarHBondContact O-CA 3.42Å; I348-V355 HydrophobicContact CG1-CG1 3.95Å
356	K	96	Very high	77.4	Confident	28 Å²	28	21.9 Å²	21.9	12%	0.122	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	133.7	179.8	-61.4	-169.1	176.2	-175.1	0	111.3	P269 N270 V272 E293 M295 F347	P269-K356 VanDerWaalsContact O-CE 3.26Å; P269-K356 WeakPolarHBondContact O-CE 3.48Å; N270-K356 WeakPolarHBondContact O-CA 3.24Å; V272-K356 HydrophobicContact CG2-CB 3.68Å; E293-K356 IonicContact OE1-NZ 3.35Å; E293-K356 PolarHBondContact OE1-NZ 2.97Å; E293-K356 IonicContact OE2-NZ 3.88Å; E293-K356 PolarHBondContact OE2-NZ 2.96Å; M295-K356 HydrophobicContact CE-CB 4.2Å; M295-K356 HydrophobicContact CE-CD 3.9Å; M295-K356 HydrophobicContact CE-CG 4.17Å; M295-K356 HydrophobicContact SD-CD 4.02Å; F347-K356 PolarHBondContact N-O 3.1Å; F347-K356 PolarHBondContact O-N 2.88Å
357	I	95.9	Very high	75.3	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	127.4	174.5	-49	174.7	0	0	0	108.9	N270 I271 V272 I322 L326 H338 L341	N270-I357 PolarHBondContact O-N 2.92Å; I271-I357 WeakPolarHBondContact CA-O 3.43Å; I271-I357 HydrophobicContact CD1-CB 3.99Å; I271-I357 HydrophobicContact CD1-CD1 4.21Å; I271-I357 HydrophobicContact CD1-CG1 4.41Å; V272-I357 PolarHBondContact N-O 3.46Å; I322-I357 HydrophobicContact CG2-CD1 4.02Å; I322-I357 HydrophobicContact CG2-CG1 4.47Å; L326-I357 HydrophobicContact CD2-CD1 4.01Å; L326-I357 HydrophobicContact CG-CD1 4.1Å; H338-I357 WeakPolarHBondContact CD2-CG2 3.22Å; H338-I357 WeakPolarHBondContact NE2-CG2 3.44Å; L341-I357 HydrophobicContact CD1-CD1 4.38Å; L341-I357 HydrophobicContact CD1-CG2 3.67Å
358	G	91.4	Very high	72.9	Confident	4 Å²	4	28.1 Å²	28.1	4%	0.041	16%	0.16	C	C	.	.			trans	-128.1	-174.9	177.6	0	0	0	0	0	112.6	H338 N345 L360	H338-G358 PolarHBondContact NE2-O 3.48Å; N345-G358 PolarHBondContact O-N 3.49Å; G358-L360 VanDerWaalsContact C-N 3.26Å; G358-L360 PolarHBondContact O-N 3Å
359	D	82.9	Confident	70.5	Confident	41 Å²	41	28.8 Å²	28.8	22%	0.219	16%	0.164	C	C	.	.			trans	64.3	21.7	-176	-79.1	35.4	0	0	0	115.7	K224 N345 L362	K224-D359 VanDerWaalsContact CE-OD2 3.26Å; K224-D359 WeakPolarHBondContact CE-OD2 3.29Å; K224-D359 IonicContact NZ-OD1 2.72Å; K224-D359 PolarHBondContact NZ-OD1 3.29Å; K224-D359 IonicContact NZ-OD2 2.85Å; K224-D359 PolarHBondContact NZ-OD2 2.67Å; N345-D359 HydrophobicContact CB-CB 4.29Å; D359-L362 HydrophobicContact CB-CD1 4.18Å
360	L	74.8	Confident	67.8	Low	19 Å²	19	30.2 Å²	30.2	10%	0.099	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	147.4	167.4	-69.1	171.1	0	0	0	112.5	L263 L266 I271 L329 H338 G358 L362	L263-L360 HydrophobicContact CD1-CB 4.49Å; L263-L360 HydrophobicContact CD2-CB 3.68Å; L263-L360 HydrophobicContact CD2-CD1 4.25Å; L266-L360 HydrophobicContact CD1-CD1 4.2Å; I271-L360 HydrophobicContact CG2-CD1 3.66Å; L329-L360 HydrophobicContact CD1-CD2 3.77Å; L329-L360 HydrophobicContact CD2-CD1 4.05Å; L329-L360 HydrophobicContact CD2-CD2 4.24Å; H338-L360 HydrophobicContact CB-CD2 4.27Å; H338-L360 WeakPolarHBondContact CD2-CD2 3.44Å; G358-L360 VanDerWaalsContact C-N 3.26Å; G358-L360 PolarHBondContact O-N 3Å; L360-L362 PolarHBondContact O-N 3.24Å
361	G	60.7	Low	66	Low	8 Å²	8	35.9 Å²	35.9	8%	0.082	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	-16.6	176.8	0	0	0	0	0	116.3	E259 A363 T364	E259-G361 VanDerWaalsContact OE1-CA 3.26Å; E259-G361 WeakPolarHBondContact OE1-CA 3.42Å; G361-A363 PolarHBondContact O-N 2.92Å; G361-T364 PolarHBondContact O-N 3.47Å
362	L	60.8	Low	64.5	Low	16 Å²	16	37.9 Å²	37.9	8%	0.084	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	5.1	177.1	-60.5	-179	0	0	0	113.7	K224 L243 L290 D359 L360 L365 K366	K224-L362 HydrophobicContact CD-CD1 3.93Å; L243-L362 HydrophobicContact CD1-CD2 4.43Å; L243-L362 HydrophobicContact CD2-CD2 4.02Å; L290-L362 HydrophobicContact CD1-CD2 4Å; D359-L362 HydrophobicContact CB-CD1 4.18Å; L360-L362 PolarHBondContact O-N 3.24Å; L362-L365 HydrophobicContact CD2-CD1 4.37Å; L362-K366 VanDerWaalsContact O-CD 3.31Å; L362-K366 WeakPolarHBondContact O-CD 3.44Å; L362-K366 WeakPolarHBondContact O-CE 3.31Å; L362-K366 WeakPolarHBondContact O-CG 3.44Å; L362-K366 PolarHBondContact O-NZ 3.3Å
363	A	57	Low	63.1	Low	7 Å²	7	38.7 Å²	38.7	6%	0.058	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-49.3	169.3	0	0	0	0	0	111.2	R339 G361 L365 K366 D367	R339-A363 HydrophobicContact CB-CB 3.95Å; G361-A363 PolarHBondContact O-N 2.92Å; A363-L365 PolarHBondContact O-N 3.38Å; A363-L365 VanDerWaalsContact O-N 3.07Å; A363-K366 WeakPolarHBondContact O-CA 3.27Å; A363-K366 VanDerWaalsContact O-CB 3.29Å; A363-K366 WeakPolarHBondContact O-CB 3.37Å; A363-K366 PolarHBondContact O-N 3.22Å; A363-D367 PolarHBondContact O-N 2.63Å
364	T	55.6	Low	61.5	Low	33 Å²	33	41.7 Å²	41.7	20%	0.202	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.6	-174	-41.8	0	0	0	0	113.5	E259 G361	E259-T364 VanDerWaalsContact CD-OG1 3.29Å; E259-T364 PolarHBondContact OE1-OG1 3.32Å; E259-T364 WeakPolarHBondContact OE2-CB 3.43Å; E259-T364 PolarHBondContact OE2-OG1 3.15Å; G361-T364 PolarHBondContact O-N 3.47Å
365	L	49.1	Very low	60	Low	22 Å²	22	43.8 Å²	43.8	12%	0.115	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-21.7	171.6	-67.6	-178.9	0	0	0	114.4	L243 L248 F256 L362 A363 S369	L243-L365 HydrophobicContact CD1-CD1 3.57Å; L243-L365 HydrophobicContact CD2-CD1 4.12Å; L243-L365 HydrophobicContact CG-CD1 4.42Å; L248-L365 HydrophobicContact CD1-CD2 3.77Å; L248-L365 HydrophobicContact CD2-CD2 3.95Å; F256-L365 HydrophobicContact CB-CD2 4.07Å; F256-L365 HydrophobicContact CD2-CD1 3.65Å; F256-L365 HydrophobicContact CD2-CD2 3.73Å; F256-L365 HydrophobicContact CD2-CG 3.56Å; F256-L365 HydrophobicContact CE1-CD1 4.37Å; F256-L365 HydrophobicContact CE2-CD1 3.46Å; F256-L365 VanDerWaalsContact CE2-CD1 3.46Å; F256-L365 HydrophobicContact CE2-CD2 4.42Å; F256-L365 HydrophobicContact CE2-CG 3.84Å; F256-L365 HydrophobicContact CG-CD1 4.19Å; F256-L365 HydrophobicContact CG-CD2 3.86Å; F256-L365 HydrophobicContact CG-CG 4.18Å; F256-L365 HydrophobicContact CZ-CD1 3.86Å; L362-L365 HydrophobicContact CD2-CD1 4.37Å; A363-L365 PolarHBondContact O-N 3.38Å; A363-L365 VanDerWaalsContact O-N 3.07Å; L365-S369 PolarHBondContact O-OG 2.84Å
366	K	52.3	Low	58.4	Low	37 Å²	37	44.7 Å²	44.7	16%	0.161	25%	0.251	C	S	.	.	H	α-helix	trans	-75.6	-32.9	175	-66	164.2	-169.2	150.2	0	110.6	F223 D340 L362 A363 K368 S369 I375	F223-K366 HydrophobicContact CD2-CG 4.26Å; F223-K366 HydrophobicContact CE2-CG 4.01Å; D340-K366 IonicContact OD2-NZ 3.48Å; D340-K366 PolarHBondContact OD2-NZ 3.49Å; L362-K366 VanDerWaalsContact O-CD 3.31Å; L362-K366 WeakPolarHBondContact O-CD 3.44Å; L362-K366 WeakPolarHBondContact O-CE 3.31Å; L362-K366 WeakPolarHBondContact O-CG 3.44Å; L362-K366 PolarHBondContact O-NZ 3.3Å; A363-K366 WeakPolarHBondContact O-CA 3.27Å; A363-K366 VanDerWaalsContact O-CB 3.29Å; A363-K366 WeakPolarHBondContact O-CB 3.37Å; A363-K366 PolarHBondContact O-N 3.22Å; K366-K368 PolarHBondContact O-N 2.89Å; K366-S369 PolarHBondContact O-N 2.87Å; K366-I375 HydrophobicContact CB-CG2 4.02Å
367	D	50.5	Low	57.5	Low	64 Å²	64	44.3 Å²	44.3	34%	0.342	25%	0.251	S	S	.	.	H	α-helix	trans	-44.6	-29.4	-174	-67.4	-3.2	0	0	0	116.1	A363 I375	A363-D367 PolarHBondContact O-N 2.63Å; D367-I375 WeakPolarHBondContact OD1-CG2 3.37Å
368	K	44.9	Very low	56.9	Low	107 Å²	107	44.9 Å²	44.9	47%	0.465	26%	0.255	S	S	.	.	H	α-helix	trans	-127.5	-15.5	-170.6	-54.8	-169	-170.8	-171.9	0	116.1	E252 K366 C370	E252-K368 HydrophobicContact CG-CD 3.82Å; E252-K368 WeakPolarHBondContact OE1-CD 2.78Å; E252-K368 IonicContact OE1-NZ 2.63Å; E252-K368 PolarHBondContact OE1-NZ 3.26Å; K366-K368 PolarHBondContact O-N 2.89Å; K368-C370 VanDerWaalsContact C-N 3.26Å; K368-C370 PolarHBondContact O-N 3.45Å
369	S	41.1	Very low	56.9	Low	13 Å²	13	46.1 Å²	46.1	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-77.9	-8	-165.3	59.2	0	0	0	0	114.7	F223 K247 L365 K366	F223-S369 WeakPolarHBondContact CE1-OG 3.46Å; F223-S369 WeakPolarHBondContact CZ-OG 3.49Å; K247-S369 WeakPolarHBondContact CD-O 3.41Å; K247-S369 PolarHBondContact NZ-O 3.39Å; L365-S369 PolarHBondContact O-OG 2.84Å; K366-S369 PolarHBondContact O-N 2.87Å
370	C	29.7	Very low	57.3	Low	51 Å²	51	44.4 Å²	44.4	35%	0.345	25%	0.25	S	S	.	.			trans	-161.3	114.5	157.7	-177	0	0	0	0	111	K368 K372 S373	K368-C370 VanDerWaalsContact C-N 3.26Å; K368-C370 PolarHBondContact O-N 3.45Å; C370-K372 PolarHBondContact O-N 3.14Å; C370-S373 WeakPolarHBondContact CB-OG 3.5Å; C370-S373 PolarHBondContact O-N 3.37Å; C370-S373 PolarHBondContact O-OG 3.47Å; C370-S373 VanDerWaalsContact O-OG 3.08Å
371	P	36.8	Very low	57.9	Low	136 Å²	136	43.9 Å²	43.9	88%	0.883	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	1.6	175.1	-25.5	35.6	0	0	0	116.2
372	K	36.5	Very low	59.2	Low	146 Å²	146	43.5 Å²	43.5	64%	0.635	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-113	-1.9	175.6	-59.5	-174.1	-179.9	-176.1	0	113.8	C370 Y1212	C370-K372 PolarHBondContact O-N 3.14Å; K372-Y1212 WeakPolarHBondContact CE-OH 3.39Å; K372-Y1212 VanDerWaalsContact NZ-CE1 3.33Å; K372-Y1212 PolarHBondContact NZ-OH 2.93Å
373	S	42.5	Very low	60.4	Low	50 Å²	50	43.7 Å²	43.7	35%	0.35	25%	0.245	S	C	.	.	S	Bend	trans	-101.6	125.2	174.8	59.2	0	0	0	0	110.5	C370 I375	C370-S373 WeakPolarHBondContact CB-OG 3.5Å; C370-S373 PolarHBondContact O-N 3.37Å; C370-S373 PolarHBondContact O-OG 3.47Å; C370-S373 VanDerWaalsContact O-OG 3.08Å; S373-I375 PolarHBondContact O-N 2.64Å
374	V	47.7	Very low	61.8	Low	67 Å²	67	44.1 Å²	44.1	41%	0.406	25%	0.246	S	C	.	.			trans	-54.2	126.3	172	178.8	0	0	0	0	109.5	G376 P378 M381 P419	V374-G376 PolarHBondContact O-N 2.7Å; V374-P378 HydrophobicContact CG1-CB 4.4Å; V374-M381 HydrophobicContact CG1-CE 3.89Å; V374-M381 HydrophobicContact CG1-SD 3.43Å; V374-M381 WeakPolarHBondContact CG1-SD 3.44Å; V374-P419 HydrophobicContact CG2-CB 4.41Å
375	I	57.6	Low	63.1	Low	67 Å²	67	44 Å²	44	34%	0.344	24%	0.244	S	C	.	.	S	Bend	trans	-82.7	104.9	-179.5	-65.5	146.1	0	0	0	107.9	K366 D367 S373 M381	K366-I375 HydrophobicContact CB-CG2 4.02Å; D367-I375 WeakPolarHBondContact OD1-CG2 3.37Å; S373-I375 PolarHBondContact O-N 2.64Å; I375-M381 VanDerWaalsContact O-CE 3.28Å; I375-M381 WeakPolarHBondContact O-CE 3.41Å; I375-M381 VanDerWaalsContact O-SD 3.41Å
376	G	61.5	Low	64.3	Low	22 Å²	22	46.3 Å²	46.3	23%	0.227	25%	0.252	C	S	.	.	S	Bend	trans	109.1	-152	-173	0	0	0	0	0	111.7	V374	V374-G376 PolarHBondContact O-N 2.7Å
377	T	78.4	Confident	65.3	Low	19 Å²	19	50.6 Å²	50.6	12%	0.117	27%	0.272	C	S	.	.			trans	-132.1	104.6	-171	-46.4	0	0	0	0	107.5	D340 K342 E379 F380 M381 Y411	D340-T377 PolarHBondContact OD1-OG1 3.35Å; K342-T377 HydrophobicContact CD-CG2 4.09Å; K342-T377 PolarHBondContact NZ-OG1 3.33Å; T377-E379 VanDerWaalsContact CG2-OE2 3.28Å; T377-E379 WeakPolarHBondContact CG2-OE2 3.43Å; T377-E379 PolarHBondContact O-N 3.45Å; T377-F380 HydrophobicContact CG2-CD2 3.93Å; T377-F380 HydrophobicContact CG2-CE2 4.45Å; T377-F380 PolarHBondContact O-N 3.42Å; T377-M381 WeakPolarHBondContact O-CG 3.24Å; T377-M381 PolarHBondContact O-N 3.02Å; T377-Y411 VanDerWaalsContact CG2-OH 3.25Å; T377-Y411 WeakPolarHBondContact CG2-OH 3.49Å
378	P	83.7	Confident	66.1	Low	13 Å²	13	55.6 Å²	55.6	8%	0.084	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.5	-158.9	22.9	-33.5	0	0	0	114.3	V374 F380 P419 I422	V374-P378 HydrophobicContact CG1-CB 4.4Å; P378-F380 VanDerWaalsContact C-N 3.28Å; P378-F380 PolarHBondContact O-N 3.12Å; P378-P419 HydrophobicContact CB-CB 4.35Å; P378-P419 HydrophobicContact CG-CB 4.05Å; P378-P419 HydrophobicContact CG-CG 4.2Å; P378-I422 HydrophobicContact CB-CD1 4.43Å; P378-I422 HydrophobicContact CB-CG2 4.42Å; P378-I422 HydrophobicContact CG-CD1 4.22Å; P378-I422 WeakPolarHBondContact O-CG2 3.38Å
379	E	90	Very high	67.5	Low	30 Å²	30	56.4 Å²	56.4	14%	0.14	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-19.2	175.8	-52.8	80.8	-170.9	0	0	113.6	T377 Y411 P412 Y413 I422	T377-E379 VanDerWaalsContact CG2-OE2 3.28Å; T377-E379 WeakPolarHBondContact CG2-OE2 3.43Å; T377-E379 PolarHBondContact O-N 3.45Å; E379-Y411 HydrophobicContact CB-CE1 4.12Å; E379-Y411 VanDerWaalsContact CD-CE1 3.46Å; E379-Y411 HydrophobicContact CG-CD1 4.23Å; E379-Y411 HydrophobicContact CG-CE1 3.53Å; E379-Y411 PolarHBondContact OE2-OH 3.04Å; E379-P412 HydrophobicContact CB-CB 4.34Å; E379-P412 WeakPolarHBondContact CG-O 3.45Å; E379-Y413 HydrophobicContact CB-CD2 4.35Å; E379-I422 HydrophobicContact CG-CD1 3.76Å; E379-I422 WeakPolarHBondContact OE1-CD1 3.24Å
380	F	91.2	Very high	69.6	Low	6 Å²	6	59 Å²	59	3%	0.026	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-7.9	-179.9	-64.6	-100.1	0	0	0	113	K342 T377 P378 Y397 A398 M401 E405 Y411 P412	K342-F380 HydrophobicContact CB-CD1 3.87Å; K342-F380 HydrophobicContact CB-CD2 4.07Å; K342-F380 HydrophobicContact CB-CE1 3.9Å; K342-F380 HydrophobicContact CB-CE2 4.11Å; K342-F380 HydrophobicContact CB-CG 3.97Å; K342-F380 HydrophobicContact CB-CZ 4.04Å; T377-F380 HydrophobicContact CG2-CD2 3.93Å; T377-F380 HydrophobicContact CG2-CE2 4.45Å; T377-F380 PolarHBondContact O-N 3.42Å; P378-F380 VanDerWaalsContact C-N 3.28Å; P378-F380 PolarHBondContact O-N 3.12Å; F380-Y397 WeakPolarHBondContact O-CD1 3.39Å; F380-A398 HydrophobicContact CB-CB 4.4Å; F380-M401 HydrophobicContact CD1-CB 3.61Å; F380-M401 HydrophobicContact CE1-CB 3.9Å; F380-M401 HydrophobicContact CG-CB 4.28Å; F380-E405 WeakPolarHBondContact CZ-OE2 3.23Å; F380-Y411 HydrophobicContact CE2-CD2 4.45Å; F380-Y411 AromaticContact CE2-CE2 3.6Å; F380-Y411 HydrophobicContact CE2-CE2 3.6Å; F380-Y411 AromaticContact CE2-CZ 3.82Å; F380-Y411 HydrophobicContact CZ-CE2 4.13Å; F380-P412 HydrophobicContact CZ-CG 4.35Å
381	M	88.8	Confident	72.4	Confident	7 Å²	7	58.5 Å²	58.5	3%	0.034	31%	0.305	C	S	.	.			trans	-77.9	129.1	-178.8	-71.6	169.8	68.9	0	0	111.5	V374 I375 T377 M385 Y386 Y397	V374-M381 HydrophobicContact CG1-CE 3.89Å; V374-M381 HydrophobicContact CG1-SD 3.43Å; V374-M381 WeakPolarHBondContact CG1-SD 3.44Å; I375-M381 VanDerWaalsContact O-CE 3.28Å; I375-M381 WeakPolarHBondContact O-CE 3.41Å; I375-M381 VanDerWaalsContact O-SD 3.41Å; T377-M381 WeakPolarHBondContact O-CG 3.24Å; T377-M381 PolarHBondContact O-N 3.02Å; M381-M385 HydrophobicContact CB-CB 4.39Å; M381-M385 HydrophobicContact CB-CE 4.48Å; M381-M385 HydrophobicContact CB-SD 3.9Å; M381-M385 HydrophobicContact CE-CB 4.09Å; M381-M385 HydrophobicContact CE-CE 4.27Å; M381-M385 HydrophobicContact CG-CE 3.87Å; M381-M385 HydrophobicContact CG-SD 3.9Å; M381-Y386 HydrophobicContact CB-CE2 4.21Å; M381-Y386 HydrophobicContact CE-CD1 4.26Å; M381-Y386 HydrophobicContact CE-CE1 3.76Å; M381-Y386 HydrophobicContact CE-CE2 4.36Å; M381-Y397 VanDerWaalsContact O-CE1 3.25Å; M381-Y397 WeakPolarHBondContact O-CE1 3.36Å
382	A	88.1	Confident	75	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.282	C	S	.	.			trans	-67.3	153.9	172.4	0	0	0	0	0	111.3	E384 M385 V394 Y397	A382-E384 VanDerWaalsContact C-N 3.25Å; A382-E384 WeakPolarHBondContact CB-OE1 3.4Å; A382-E384 WeakPolarHBondContact CB-OE2 3.47Å; A382-E384 PolarHBondContact O-N 2.77Å; A382-M385 HydrophobicContact CB-CG 4.23Å; A382-M385 WeakPolarHBondContact O-CB 3.5Å; A382-M385 PolarHBondContact O-N 3.43Å; A382-V394 HydrophobicContact CB-CB 4.27Å; A382-V394 HydrophobicContact CB-CG1 4.13Å; A382-Y397 HydrophobicContact CB-CD1 3.97Å; A382-Y397 HydrophobicContact CB-CD2 4.22Å; A382-Y397 HydrophobicContact CB-CG 3.76Å
383	P	86	Confident	77.7	Confident	20 Å²	20	49.8 Å²	49.8	13%	0.13	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-56.8	-36.5	-178.9	19.2	-30	0	0	0	113.5	M385 Y386 V426 T427 P466	P383-M385 VanDerWaalsContact C-N 3.3Å; P383-M385 PolarHBondContact O-N 3.49Å; P383-Y386 WeakPolarHBondContact O-CD2 3.48Å; P383-Y386 PolarHBondContact O-N 3.05Å; P383-V426 HydrophobicContact CB-CG1 3.9Å; P383-V426 HydrophobicContact CG-CG1 4.31Å; P383-T427 HydrophobicContact CB-CG2 4.3Å; P383-P466 WeakPolarHBondContact CG-O 3.47Å
384	E	84.8	Confident	80.1	Confident	16 Å²	16	47.5 Å²	47.5	8%	0.075	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-76.6	-8	178	72.9	-73.7	176.9	0	0	114.3	A382 Y386 E387 V394 R471	A382-E384 VanDerWaalsContact C-N 3.25Å; A382-E384 WeakPolarHBondContact CB-OE1 3.4Å; A382-E384 WeakPolarHBondContact CB-OE2 3.47Å; A382-E384 PolarHBondContact O-N 2.77Å; E384-Y386 PolarHBondContact O-N 2.8Å; E384-E387 CarbonylContact O-C 3.59Å; E384-E387 WeakPolarHBondContact O-CA 3.42Å; E384-E387 WeakPolarHBondContact O-CB 3.33Å; E384-E387 PolarHBondContact O-N 3.49Å; E384-V394 HydrophobicContact CG-CG1 4.36Å; E384-V394 WeakPolarHBondContact OE1-CG1 3.48Å; E384-R471 VanDerWaalsContact CD-NH2 3.32Å; E384-R471 IonicContact OE1-CZ 2.79Å; E384-R471 IonicContact OE1-NH1 2.61Å; E384-R471 PolarHBondContact OE1-NH1 3.39Å; E384-R471 IonicContact OE1-NH2 3.18Å; E384-R471 PolarHBondContact OE1-NH2 3.17Å; E384-R471 VanDerWaalsContact OE1-NH2 3.16Å; E384-R471 IonicContact OE2-CZ 2.78Å; E384-R471 IonicContact OE2-NH1 2.71Å; E384-R471 IonicContact OE2-NH2 2.92Å; E384-R471 PolarHBondContact OE2-NH2 2.8Å
385	M	83	Confident	82.3	Confident	30 Å²	30	44.3 Å²	44.3	15%	0.148	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-71.5	-10.8	168.5	-70.6	-176.5	67.4	0	0	113.2	R339 M381 A382 P383 E387 V394	R339-M385 WeakPolarHBondContact O-CE 3.3Å; M381-M385 HydrophobicContact CB-CB 4.39Å; M381-M385 HydrophobicContact CB-CE 4.48Å; M381-M385 HydrophobicContact CB-SD 3.9Å; M381-M385 HydrophobicContact CE-CB 4.09Å; M381-M385 HydrophobicContact CE-CE 4.27Å; M381-M385 HydrophobicContact CG-CE 3.87Å; M381-M385 HydrophobicContact CG-SD 3.9Å; A382-M385 HydrophobicContact CB-CG 4.23Å; A382-M385 WeakPolarHBondContact O-CB 3.5Å; A382-M385 PolarHBondContact O-N 3.43Å; P383-M385 VanDerWaalsContact C-N 3.3Å; P383-M385 PolarHBondContact O-N 3.49Å; M385-E387 VanDerWaalsContact C-N 3.29Å; M385-V394 HydrophobicContact CG-CB 3.99Å; M385-V394 HydrophobicContact CG-CG1 3.62Å; M385-V394 HydrophobicContact SD-CB 4.01Å; M385-V394 HydrophobicContact SD-CG1 4.33Å
386	Y	74.1	Confident	84.2	Confident	72 Å²	72	41.2 Å²	41.2	28%	0.282	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-89.5	0.9	168.7	-57.5	-82.1	0	0	0	111.9	M381 P383 E384 Y423	M381-Y386 HydrophobicContact CB-CE2 4.21Å; M381-Y386 HydrophobicContact CE-CD1 4.26Å; M381-Y386 HydrophobicContact CE-CE1 3.76Å; M381-Y386 HydrophobicContact CE-CE2 4.36Å; P383-Y386 WeakPolarHBondContact O-CD2 3.48Å; P383-Y386 PolarHBondContact O-N 3.05Å; E384-Y386 PolarHBondContact O-N 2.8Å; Y386-Y423 AromaticContact CD1-CD2 3.68Å; Y386-Y423 HydrophobicContact CD1-CD2 3.68Å; Y386-Y423 AromaticContact CD1-CE2 3.95Å; Y386-Y423 HydrophobicContact CD1-CE2 3.95Å; Y386-Y423 AromaticContact CD2-CD2 3.8Å; Y386-Y423 HydrophobicContact CD2-CD2 3.8Å; Y386-Y423 HydrophobicContact CD2-CE2 4.01Å; Y386-Y423 AromaticContact CE1-CD2 3.8Å; Y386-Y423 HydrophobicContact CE1-CD2 3.8Å; Y386-Y423 AromaticContact CE2-CD2 3.93Å; Y386-Y423 HydrophobicContact CE2-CD2 3.93Å; Y386-Y423 AromaticContact CG-CD2 3.68Å; Y386-Y423 HydrophobicContact CG-CD2 3.68Å; Y386-Y423 AromaticContact CG-CE2 3.66Å; Y386-Y423 HydrophobicContact CG-CE2 3.66Å; Y386-Y423 AromaticContact CZ-CD2 3.93Å
387	E	74.7	Confident	85.8	Confident	126 Å²	126	40.5 Å²	40.5	59%	0.589	20%	0.195	S	C	*	.	S	Bend	trans	-110	161.2	168.3	-55.3	-176.6	-166.1	0	0	109.2	E384 M385 N389	E384-E387 CarbonylContact O-C 3.59Å; E384-E387 WeakPolarHBondContact O-CA 3.42Å; E384-E387 WeakPolarHBondContact O-CB 3.33Å; E384-E387 PolarHBondContact O-N 3.49Å; M385-E387 VanDerWaalsContact C-N 3.29Å; E387-N389 VanDerWaalsContact C-N 3.26Å; E387-N389 PolarHBondContact O-N 3.35Å
388	E	67.8	Low	86.6	Confident	170 Å²	170	39.8 Å²	39.8	79%	0.794	19%	0.191	S	C	*	.	S	Bend	trans	-79.3	-8.4	-179.2	-62.5	-176.6	162.2	0	0	113.3
389	N	73.9	Confident	87.3	Confident	124 Å²	124	39.1 Å²	39.1	66%	0.663	19%	0.187	S	C	*	.			trans	-113.8	88.1	-171.1	-67.6	-46.6	0	0	0	112.6	E387	E387-N389 VanDerWaalsContact C-N 3.26Å; E387-N389 PolarHBondContact O-N 3.35Å
390	Y	84	Confident	87.6	Confident	68 Å²	68	37.7 Å²	37.7	27%	0.267	18%	0.181	S	C	.	.			trans	-130.3	163.2	179.2	59.9	-96.6	0	0	0	112.7	R339 V394	R339-Y390 HydrophobicContact CG-CE2 4.07Å; R339-Y390 VanDerWaalsContact CZ-OH 3.31Å; R339-Y390 PolarHBondContact NE-OH 3.37Å; R339-Y390 PolarHBondContact NH1-OH 2.9Å; Y390-V394 HydrophobicContact CD2-CG1 4.29Å; Y390-V394 HydrophobicContact CG-CG1 4.28Å
391	D	88.4	Confident	87.9	Confident	40 Å²	40	37.5 Å²	37.5	21%	0.214	18%	0.18	C	C	.	.			trans	-137.7	-170.1	-173.5	54.8	48.9	0	0	0	111	S393 V394 R468	D391-S393 PolarHBondContact O-N 2.75Å; D391-S393 WeakPolarHBondContact OD1-CB 3.33Å; D391-S393 PolarHBondContact OD1-N 2.58Å; D391-S393 PolarHBondContact OD1-OG 2.86Å; D391-V394 WeakPolarHBondContact O-CG2 3.15Å; D391-V394 PolarHBondContact O-N 3.43Å; D391-R468 VanDerWaalsContact OD2-CD 3.23Å; D391-R468 WeakPolarHBondContact OD2-CD 3.39Å; D391-R468 IonicContact OD2-CZ 3.7Å; D391-R468 IonicContact OD2-NE 3.19Å; D391-R468 IonicContact OD2-NH1 3.47Å; D391-R468 PolarHBondContact OD2-NH1 2.97Å
392	E	91.7	Very high	88.3	Confident	86 Å²	86	37.1 Å²	37.1	40%	0.402	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-17.3	-178.8	63.9	-86.9	-166.5	0	0	115.2	H330 V394 D395	H330-E392 HydrophobicContact CB-CB 4.39Å; E392-V394 PolarHBondContact O-N 3.32Å; E392-D395 PolarHBondContact O-N 3.46Å
393	S	93.3	Very high	88.7	Confident	12 Å²	12	37.1 Å²	37.1	8%	0.084	18%	0.178	C	C	.	.	H	α-helix	trans	-67.4	-16.2	179.4	72.7	0	0	0	0	113.9	D391 D395 V396 Y397 R468 R471	D391-S393 PolarHBondContact O-N 2.75Å; D391-S393 WeakPolarHBondContact OD1-CB 3.33Å; D391-S393 PolarHBondContact OD1-N 2.58Å; D391-S393 PolarHBondContact OD1-OG 2.86Å; S393-D395 VanDerWaalsContact C-N 3.32Å; S393-V396 PolarHBondContact O-N 3.31Å; S393-Y397 PolarHBondContact O-N 3.02Å; S393-R468 WeakPolarHBondContact OG-CB 3.29Å; S393-R471 PolarHBondContact O-NH1 3.38Å; S393-R471 PolarHBondContact OG-NH1 3.11Å
394	V	92.5	Very high	89.2	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-65.7	-37.7	172.7	-55.1	0	0	0	0	111.2	I337 A382 E384 M385 Y390 D391 E392 V396 Y397 A398	I337-V394 HydrophobicContact CG2-CG2 3.59Å; A382-V394 HydrophobicContact CB-CB 4.27Å; A382-V394 HydrophobicContact CB-CG1 4.13Å; E384-V394 HydrophobicContact CG-CG1 4.36Å; E384-V394 WeakPolarHBondContact OE1-CG1 3.48Å; M385-V394 HydrophobicContact CG-CB 3.99Å; M385-V394 HydrophobicContact CG-CG1 3.62Å; M385-V394 HydrophobicContact SD-CB 4.01Å; M385-V394 HydrophobicContact SD-CG1 4.33Å; Y390-V394 HydrophobicContact CD2-CG1 4.29Å; Y390-V394 HydrophobicContact CG-CG1 4.28Å; D391-V394 WeakPolarHBondContact O-CG2 3.15Å; D391-V394 PolarHBondContact O-N 3.43Å; E392-V394 PolarHBondContact O-N 3.32Å; V394-V396 VanDerWaalsContact C-N 3.28Å; V394-V396 PolarHBondContact O-N 2.76Å; V394-Y397 PolarHBondContact O-N 3.29Å; V394-A398 WeakPolarHBondContact O-CB 3.5Å; V394-A398 PolarHBondContact O-N 2.89Å
395	D	94.7	Very high	89.7	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-70.7	-28.9	178	-64.9	-23	0	0	0	110.8	L326 H330 H338 R339 L341 E392 S393 F399	L326-D395 HydrophobicContact CD1-CB 4.31Å; L326-D395 HydrophobicContact CD2-CB 3.98Å; H330-D395 IonicContact CD2-OD2 4Å; H330-D395 IonicContact CE1-OD2 3.21Å; H330-D395 IonicContact NE2-OD2 2.99Å; H330-D395 PolarHBondContact NE2-OD2 2.92Å; H338-D395 WeakPolarHBondContact CB-OD1 3.36Å; H338-D395 PolarHBondContact N-OD1 2.95Å; H338-D395 PolarHBondContact N-OD2 3.08Å; R339-D395 PolarHBondContact N-OD1 3.47Å; L341-D395 WeakPolarHBondContact CD2-O 3.42Å; E392-D395 PolarHBondContact O-N 3.46Å; S393-D395 VanDerWaalsContact C-N 3.32Å; D395-F399 VanDerWaalsContact O-CB 3.26Å; D395-F399 WeakPolarHBondContact O-CB 3.39Å; D395-F399 PolarHBondContact O-N 3.18Å
396	V	96.7	Very high	90.2	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.012	16%	0.164	C	C	.	.	H	α-helix	trans	-72.1	-40.2	173.6	-175.9	0	0	0	0	111.6	S393 V394 F399 G400 C463 Y472 L477	S393-V396 PolarHBondContact O-N 3.31Å; V394-V396 VanDerWaalsContact C-N 3.28Å; V394-V396 PolarHBondContact O-N 2.76Å; V396-F399 WeakPolarHBondContact O-CB 2.95Å; V396-F399 PolarHBondContact O-N 2.98Å; V396-G400 PolarHBondContact O-N 3.04Å; V396-C463 HydrophobicContact CG1-CB 4.08Å; V396-Y472 WeakPolarHBondContact CG1-O 3.48Å; V396-L477 HydrophobicContact CG1-CD1 3.89Å
397	Y	96.1	Very high	91.2	Very high	6 Å²	6	32.4 Å²	32.4	2%	0.024	16%	0.157	C	C	.	.	H	α-helix	trans	-59.7	-48.3	172.3	-177.7	-82.6	0	0	0	110.8	F380 M381 A382 S393 V394 F399 G400 M401 C463	F380-Y397 WeakPolarHBondContact O-CD1 3.39Å; M381-Y397 VanDerWaalsContact O-CE1 3.25Å; M381-Y397 WeakPolarHBondContact O-CE1 3.36Å; A382-Y397 HydrophobicContact CB-CD1 3.97Å; A382-Y397 HydrophobicContact CB-CD2 4.22Å; A382-Y397 HydrophobicContact CB-CG 3.76Å; S393-Y397 PolarHBondContact O-N 3.02Å; V394-Y397 PolarHBondContact O-N 3.29Å; Y397-F399 VanDerWaalsContact C-N 3.35Å; Y397-F399 PolarHBondContact O-N 3.06Å; Y397-G400 PolarHBondContact O-N 2.95Å; Y397-G400 VanDerWaalsContact O-N 3.14Å; Y397-M401 HydrophobicContact CD1-CG 4.37Å; Y397-M401 HydrophobicContact CE1-CE 3.72Å; Y397-M401 HydrophobicContact CE1-CG 4.07Å; Y397-M401 HydrophobicContact CE2-CE 4.31Å; Y397-M401 PolarHBondContact O-N 2.94Å; Y397-M401 VanDerWaalsContact O-N 3.08Å; Y397-M401 VanDerWaalsContact OH-CE 3.25Å; Y397-M401 WeakPolarHBondContact OH-CE 3.48Å; Y397-C463 WeakPolarHBondContact CA-O 3.43Å
398	A	96	Very high	92	Very high	4 Å²	4	27.7 Å²	27.7	3%	0.033	14%	0.137	C	C	.	.	H	α-helix	trans	-62.4	-38.1	176.4	0	0	0	0	0	112.6	L341 F380 V394 M401 C402	L341-A398 HydrophobicContact CB-CB 3.87Å; L341-A398 HydrophobicContact CD2-CB 4.22Å; L341-A398 HydrophobicContact CG-CB 4.44Å; F380-A398 HydrophobicContact CB-CB 4.4Å; V394-A398 WeakPolarHBondContact O-CB 3.5Å; V394-A398 PolarHBondContact O-N 2.89Å; A398-M401 PolarHBondContact O-N 2.6Å; A398-C402 PolarHBondContact O-N 2.68Å; A398-C402 PolarHBondContact O-SG 2.97Å
399	F	97.9	Very high	93.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61	-43.4	171.3	166	-96	0	0	0	111.9	C319 I322 L323 L326 L341 D395 V396 Y397 M401 C402 M403 L477 F483	C319-F399 HydrophobicContact CB-CE2 3.92Å; C319-F399 HydrophobicContact CB-CZ 3.91Å; I322-F399 HydrophobicContact CB-CD2 4.38Å; I322-F399 HydrophobicContact CB-CE2 4.41Å; I322-F399 HydrophobicContact CG2-CD2 3.83Å; I322-F399 HydrophobicContact CG2-CE2 4.35Å; L323-F399 HydrophobicContact CD1-CE1 4.22Å; L323-F399 HydrophobicContact CD1-CE2 4.16Å; L323-F399 HydrophobicContact CD1-CZ 3.66Å; L323-F399 HydrophobicContact CD2-CD1 4.03Å; L323-F399 HydrophobicContact CD2-CD2 4.11Å; L323-F399 HydrophobicContact CD2-CE1 3.86Å; L323-F399 HydrophobicContact CD2-CE2 3.93Å; L323-F399 HydrophobicContact CD2-CG 4.17Å; L323-F399 HydrophobicContact CD2-CZ 3.81Å; L323-F399 HydrophobicContact CG-CD2 4.27Å; L323-F399 HydrophobicContact CG-CE1 4.22Å; L323-F399 HydrophobicContact CG-CE2 3.68Å; L323-F399 HydrophobicContact CG-CZ 3.65Å; L326-F399 HydrophobicContact CD1-CB 4.11Å; L341-F399 HydrophobicContact CD2-CB 4.18Å; D395-F399 VanDerWaalsContact O-CB 3.26Å; D395-F399 WeakPolarHBondContact O-CB 3.39Å; D395-F399 PolarHBondContact O-N 3.18Å; V396-F399 WeakPolarHBondContact O-CB 2.95Å; V396-F399 PolarHBondContact O-N 2.98Å; Y397-F399 VanDerWaalsContact C-N 3.35Å; Y397-F399 PolarHBondContact O-N 3.06Å; F399-M401 VanDerWaalsContact C-N 3.28Å; F399-M401 PolarHBondContact O-N 3.09Å; F399-C402 WeakPolarHBondContact O-CB 3.31Å; F399-C402 PolarHBondContact O-N 3.23Å; F399-C402 VanDerWaalsContact O-N 3.14Å; F399-M403 HydrophobicContact CE1-SD 4.21Å; F399-M403 HydrophobicContact CZ-SD 4.11Å; F399-M403 PolarHBondContact O-N 3.37Å; F399-L477 HydrophobicContact CD1-CD1 4.05Å; F399-L477 HydrophobicContact CE1-CD1 3.96Å; F399-F483 HydrophobicContact CZ-CE2 4.36Å; F399-F483 HydrophobicContact CZ-CZ 4Å
400	G	96.9	Very high	94	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-57.4	-40.9	174.1	0	0	0	0	0	112.5	V396 Y397 M403 L404	V396-G400 PolarHBondContact O-N 3.04Å; Y397-G400 PolarHBondContact O-N 2.95Å; Y397-G400 VanDerWaalsContact O-N 3.14Å; G400-M403 PolarHBondContact O-N 3.04Å; G400-L404 WeakPolarHBondContact O-CB 3.39Å; G400-L404 PolarHBondContact O-N 3.09Å
401	M	96.8	Very high	94.4	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-70.6	-35.1	174.6	-64.9	-58.6	-174.5	0	0	113.1	F380 Y397 A398 F399 L404 E405 P412 Y413 P443 T464	F380-M401 HydrophobicContact CD1-CB 3.61Å; F380-M401 HydrophobicContact CE1-CB 3.9Å; F380-M401 HydrophobicContact CG-CB 4.28Å; Y397-M401 HydrophobicContact CD1-CG 4.37Å; Y397-M401 HydrophobicContact CE1-CE 3.72Å; Y397-M401 HydrophobicContact CE1-CG 4.07Å; Y397-M401 HydrophobicContact CE2-CE 4.31Å; Y397-M401 PolarHBondContact O-N 2.94Å; Y397-M401 VanDerWaalsContact O-N 3.08Å; Y397-M401 VanDerWaalsContact OH-CE 3.25Å; Y397-M401 WeakPolarHBondContact OH-CE 3.48Å; A398-M401 PolarHBondContact O-N 2.6Å; F399-M401 VanDerWaalsContact C-N 3.28Å; F399-M401 PolarHBondContact O-N 3.09Å; M401-L404 WeakPolarHBondContact O-CB 3.48Å; M401-L404 PolarHBondContact O-N 3.33Å; M401-L404 HydrophobicContact SD-CD2 4.13Å; M401-E405 PolarHBondContact O-N 3.02Å; M401-P412 HydrophobicContact CB-CG 4.27Å; M401-P412 HydrophobicContact SD-CB 4.13Å; M401-P412 HydrophobicContact SD-CG 4.44Å; M401-Y413 HydrophobicContact CE-CE2 3.86Å; M401-P443 HydrophobicContact SD-CG 4.34Å; M401-T464 HydrophobicContact CE-CG2 3.79Å; M401-T464 HydrophobicContact CG-CG2 4.36Å; M401-T464 HydrophobicContact SD-CG2 4.02Å
402	C	97.3	Very high	94.6	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-63.9	-42.3	171.6	-64.3	0	0	0	0	111.9	K342 I346 A398 F399 L404 E405 M406	K342-C402 VanDerWaalsContact CA-SG 3.55Å; I346-C402 HydrophobicContact CD1-CB 4.45Å; A398-C402 PolarHBondContact O-N 2.68Å; A398-C402 PolarHBondContact O-SG 2.97Å; F399-C402 WeakPolarHBondContact O-CB 3.31Å; F399-C402 PolarHBondContact O-N 3.23Å; F399-C402 VanDerWaalsContact O-N 3.14Å; C402-L404 VanDerWaalsContact C-N 3.3Å; C402-L404 PolarHBondContact O-N 3.42Å; C402-E405 PolarHBondContact O-N 3.1Å; C402-M406 WeakPolarHBondContact O-CG 3.2Å; C402-M406 PolarHBondContact O-N 2.95Å
403	M	96.6	Very high	94.7	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-65.5	-35.2	176.4	-172.6	167.7	170.9	0	0	111.6	L315 F399 G400 M406 I407 I456 I459 I460 F482 F483	L315-M403 HydrophobicContact CD2-CE 4.2Å; L315-M403 HydrophobicContact CD2-CG 4.42Å; F399-M403 HydrophobicContact CE1-SD 4.21Å; F399-M403 HydrophobicContact CZ-SD 4.11Å; F399-M403 PolarHBondContact O-N 3.37Å; G400-M403 PolarHBondContact O-N 3.04Å; M403-M406 PolarHBondContact O-N 2.97Å; M403-I407 WeakPolarHBondContact O-CG2 3.48Å; M403-I407 PolarHBondContact O-N 2.55Å; M403-I456 HydrophobicContact CE-CB 4.19Å; M403-I456 HydrophobicContact CE-CG1 3.98Å; M403-I456 HydrophobicContact CE-CG2 3.88Å; M403-I459 HydrophobicContact CE-CB 4.29Å; M403-I459 HydrophobicContact CE-CD1 4.26Å; M403-I459 HydrophobicContact CE-CG2 3.95Å; M403-I459 HydrophobicContact SD-CG2 3.79Å; M403-I460 HydrophobicContact CB-CD1 4.45Å; M403-I460 HydrophobicContact CB-CG1 4.24Å; M403-I460 HydrophobicContact CG-CD1 4.07Å; M403-I460 HydrophobicContact CG-CG1 4.02Å; M403-I460 HydrophobicContact SD-CG1 4.25Å; M403-F482 HydrophobicContact CE-CD1 4.08Å; M403-F482 HydrophobicContact CE-CE1 3.73Å; M403-F483 HydrophobicContact CE-CE1 4.46Å; M403-F483 HydrophobicContact CE-CZ 3.78Å; M403-F483 HydrophobicContact SD-CZ 3.75Å
404	L	95.6	Very high	94.6	Very high	1 Å²	1	15 Å²	15	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-66.1	-45.5	172.7	-177.4	62.7	0	0	0	112.7	G400 M401 C402 M406 I407 T408 P443 F446 I449 I460	G400-L404 WeakPolarHBondContact O-CB 3.39Å; G400-L404 PolarHBondContact O-N 3.09Å; M401-L404 WeakPolarHBondContact O-CB 3.48Å; M401-L404 PolarHBondContact O-N 3.33Å; M401-L404 HydrophobicContact SD-CD2 4.13Å; C402-L404 VanDerWaalsContact C-N 3.3Å; C402-L404 PolarHBondContact O-N 3.42Å; L404-M406 VanDerWaalsContact C-N 3.31Å; L404-M406 PolarHBondContact O-N 3.38Å; L404-I407 PolarHBondContact O-N 2.89Å; L404-T408 HydrophobicContact CD1-CG2 3.72Å; L404-T408 HydrophobicContact CG-CG2 4.46Å; L404-T408 WeakPolarHBondContact O-CB 3.42Å; L404-T408 WeakPolarHBondContact O-CG2 3.38Å; L404-T408 PolarHBondContact O-N 3.35Å; L404-T408 PolarHBondContact O-OG1 3.48Å; L404-P443 HydrophobicContact CD2-CG 3.47Å; L404-P443 VanDerWaalsContact CD2-CG 3.47Å; L404-F446 HydrophobicContact CD1-CB 4.47Å; L404-I449 HydrophobicContact CD1-CD1 3.93Å; L404-I449 HydrophobicContact CD1-CG1 3.89Å; L404-I460 HydrophobicContact CB-CD1 4.27Å; L404-I460 HydrophobicContact CB-CG2 4.32Å; L404-I460 HydrophobicContact CD1-CD1 4.38Å
405	E	95.7	Very high	94.5	Very high	7 Å²	7	17.7 Å²	17.7	3%	0.033	10%	0.1	C	C	.	.	H	α-helix	trans	-61.7	-39.9	175.3	-164.2	-177	-177.6	0	0	111	I304 C343 F380 M401 C402 G409 P412	I304-E405 HydrophobicContact CD1-CB 4.44Å; I304-E405 HydrophobicContact CD1-CG 4.02Å; C343-E405 WeakPolarHBondContact CB-OE2 3.24Å; C343-E405 PolarHBondContact SG-OE2 3.2Å; F380-E405 WeakPolarHBondContact CZ-OE2 3.23Å; M401-E405 PolarHBondContact O-N 3.02Å; C402-E405 PolarHBondContact O-N 3.1Å; E405-G409 WeakPolarHBondContact O-CA 3.32Å; E405-G409 PolarHBondContact O-N 3.32Å; E405-P412 HydrophobicContact CB-CG 4.5Å
406	M	94.3	Very high	94.3	Very high	3 Å²	3	18.7 Å²	18.7	2%	0.015	11%	0.106	C	C	.	.	H	α-helix	trans	-65.6	-42.7	177.1	-80.9	-168.8	-80.4	0	0	114.4	L300 I304 I310 L315 W318 C319 I322 C402 M403 L404	L300-M406 HydrophobicContact CD1-CG 4.09Å; L300-M406 HydrophobicContact CD1-SD 3.91Å; L300-M406 HydrophobicContact CD2-CE 4.09Å; L300-M406 HydrophobicContact CD2-CG 4.01Å; L300-M406 HydrophobicContact CD2-SD 3.71Å; L300-M406 HydrophobicContact CG-CG 4.27Å; L300-M406 HydrophobicContact CG-SD 4.32Å; I304-M406 HydrophobicContact CD1-CG 3.9Å; I310-M406 HydrophobicContact CD1-CB 3.98Å; I310-M406 HydrophobicContact CD1-CG 3.8Å; I310-M406 HydrophobicContact CD1-SD 4.41Å; L315-M406 HydrophobicContact CD1-CB 3.88Å; L315-M406 HydrophobicContact CG-CB 4.39Å; W318-M406 HydrophobicContact CB-SD 4.49Å; W318-M406 HydrophobicContact CE3-SD 4.18Å; C319-M406 WeakPolarHBondContact SG-CE 3.42Å; I322-M406 HydrophobicContact CD1-CE 4.12Å; C402-M406 WeakPolarHBondContact O-CG 3.2Å; C402-M406 PolarHBondContact O-N 2.95Å; M403-M406 PolarHBondContact O-N 2.97Å; L404-M406 VanDerWaalsContact C-N 3.31Å; L404-M406 PolarHBondContact O-N 3.38Å
407	I	93.6	Very high	93.8	Very high	27 Å²	27	24.5 Å²	24.5	14%	0.138	13%	0.133	C	C	.	.	H	α-helix	trans	-80.1	-31.3	-177.4	-169.1	63.1	0	0	0	113	L315 M403 L404 I449 I456 I460	L315-I407 HydrophobicContact CD1-CB 3.89Å; L315-I407 HydrophobicContact CD1-CD1 4.05Å; M403-I407 WeakPolarHBondContact O-CG2 3.48Å; M403-I407 PolarHBondContact O-N 2.55Å; L404-I407 PolarHBondContact O-N 2.89Å; I407-I449 HydrophobicContact CG2-CG1 4.26Å; I407-I456 HydrophobicContact CD1-CD1 4.13Å; I407-I456 HydrophobicContact CG1-CG2 4.25Å; I407-I456 HydrophobicContact CG2-CG2 4.37Å; I407-I460 HydrophobicContact CG2-CD1 4.13Å
408	T	92.1	Very high	93.2	Very high	27 Å²	27	29.9 Å²	29.9	17%	0.166	16%	0.157	C	C	.	.	H	α-helix	trans	-90.8	-28.6	-178.5	61.5	0	0	0	0	113.4	L404 E410 C445	L404-T408 HydrophobicContact CD1-CG2 3.72Å; L404-T408 HydrophobicContact CG-CG2 4.46Å; L404-T408 WeakPolarHBondContact O-CB 3.42Å; L404-T408 WeakPolarHBondContact O-CG2 3.38Å; L404-T408 PolarHBondContact O-N 3.35Å; L404-T408 PolarHBondContact O-OG1 3.48Å; T408-E410 PolarHBondContact O-N 2.89Å; T408-E410 PolarHBondContact OG1-N 3.08Å; T408-E410 VanDerWaalsContact OG1-N 3.13Å; T408-E410 PolarHBondContact OG1-O 3.49Å; T408-C445 HydrophobicContact CG2-CB 4.13Å; T408-C445 WeakPolarHBondContact CG2-O 3.11Å
409	G	91.6	Very high	92.5	Very high	31 Å²	31	32.6 Å²	32.6	32%	0.32	17%	0.174	S	C	.	.	S	Bend	trans	71.3	9.1	-167.5	0	0	0	0	0	113.9	E405	E405-G409 WeakPolarHBondContact O-CA 3.32Å; E405-G409 PolarHBondContact O-N 3.32Å
410	E	92.1	Very high	91.7	Very high	63 Å²	63	37.1 Å²	37.1	29%	0.294	20%	0.202	S	C	.	.	S	Bend	trans	-116.7	143.4	-178.6	-66.3	-175.3	174.9	0	0	111.3	T408 C445 K448	T408-E410 PolarHBondContact O-N 2.89Å; T408-E410 PolarHBondContact OG1-N 3.08Å; T408-E410 VanDerWaalsContact OG1-N 3.13Å; T408-E410 PolarHBondContact OG1-O 3.49Å; E410-C445 HydrophobicContact CB-CB 4.16Å; E410-C445 WeakPolarHBondContact OE2-CB 3.44Å; E410-K448 IonicContact OE1-NZ 2.66Å; E410-K448 PolarHBondContact OE1-NZ 2.7Å; E410-K448 VanDerWaalsContact OE2-CD 3.32Å; E410-K448 WeakPolarHBondContact OE2-CD 3.3Å; E410-K448 WeakPolarHBondContact OE2-CE 3.39Å; E410-K448 IonicContact OE2-NZ 3.09Å; E410-K448 PolarHBondContact OE2-NZ 3.1Å
411	Y	92	Very high	91.2	Very high	62 Å²	62	40.7 Å²	40.7	24%	0.243	22%	0.219	C	C	.	.			trans	-71	131	177.8	-165.2	-110.7	0	0	0	110.2	T377 E379 F380 S414	T377-Y411 VanDerWaalsContact CG2-OH 3.25Å; T377-Y411 WeakPolarHBondContact CG2-OH 3.49Å; E379-Y411 HydrophobicContact CB-CE1 4.12Å; E379-Y411 VanDerWaalsContact CD-CE1 3.46Å; E379-Y411 HydrophobicContact CG-CD1 4.23Å; E379-Y411 HydrophobicContact CG-CE1 3.53Å; E379-Y411 PolarHBondContact OE2-OH 3.04Å; F380-Y411 HydrophobicContact CE2-CD2 4.45Å; F380-Y411 AromaticContact CE2-CE2 3.6Å; F380-Y411 HydrophobicContact CE2-CE2 3.6Å; F380-Y411 AromaticContact CE2-CZ 3.82Å; F380-Y411 HydrophobicContact CZ-CE2 4.13Å; Y411-S414 VanDerWaalsContact O-CB 3.24Å; Y411-S414 WeakPolarHBondContact O-CB 3.29Å; Y411-S414 PolarHBondContact O-N 3.35Å; Y411-S414 PolarHBondContact O-OG 2.85Å
412	P	93.7	Very high	90.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	143.6	178.5	-25.4	34.5	0	0	0	112.2	E379 F380 M401 E405 S414 P443	E379-P412 HydrophobicContact CB-CB 4.34Å; E379-P412 WeakPolarHBondContact CG-O 3.45Å; F380-P412 HydrophobicContact CZ-CG 4.35Å; M401-P412 HydrophobicContact CB-CG 4.27Å; M401-P412 HydrophobicContact SD-CB 4.13Å; M401-P412 HydrophobicContact SD-CG 4.44Å; E405-P412 HydrophobicContact CB-CG 4.5Å; P412-S414 PolarHBondContact O-N 2.83Å; P412-S414 VanDerWaalsContact O-N 3.08Å; P412-P443 HydrophobicContact CB-CG 4.49Å
413	Y	93.5	Very high	90.1	Very high	6 Å²	6	45.6 Å²	45.6	2%	0.024	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	22.6	-176.5	-60.8	-74.3	0	0	0	116.1	E379 M401 E415 C416 I422 K425 V426 V441 P443	E379-Y413 HydrophobicContact CB-CD2 4.35Å; M401-Y413 HydrophobicContact CE-CE2 3.86Å; Y413-E415 VanDerWaalsContact C-OE2 3.25Å; Y413-E415 VanDerWaalsContact CA-OE2 3.28Å; Y413-E415 WeakPolarHBondContact CA-OE2 3.37Å; Y413-E415 PolarHBondContact O-N 2.9Å; Y413-C416 WeakPolarHBondContact O-CB 3.42Å; Y413-C416 PolarHBondContact O-N 3.06Å; Y413-I422 HydrophobicContact CD2-CG2 3.83Å; Y413-I422 HydrophobicContact CE2-CG2 4.25Å; Y413-I422 HydrophobicContact CG-CG1 4.42Å; Y413-I422 HydrophobicContact CG-CG2 4.02Å; Y413-K425 HydrophobicContact CD1-CB 4.46Å; Y413-K425 HydrophobicContact CD1-CD 3.78Å; Y413-K425 HydrophobicContact CE1-CB 3.92Å; Y413-K425 HydrophobicContact CE1-CD 3.84Å; Y413-V426 HydrophobicContact CE2-CG2 3.83Å; Y413-V426 WeakPolarHBondContact OH-CG2 2.9Å; Y413-V441 VanDerWaalsContact CE1-O 3.32Å; Y413-V441 WeakPolarHBondContact CE1-O 3.43Å; Y413-V441 PolarHBondContact OH-O 3.3Å; Y413-V441 VanDerWaalsContact OH-O 3.08Å; Y413-P443 HydrophobicContact CD1-CB 3.64Å; Y413-P443 HydrophobicContact CD2-CB 4.03Å; Y413-P443 HydrophobicContact CE1-CB 3.76Å; Y413-P443 HydrophobicContact CE1-CG 4.41Å; Y413-P443 HydrophobicContact CE2-CB 4.16Å; Y413-P443 HydrophobicContact CE2-CG 4.31Å; Y413-P443 HydrophobicContact CG-CB 3.79Å
414	S	91.7	Very high	89.5	Confident	72 Å²	72	50.7 Å²	50.7	50%	0.503	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-15.4	175.9	61.7	0	0	0	0	115.2	Y411 P412 C416	Y411-S414 VanDerWaalsContact O-CB 3.24Å; Y411-S414 WeakPolarHBondContact O-CB 3.29Å; Y411-S414 PolarHBondContact O-N 3.35Å; Y411-S414 PolarHBondContact O-OG 2.85Å; P412-S414 PolarHBondContact O-N 2.83Å; P412-S414 VanDerWaalsContact O-N 3.08Å; S414-C416 PolarHBondContact O-N 3.44Å
415	E	90.8	Very high	89	Confident	59 Å²	59	52.9 Å²	52.9	28%	0.276	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	0.1	170.7	77.9	-77.4	-177.9	0	0	114.4	Y413 K425 Q444	Y413-E415 VanDerWaalsContact C-OE2 3.25Å; Y413-E415 VanDerWaalsContact CA-OE2 3.28Å; Y413-E415 WeakPolarHBondContact CA-OE2 3.37Å; Y413-E415 PolarHBondContact O-N 2.9Å; E415-K425 VanDerWaalsContact CD-NZ 3.29Å; E415-K425 IonicContact OE1-NZ 2.86Å; E415-K425 PolarHBondContact OE1-NZ 2.82Å; E415-Q444 HydrophobicContact CG-CB 4.02Å; E415-Q444 PolarHBondContact OE1-N 3.08Å
416	C	89.3	Confident	88.4	Confident	21 Å²	21	52.8 Å²	52.8	14%	0.142	27%	0.27	C	S	.	.			trans	-105.9	135	174.7	-75.2	0	0	0	0	111.9	Y413 S414 Q421 I422 K425	Y413-C416 WeakPolarHBondContact O-CB 3.42Å; Y413-C416 PolarHBondContact O-N 3.06Å; S414-C416 PolarHBondContact O-N 3.44Å; C416-Q421 HydrophobicContact CB-CB 4.02Å; C416-I422 HydrophobicContact CB-CD1 4.43Å; C416-I422 HydrophobicContact CB-CG1 3.7Å; C416-K425 PolarHBondContact SG-NZ 3.31Å
417	Q	85.6	Confident	87.7	Confident	124 Å²	124	55.2 Å²	55.2	58%	0.579	28%	0.284	S	S	*	.	S	Bend	trans	-87.4	-25.6	-178.9	-64.2	175.7	1.3	0	0	113.3
418	F	83.4	Confident	86.4	Confident	120 Å²	120	58 Å²	58	53%	0.526	30%	0.297	S	S	.	.	S	Bend	trans	-137.1	143.3	-172.3	-57.3	-74.2	0	0	0	111.9	V420 Q421 I422	F418-V420 PolarHBondContact O-N 3.17Å; F418-Q421 HydrophobicContact CB-CG 4.46Å; F418-Q421 WeakPolarHBondContact O-CB 3.48Å; F418-Q421 PolarHBondContact O-N 2.98Å; F418-I422 PolarHBondContact O-N 3.06Å
419	P	82.7	Confident	84.5	Confident	60 Å²	60	58.7 Å²	58.7	39%	0.39	31%	0.306	S	S	.	.	H	α-helix	trans	-51.4	-32.7	176.5	-31.3	37.3	0	0	0	115	V374 P378 Q421 I422 Y423	V374-P419 HydrophobicContact CG2-CB 4.41Å; P378-P419 HydrophobicContact CB-CB 4.35Å; P378-P419 HydrophobicContact CG-CB 4.05Å; P378-P419 HydrophobicContact CG-CG 4.2Å; P419-Q421 VanDerWaalsContact C-N 3.26Å; P419-Q421 PolarHBondContact O-N 2.68Å; P419-I422 WeakPolarHBondContact O-CB 3.22Å; P419-I422 PolarHBondContact O-N 2.93Å; P419-I422 VanDerWaalsContact O-N 3.15Å; P419-Y423 WeakPolarHBondContact O-CB 3.48Å; P419-Y423 PolarHBondContact O-N 3.07Å
420	V	81.4	Confident	82.2	Confident	96 Å²	96	66.4 Å²	66.4	58%	0.582	33%	0.325	S	S	*	.	H	α-helix	trans	-64.5	-29.3	177.2	-176.2	0	0	0	0	112.3	F418 K424	F418-V420 PolarHBondContact O-N 3.17Å; V420-K424 WeakPolarHBondContact O-CB 3.2Å; V420-K424 VanDerWaalsContact O-CG 3.3Å; V420-K424 WeakPolarHBondContact O-CG 3.45Å; V420-K424 PolarHBondContact O-N 3.22Å
421	Q	86.1	Confident	79.5	Confident	75 Å²	75	68.7 Å²	68.7	35%	0.35	35%	0.348	S	S	.	.	H	α-helix	trans	-73.8	-37.1	174.2	-62.1	174.5	-16.6	0	0	111.3	C416 F418 P419 K424 K425	C416-Q421 HydrophobicContact CB-CB 4.02Å; F418-Q421 HydrophobicContact CB-CG 4.46Å; F418-Q421 WeakPolarHBondContact O-CB 3.48Å; F418-Q421 PolarHBondContact O-N 2.98Å; P419-Q421 VanDerWaalsContact C-N 3.26Å; P419-Q421 PolarHBondContact O-N 2.68Å; Q421-K424 PolarHBondContact O-N 2.91Å; Q421-K425 PolarHBondContact O-N 2.73Å
422	I	86.1	Confident	76.9	Confident	4 Å²	4	68.3 Å²	68.3	2%	0.021	36%	0.362	C	S	.	.	H	α-helix	trans	-66.5	-51.7	175.4	-58.5	162.7	0	0	0	109.5	P378 E379 Y413 C416 F418 P419 K424 K425 V426	P378-I422 HydrophobicContact CB-CD1 4.43Å; P378-I422 HydrophobicContact CB-CG2 4.42Å; P378-I422 HydrophobicContact CG-CD1 4.22Å; P378-I422 WeakPolarHBondContact O-CG2 3.38Å; E379-I422 HydrophobicContact CG-CD1 3.76Å; E379-I422 WeakPolarHBondContact OE1-CD1 3.24Å; Y413-I422 HydrophobicContact CD2-CG2 3.83Å; Y413-I422 HydrophobicContact CE2-CG2 4.25Å; Y413-I422 HydrophobicContact CG-CG1 4.42Å; Y413-I422 HydrophobicContact CG-CG2 4.02Å; C416-I422 HydrophobicContact CB-CD1 4.43Å; C416-I422 HydrophobicContact CB-CG1 3.7Å; F418-I422 PolarHBondContact O-N 3.06Å; P419-I422 WeakPolarHBondContact O-CB 3.22Å; P419-I422 PolarHBondContact O-N 2.93Å; P419-I422 VanDerWaalsContact O-N 3.15Å; I422-K424 VanDerWaalsContact C-N 3.28Å; I422-K424 PolarHBondContact O-N 2.73Å; I422-K425 PolarHBondContact O-N 3.16Å; I422-V426 HydrophobicContact CG2-CG2 4.08Å; I422-V426 WeakPolarHBondContact O-CB 3.45Å; I422-V426 WeakPolarHBondContact O-CG2 3.42Å; I422-V426 PolarHBondContact O-N 3.43Å
423	Y	83.5	Confident	74.4	Confident	99 Å²	99	76.9 Å²	76.9	39%	0.388	40%	0.402	S	S	.	.	H	α-helix	trans	-50.6	-47.6	173.2	171.8	-93.9	0	0	0	111.8	Y386 P419 V426 T427	Y386-Y423 AromaticContact CD1-CD2 3.68Å; Y386-Y423 HydrophobicContact CD1-CD2 3.68Å; Y386-Y423 AromaticContact CD1-CE2 3.95Å; Y386-Y423 HydrophobicContact CD1-CE2 3.95Å; Y386-Y423 AromaticContact CD2-CD2 3.8Å; Y386-Y423 HydrophobicContact CD2-CD2 3.8Å; Y386-Y423 HydrophobicContact CD2-CE2 4.01Å; Y386-Y423 AromaticContact CE1-CD2 3.8Å; Y386-Y423 HydrophobicContact CE1-CD2 3.8Å; Y386-Y423 AromaticContact CE2-CD2 3.93Å; Y386-Y423 HydrophobicContact CE2-CD2 3.93Å; Y386-Y423 AromaticContact CG-CD2 3.68Å; Y386-Y423 HydrophobicContact CG-CD2 3.68Å; Y386-Y423 AromaticContact CG-CE2 3.66Å; Y386-Y423 HydrophobicContact CG-CE2 3.66Å; Y386-Y423 AromaticContact CZ-CD2 3.93Å; P419-Y423 WeakPolarHBondContact O-CB 3.48Å; P419-Y423 PolarHBondContact O-N 3.07Å; Y423-V426 PolarHBondContact O-N 3.17Å; Y423-T427 HydrophobicContact CD2-CG2 3.97Å; Y423-T427 HydrophobicContact CE2-CG2 3.64Å; Y423-T427 WeakPolarHBondContact O-CB 3.43Å; Y423-T427 WeakPolarHBondContact O-CG2 3.21Å; Y423-T427 PolarHBondContact O-N 2.66Å; Y423-T427 PolarHBondContact O-OG1 3.4Å
424	K	84.1	Confident	71.8	Confident	107 Å²	107	80.6 Å²	80.6	47%	0.465	43%	0.429	S	S	.	.	H	α-helix	trans	-59.3	-48.7	175.2	-80.9	-179.4	180	-174	0	111.9	V420 Q421 I422 V426 Q428	V420-K424 WeakPolarHBondContact O-CB 3.2Å; V420-K424 VanDerWaalsContact O-CG 3.3Å; V420-K424 WeakPolarHBondContact O-CG 3.45Å; V420-K424 PolarHBondContact O-N 3.22Å; Q421-K424 PolarHBondContact O-N 2.91Å; I422-K424 VanDerWaalsContact C-N 3.28Å; I422-K424 PolarHBondContact O-N 2.73Å; K424-V426 PolarHBondContact O-N 3.4Å; K424-Q428 HydrophobicContact CB-CG 4.5Å; K424-Q428 WeakPolarHBondContact O-CA 3.43Å; K424-Q428 WeakPolarHBondContact O-CB 3.43Å; K424-Q428 WeakPolarHBondContact O-CG 3.31Å; K424-Q428 PolarHBondContact O-N 3.33Å
425	K	85.8	Confident	69.4	Low	48 Å²	48	81.1 Å²	81.1	21%	0.209	43%	0.431	C	S	.	.	H	α-helix	trans	-59.8	-45.9	176.8	-80.6	-175.7	175.1	170.4	0	113.1	Y413 E415 C416 Q421 I422 V441	Y413-K425 HydrophobicContact CD1-CB 4.46Å; Y413-K425 HydrophobicContact CD1-CD 3.78Å; Y413-K425 HydrophobicContact CE1-CB 3.92Å; Y413-K425 HydrophobicContact CE1-CD 3.84Å; E415-K425 VanDerWaalsContact CD-NZ 3.29Å; E415-K425 IonicContact OE1-NZ 2.86Å; E415-K425 PolarHBondContact OE1-NZ 2.82Å; C416-K425 PolarHBondContact SG-NZ 3.31Å; Q421-K425 PolarHBondContact O-N 2.73Å; I422-K425 PolarHBondContact O-N 3.16Å; K425-V441 HydrophobicContact CB-CB 3.96Å; K425-V441 HydrophobicContact CB-CG1 4.44Å; K425-V441 HydrophobicContact CD-CG1 4.17Å; K425-V441 HydrophobicContact CG-CB 4Å; K425-V441 HydrophobicContact CG-CG1 4.03Å; K425-V441 PolarHBondContact O-N 2.92Å
426	V	84	Confident	67.2	Low	5 Å²	5	85.5 Å²	85.5	3%	0.03	45%	0.445	C	S	.	.	H	α-helix	trans	-67.5	-40.2	-176.4	172.2	0	0	0	0	111.8	P383 Y413 I422 Y423 K424	P383-V426 HydrophobicContact CB-CG1 3.9Å; P383-V426 HydrophobicContact CG-CG1 4.31Å; Y413-V426 HydrophobicContact CE2-CG2 3.83Å; Y413-V426 WeakPolarHBondContact OH-CG2 2.9Å; I422-V426 HydrophobicContact CG2-CG2 4.08Å; I422-V426 WeakPolarHBondContact O-CB 3.45Å; I422-V426 WeakPolarHBondContact O-CG2 3.42Å; I422-V426 PolarHBondContact O-N 3.43Å; Y423-V426 PolarHBondContact O-N 3.17Å; K424-V426 PolarHBondContact O-N 3.4Å
427	T	78.6	Confident	64.9	Low	53 Å²	53	87.2 Å²	87.2	33%	0.325	46%	0.457	S	S	.	.	H	α-helix	trans	-92.5	-31.3	-176.6	59.3	0	0	0	0	114.6	P383 Y423 A429	P383-T427 HydrophobicContact CB-CG2 4.3Å; Y423-T427 HydrophobicContact CD2-CG2 3.97Å; Y423-T427 HydrophobicContact CE2-CG2 3.64Å; Y423-T427 WeakPolarHBondContact O-CB 3.43Å; Y423-T427 WeakPolarHBondContact O-CG2 3.21Å; Y423-T427 PolarHBondContact O-N 2.66Å; Y423-T427 PolarHBondContact O-OG1 3.4Å; T427-A429 PolarHBondContact O-N 2.84Å
428	Q	67.3	Low	63.2	Low	86 Å²	86	84.6 Å²	84.6	40%	0.402	45%	0.449	S	S	.	.			trans	-81.4	109	-177.2	-62.7	180	-37.5	0	0	111.4	K424	K424-Q428 HydrophobicContact CB-CG 4.5Å; K424-Q428 WeakPolarHBondContact O-CA 3.43Å; K424-Q428 WeakPolarHBondContact O-CB 3.43Å; K424-Q428 WeakPolarHBondContact O-CG 3.31Å; K424-Q428 PolarHBondContact O-N 3.33Å
429	A	51.5	Low	61.9	Low	42 Å²	42	86.1 Å²	86.1	35%	0.347	46%	0.456	S	S	.	.			trans	-57.4	137.6	140	0	0	0	0	0	108.1	T427 S431 V438	T427-A429 PolarHBondContact O-N 2.84Å; A429-S431 PolarHBondContact O-N 2.9Å; A429-V438 HydrophobicContact CB-CG1 4.36Å
430	R	42.3	Very low	61.2	Low	193 Å²	193	84 Å²	84	73%	0.728	44%	0.444	S	S	*	.			trans	-56.8	109.7	-173.3	-90.7	-175	161.2	111.9	-7.2	111.7	G432	R430-G432 VanDerWaalsContact C-N 3.32Å; R430-G432 PolarHBondContact O-N 3.32Å
431	S	36.5	Very low	61.3	Low	111 Å²	111	81.3 Å²	81.3	78%	0.776	43%	0.428	S	S	*	.	S	Bend	trans	-75.4	84.2	170.5	58.6	0	0	0	0	109.7	A429	A429-S431 PolarHBondContact O-N 2.9Å
432	G	37.1	Very low	61.5	Low	53 Å²	53	80.2 Å²	80.2	55%	0.546	42%	0.422	S	S	.	.	S	Bend	trans	127.1	130.1	-176.9	0	0	0	0	0	111.9	R430	R430-G432 VanDerWaalsContact C-N 3.32Å; R430-G432 PolarHBondContact O-N 3.32Å
433	Q	41.4	Very low	61.8	Low	180 Å²	180	80.1 Å²	80.1	84%	0.841	42%	0.422	S	S	*	.	S	Bend	trans	62	105	-174.6	-124.4	65.3	5.7	0	0	115.6
434	C	39.5	Very low	62.1	Low	85 Å²	85	80.3 Å²	80.3	57%	0.574	43%	0.426	S	S	*	.			trans	77.6	97.3	176.4	-160.7	0	0	0	0	116.8	R436	C434-R436 PolarHBondContact O-N 2.83Å; C434-R436 VanDerWaalsContact O-N 3.09Å
435	C	41.2	Very low	62.4	Low	83 Å²	83	75.2 Å²	75.2	56%	0.561	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	3.2	171.7	53.2	0	0	0	0	115.4
436	R	44	Very low	62.7	Low	151 Å²	151	73.8 Å²	73.8	57%	0.57	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	3.6	-167.3	-147.6	179.2	-65.1	-139.4	7.5	115.2	C434 E606	C434-R436 PolarHBondContact O-N 2.83Å; C434-R436 VanDerWaalsContact O-N 3.09Å; R436-E606 IonicContact NH1-OE1 2.65Å; R436-E606 PolarHBondContact NH1-OE1 2.74Å; R436-E606 VanDerWaalsContact NH1-OE1 3.12Å
437	C	41.2	Very low	63	Low	57 Å²	57	80.3 Å²	80.3	39%	0.385	43%	0.428	S	S	.	.			trans	-148.8	112.1	-177.4	48.1	0	0	0	0	115	K439	C437-K439 HydrophobicContact CB-CB 4.29Å; C437-K439 HydrophobicContact CB-CD 3.95Å; C437-K439 HydrophobicContact CB-CG 3.93Å; C437-K439 PolarHBondContact O-N 3.44Å
438	V	49.1	Very low	63.6	Low	68 Å²	68	82.9 Å²	82.9	41%	0.412	44%	0.435	S	S	.	.			trans	-75.6	55.6	165.1	-166.6	0	0	0	0	109.8	A429	A429-V438 HydrophobicContact CB-CG1 4.36Å
439	K	56.4	Low	64.7	Low	153 Å²	153	79 Å²	79	67%	0.665	42%	0.417	S	S	*	.			trans	-99.1	104.4	178.6	-75.3	178.8	-179.2	-176.3	0	108.7	C437	C437-K439 HydrophobicContact CB-CB 4.29Å; C437-K439 HydrophobicContact CB-CD 3.95Å; C437-K439 HydrophobicContact CB-CG 3.93Å; C437-K439 PolarHBondContact O-N 3.44Å
440	G	68	Low	66.4	Low	15 Å²	15	79.6 Å²	79.6	16%	0.155	42%	0.417	C	S	.	.			trans	-54.2	141.3	160.3	0	0	0	0	0	109.4	K442	G440-K442 PolarHBondContact O-N 2.97Å; G440-K442 VanDerWaalsContact O-N 3.08Å
441	V	83.5	Confident	68.4	Low	39 Å²	39	76.2 Å²	76.2	24%	0.236	42%	0.423	C	S	.	.			trans	-74.3	102.9	-173.1	-179.3	0	0	0	0	109	Y413 K425	Y413-V441 VanDerWaalsContact CE1-O 3.32Å; Y413-V441 WeakPolarHBondContact CE1-O 3.43Å; Y413-V441 PolarHBondContact OH-O 3.3Å; Y413-V441 VanDerWaalsContact OH-O 3.08Å; K425-V441 HydrophobicContact CB-CB 3.96Å; K425-V441 HydrophobicContact CB-CG1 4.44Å; K425-V441 HydrophobicContact CD-CG1 4.17Å; K425-V441 HydrophobicContact CG-CB 4Å; K425-V441 HydrophobicContact CG-CG1 4.03Å; K425-V441 PolarHBondContact O-N 2.92Å
442	K	89.6	Confident	70.6	Confident	52 Å²	52	75.4 Å²	75.4	23%	0.226	42%	0.418	C	S	.	.			trans	-56.4	151	173.5	-75	-172.4	155.6	105.2	0	111.6	G440 F446 D461 T464	G440-K442 PolarHBondContact O-N 2.97Å; G440-K442 VanDerWaalsContact O-N 3.08Å; K442-F446 HydrophobicContact CB-CB 4.31Å; K442-F446 HydrophobicContact CB-CD1 4.33Å; K442-F446 HydrophobicContact CB-CG 4.31Å; K442-F446 HydrophobicContact CD-CD1 3.77Å; K442-F446 HydrophobicContact CD-CD2 4.02Å; K442-F446 HydrophobicContact CD-CE1 3.69Å; K442-F446 HydrophobicContact CD-CE2 3.96Å; K442-F446 HydrophobicContact CD-CG 3.94Å; K442-F446 HydrophobicContact CD-CZ 3.79Å; K442-D461 WeakPolarHBondContact CE-OD1 3.48Å; K442-D461 PolarHBondContact NZ-O 2.99Å; K442-D461 VanDerWaalsContact NZ-O 3.15Å; K442-D461 IonicContact NZ-OD1 2.69Å; K442-D461 PolarHBondContact NZ-OD1 3.37Å; K442-D461 IonicContact NZ-OD2 2.74Å; K442-D461 PolarHBondContact NZ-OD2 2.96Å; K442-T464 WeakPolarHBondContact CE-OG1 3.35Å
443	P	92.3	Very high	72.8	Confident	3 Å²	3	74.5 Å²	74.5	2%	0.019	40%	0.4	C	S	.	.			trans	-65.2	149.4	179.8	28.9	-36.9	0	0	0	111.4	M401 L404 P412 Y413 C445 F446	M401-P443 HydrophobicContact SD-CG 4.34Å; L404-P443 HydrophobicContact CD2-CG 3.47Å; L404-P443 VanDerWaalsContact CD2-CG 3.47Å; P412-P443 HydrophobicContact CB-CG 4.49Å; Y413-P443 HydrophobicContact CD1-CB 3.64Å; Y413-P443 HydrophobicContact CD2-CB 4.03Å; Y413-P443 HydrophobicContact CE1-CB 3.76Å; Y413-P443 HydrophobicContact CE1-CG 4.41Å; Y413-P443 HydrophobicContact CE2-CB 4.16Å; Y413-P443 HydrophobicContact CE2-CG 4.31Å; Y413-P443 HydrophobicContact CG-CB 3.79Å; P443-C445 PolarHBondContact O-N 3.33Å; P443-C445 VanDerWaalsContact O-N 3.11Å; P443-F446 HydrophobicContact CG-CB 4.46Å; P443-F446 WeakPolarHBondContact O-CB 3.29Å; P443-F446 PolarHBondContact O-N 3.14Å
444	Q	89.9	Confident	74.9	Confident	102 Å²	102	70.2 Å²	70.2	48%	0.477	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-59.9	-29.1	-175.1	-169.3	177	6.1	0	0	113.4	E415 F446 E447	E415-Q444 HydrophobicContact CG-CB 4.02Å; E415-Q444 PolarHBondContact OE1-N 3.08Å; Q444-F446 PolarHBondContact O-N 2.85Å; Q444-E447 PolarHBondContact O-N 3.33Å
445	C	91.7	Very high	77.1	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.007	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-66.5	-16.6	175.6	60.7	0	0	0	0	114	T408 E410 P443 E447 K448	T408-C445 HydrophobicContact CG2-CB 4.13Å; T408-C445 WeakPolarHBondContact CG2-O 3.11Å; E410-C445 HydrophobicContact CB-CB 4.16Å; E410-C445 WeakPolarHBondContact OE2-CB 3.44Å; P443-C445 PolarHBondContact O-N 3.33Å; P443-C445 VanDerWaalsContact O-N 3.11Å; C445-E447 PolarHBondContact O-N 3.3Å; C445-K448 WeakPolarHBondContact O-CB 3.33Å; C445-K448 PolarHBondContact O-N 2.84Å
446	F	92.3	Very high	79.5	Confident	18 Å²	18	66 Å²	66	8%	0.079	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-61.9	-30.2	171.3	-178.3	-98	0	0	0	112.5	L404 K442 P443 Q444 K448 I449 R457 I460 D461	L404-F446 HydrophobicContact CD1-CB 4.47Å; K442-F446 HydrophobicContact CB-CB 4.31Å; K442-F446 HydrophobicContact CB-CD1 4.33Å; K442-F446 HydrophobicContact CB-CG 4.31Å; K442-F446 HydrophobicContact CD-CD1 3.77Å; K442-F446 HydrophobicContact CD-CD2 4.02Å; K442-F446 HydrophobicContact CD-CE1 3.69Å; K442-F446 HydrophobicContact CD-CE2 3.96Å; K442-F446 HydrophobicContact CD-CG 3.94Å; K442-F446 HydrophobicContact CD-CZ 3.79Å; P443-F446 HydrophobicContact CG-CB 4.46Å; P443-F446 WeakPolarHBondContact O-CB 3.29Å; P443-F446 PolarHBondContact O-N 3.14Å; Q444-F446 PolarHBondContact O-N 2.85Å; F446-K448 PolarHBondContact O-N 3.09Å; F446-I449 HydrophobicContact CD2-CD1 3.54Å; F446-I449 HydrophobicContact CE2-CD1 3.8Å; F446-I449 HydrophobicContact CG-CD1 4.18Å; F446-I449 WeakPolarHBondContact O-CD1 3.5Å; F446-I449 WeakPolarHBondContact O-CG1 3.17Å; F446-R457 HydrophobicContact CE2-CG 4.44Å; F446-R457 HydrophobicContact CZ-CG 4.03Å; F446-I460 HydrophobicContact CD2-CG2 3.82Å; F446-I460 HydrophobicContact CE2-CB 4.2Å; F446-I460 HydrophobicContact CE2-CG2 3.81Å; F446-D461 HydrophobicContact CE2-CB 4.33Å; F446-D461 HydrophobicContact CZ-CB 3.96Å; F446-D461 WeakPolarHBondContact CZ-OD1 3.42Å
447	E	90.7	Very high	81.8	Confident	142 Å²	142	63.4 Å²	63.4	66%	0.664	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-72.1	-22	175.2	-61.8	-177.2	160.5	0	0	112.2	Q444 C445	Q444-E447 PolarHBondContact O-N 3.33Å; C445-E447 PolarHBondContact O-N 3.3Å
448	K	90.5	Very high	84.1	Confident	107 Å²	107	63.8 Å²	63.8	47%	0.465	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-86.2	-0.4	-179.2	-56	177.6	-177.3	171.4	0	114.2	E410 C445 F446 P450	E410-K448 IonicContact OE1-NZ 2.66Å; E410-K448 PolarHBondContact OE1-NZ 2.7Å; E410-K448 VanDerWaalsContact OE2-CD 3.32Å; E410-K448 WeakPolarHBondContact OE2-CD 3.3Å; E410-K448 WeakPolarHBondContact OE2-CE 3.39Å; E410-K448 IonicContact OE2-NZ 3.09Å; E410-K448 PolarHBondContact OE2-NZ 3.1Å; C445-K448 WeakPolarHBondContact O-CB 3.33Å; C445-K448 PolarHBondContact O-N 2.84Å; F446-K448 PolarHBondContact O-N 3.09Å; K448-P450 WeakPolarHBondContact O-CD 3.43Å
449	I	89.9	Confident	86.3	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.021	32%	0.318	C	S	.	.	S	Bend	trans	-60	124.5	173.2	-61.7	168.1	0	0	0	108.6	L404 I407 F446 S451 I456 R457 I460	L404-I449 HydrophobicContact CD1-CD1 3.93Å; L404-I449 HydrophobicContact CD1-CG1 3.89Å; I407-I449 HydrophobicContact CG2-CG1 4.26Å; F446-I449 HydrophobicContact CD2-CD1 3.54Å; F446-I449 HydrophobicContact CE2-CD1 3.8Å; F446-I449 HydrophobicContact CG-CD1 4.18Å; F446-I449 WeakPolarHBondContact O-CD1 3.5Å; F446-I449 WeakPolarHBondContact O-CG1 3.17Å; I449-S451 PolarHBondContact O-N 2.81Å; I449-I456 HydrophobicContact CG2-CG2 4.2Å; I449-R457 HydrophobicContact CD1-CG 4.25Å; I449-R457 HydrophobicContact CG2-CB 4.18Å; I449-I460 HydrophobicContact CD1-CD1 3.86Å
450	P	86.5	Confident	88.1	Confident	55 Å²	55	53.2 Å²	53.2	36%	0.357	29%	0.287	S	S	.	.			trans	-57.5	128.1	-176.2	-27.1	35.3	0	0	0	113.4	K448 S452 N453	K448-P450 WeakPolarHBondContact O-CD 3.43Å; P450-S452 PolarHBondContact O-N 3.27Å; P450-N453 PolarHBondContact O-N 3.16Å
451	S	85	Confident	89.2	Confident	121 Å²	121	55.1 Å²	55.1	85%	0.846	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-14.3	-180	-47.4	0	0	0	0	114.4	I449 N453	I449-S451 PolarHBondContact O-N 2.81Å; S451-N453 PolarHBondContact O-N 2.9Å
452	S	83.5	Confident	89.6	Confident	95 Å²	95	55 Å²	55	66%	0.664	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-19.1	171.7	59.6	0	0	0	0	113.6	P450 P454	P450-S452 PolarHBondContact O-N 3.27Å; S452-P454 VanDerWaalsContact O-CD 3.27Å; S452-P454 WeakPolarHBondContact O-CD 3.4Å
453	N	82.3	Confident	89.8	Confident	33 Å²	33	52.5 Å²	52.5	18%	0.176	28%	0.277	C	S	.	.			trans	-121.4	62.3	-170	-57.9	6.7	0	0	0	111.2	P450 S451 E455 I456 R457	P450-N453 PolarHBondContact O-N 3.16Å; S451-N453 PolarHBondContact O-N 2.9Å; N453-E455 VanDerWaalsContact C-N 3.29Å; N453-E455 PolarHBondContact O-N 3.26Å; N453-I456 HydrophobicContact CB-CB 4.2Å; N453-I456 HydrophobicContact CB-CD1 3.96Å; N453-I456 HydrophobicContact CB-CG1 4.2Å; N453-I456 PolarHBondContact O-N 3.2Å; N453-R457 PolarHBondContact O-N 2.87Å
454	P	85.9	Confident	89.8	Confident	91 Å²	91	52.8 Å²	52.8	59%	0.591	28%	0.279	S	S	*	.	H	α-helix	trans	-60.2	-35.5	-176	24.9	-34.3	0	0	0	113	S452 I456 R457 E458	S452-P454 VanDerWaalsContact O-CD 3.27Å; S452-P454 WeakPolarHBondContact O-CD 3.4Å; P454-I456 VanDerWaalsContact C-N 3.32Å; P454-I456 PolarHBondContact O-N 3.12Å; P454-R457 WeakPolarHBondContact O-CB 3.36Å; P454-R457 PolarHBondContact O-N 3.43Å; P454-E458 PolarHBondContact O-N 3.26Å
455	E	85.9	Confident	89.8	Confident	77 Å²	77	50 Å²	50	36%	0.36	26%	0.264	S	S	.	.	H	α-helix	trans	-56.2	-43.3	176.1	-60.6	-177.9	-174.6	0	0	112.2	N453 R457 E458 I459 F482 R492	N453-E455 VanDerWaalsContact C-N 3.29Å; N453-E455 PolarHBondContact O-N 3.26Å; E455-R457 VanDerWaalsContact C-N 3.29Å; E455-R457 PolarHBondContact O-N 2.99Å; E455-E458 PolarHBondContact O-N 3.08Å; E455-I459 VanDerWaalsContact O-CD1 3.32Å; E455-I459 WeakPolarHBondContact O-CD1 3.36Å; E455-I459 WeakPolarHBondContact O-CG1 3.31Å; E455-I459 PolarHBondContact O-N 2.8Å; E455-F482 HydrophobicContact CB-CB 4.46Å; E455-F482 HydrophobicContact CB-CD2 4.3Å; E455-F482 WeakPolarHBondContact OE2-CB 3.28Å; E455-F482 WeakPolarHBondContact OE2-CD2 3.21Å; E455-R492 IonicContact OE1-NH2 2.82Å
456	I	91.7	Very high	89.5	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-63.1	-39	177.5	-68.3	-177.9	0	0	0	110.7	V312 L315 M403 I407 I449 N453 P454 I460 F482	V312-I456 HydrophobicContact CG1-CD1 4.31Å; L315-I456 HydrophobicContact CD2-CD1 4.43Å; M403-I456 HydrophobicContact CE-CB 4.19Å; M403-I456 HydrophobicContact CE-CG1 3.98Å; M403-I456 HydrophobicContact CE-CG2 3.88Å; I407-I456 HydrophobicContact CD1-CD1 4.13Å; I407-I456 HydrophobicContact CG1-CG2 4.25Å; I407-I456 HydrophobicContact CG2-CG2 4.37Å; I449-I456 HydrophobicContact CG2-CG2 4.2Å; N453-I456 HydrophobicContact CB-CB 4.2Å; N453-I456 HydrophobicContact CB-CD1 3.96Å; N453-I456 HydrophobicContact CB-CG1 4.2Å; N453-I456 PolarHBondContact O-N 3.2Å; P454-I456 VanDerWaalsContact C-N 3.32Å; P454-I456 PolarHBondContact O-N 3.12Å; I456-I460 HydrophobicContact CG2-CD1 3.78Å; I456-I460 VanDerWaalsContact O-CG1 3.32Å; I456-I460 WeakPolarHBondContact O-CG1 3.3Å; I456-I460 PolarHBondContact O-N 3.28Å; I456-I460 VanDerWaalsContact O-N 3.07Å; I456-F482 HydrophobicContact CD1-CE1 4.3Å; I456-F482 HydrophobicContact CD1-CE2 3.91Å; I456-F482 HydrophobicContact CD1-CZ 3.55Å; I456-F482 HydrophobicContact CG1-CD1 4.48Å; I456-F482 HydrophobicContact CG1-CD2 4.28Å; I456-F482 HydrophobicContact CG1-CE1 3.91Å; I456-F482 HydrophobicContact CG1-CE2 3.68Å; I456-F482 HydrophobicContact CG1-CZ 3.49Å; I456-F482 VanDerWaalsContact CG1-CZ 3.49Å
457	R	91.9	Very high	89	Confident	97 Å²	97	56.1 Å²	56.1	37%	0.366	29%	0.292	S	S	.	.	H	α-helix	trans	-66.5	-42.3	177.9	-167.7	-179.9	-178.7	107.6	-0.9	111.4	F446 I449 N453 P454 E455 D461	F446-R457 HydrophobicContact CE2-CG 4.44Å; F446-R457 HydrophobicContact CZ-CG 4.03Å; I449-R457 HydrophobicContact CD1-CG 4.25Å; I449-R457 HydrophobicContact CG2-CB 4.18Å; N453-R457 PolarHBondContact O-N 2.87Å; P454-R457 WeakPolarHBondContact O-CB 3.36Å; P454-R457 PolarHBondContact O-N 3.43Å; E455-R457 VanDerWaalsContact C-N 3.29Å; E455-R457 PolarHBondContact O-N 2.99Å; R457-D461 VanDerWaalsContact O-CB 3.28Å; R457-D461 WeakPolarHBondContact O-CB 3.47Å; R457-D461 PolarHBondContact O-N 3.3Å
458	E	90.4	Very high	88.8	Confident	65 Å²	65	53.6 Å²	53.6	30%	0.304	28%	0.276	S	S	.	.	H	α-helix	trans	-63.4	-46.3	176.1	-162.1	-143.3	143.5	0	0	111.8	P454 E455 I460 D461 R462 Y472 R498	P454-E458 PolarHBondContact O-N 3.26Å; E455-E458 PolarHBondContact O-N 3.08Å; E458-I460 PolarHBondContact O-N 2.97Å; E458-D461 PolarHBondContact O-N 2.82Å; E458-D461 VanDerWaalsContact O-N 3.16Å; E458-R462 HydrophobicContact CG-CG 4.47Å; E458-R462 WeakPolarHBondContact O-CG 3.32Å; E458-R462 PolarHBondContact O-N 2.71Å; E458-R462 IonicContact OE1-CZ 3.91Å; E458-R462 IonicContact OE1-NE 3.06Å; E458-R462 PolarHBondContact OE1-NE 3.34Å; E458-R462 IonicContact OE1-NH2 2.91Å; E458-R462 PolarHBondContact OE1-NH2 2.93Å; E458-Y472 PolarHBondContact OE1-OH 2.94Å; E458-R498 IonicContact OE2-NH1 2.77Å
459	I	93.3	Very high	88.6	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-58.8	-50.1	179.4	-68.7	160.1	0	0	0	110.7	M403 E455 D461 R462 C463 L477 F482 F483	M403-I459 HydrophobicContact CE-CB 4.29Å; M403-I459 HydrophobicContact CE-CD1 4.26Å; M403-I459 HydrophobicContact CE-CG2 3.95Å; M403-I459 HydrophobicContact SD-CG2 3.79Å; E455-I459 VanDerWaalsContact O-CD1 3.32Å; E455-I459 WeakPolarHBondContact O-CD1 3.36Å; E455-I459 WeakPolarHBondContact O-CG1 3.31Å; E455-I459 PolarHBondContact O-N 2.8Å; I459-D461 VanDerWaalsContact C-N 3.33Å; I459-D461 PolarHBondContact O-N 3.07Å; I459-R462 PolarHBondContact O-N 2.89Å; I459-C463 WeakPolarHBondContact O-CB 3.44Å; I459-C463 PolarHBondContact O-N 3.25Å; I459-C463 PolarHBondContact O-SG 3.07Å; I459-L477 HydrophobicContact CG2-CD2 3.98Å; I459-F482 HydrophobicContact CD1-CB 3.51Å; I459-F482 HydrophobicContact CD1-CD1 3.61Å; I459-F482 HydrophobicContact CD1-CG 3.73Å; I459-F483 HydrophobicContact CD1-CE2 4.04Å; I459-F483 HydrophobicContact CD1-CZ 4.44Å; I459-F483 HydrophobicContact CG2-CE2 3.98Å; I459-F483 HydrophobicContact CG2-CZ 4.37Å
460	I	95	Very high	88.4	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.6	-39.6	177.3	-63.4	167.3	0	0	0	110.1	M403 L404 I407 F446 I449 I456 E458 R462 C463 T464	M403-I460 HydrophobicContact CB-CD1 4.45Å; M403-I460 HydrophobicContact CB-CG1 4.24Å; M403-I460 HydrophobicContact CG-CD1 4.07Å; M403-I460 HydrophobicContact CG-CG1 4.02Å; M403-I460 HydrophobicContact SD-CG1 4.25Å; L404-I460 HydrophobicContact CB-CD1 4.27Å; L404-I460 HydrophobicContact CB-CG2 4.32Å; L404-I460 HydrophobicContact CD1-CD1 4.38Å; I407-I460 HydrophobicContact CG2-CD1 4.13Å; F446-I460 HydrophobicContact CD2-CG2 3.82Å; F446-I460 HydrophobicContact CE2-CB 4.2Å; F446-I460 HydrophobicContact CE2-CG2 3.81Å; I449-I460 HydrophobicContact CD1-CD1 3.86Å; I456-I460 HydrophobicContact CG2-CD1 3.78Å; I456-I460 VanDerWaalsContact O-CG1 3.32Å; I456-I460 WeakPolarHBondContact O-CG1 3.3Å; I456-I460 PolarHBondContact O-N 3.28Å; I456-I460 VanDerWaalsContact O-N 3.07Å; E458-I460 PolarHBondContact O-N 2.97Å; I460-R462 PolarHBondContact O-N 3.07Å; I460-C463 PolarHBondContact O-N 3.11Å; I460-T464 HydrophobicContact CG2-CG2 4.33Å; I460-T464 WeakPolarHBondContact O-CB 3.5Å; I460-T464 PolarHBondContact O-N 3.37Å; I460-T464 PolarHBondContact O-OG1 3.26Å
461	D	92	Very high	88.7	Confident	54 Å²	54	53 Å²	53	29%	0.289	27%	0.269	S	S	.	.	H	α-helix	trans	-59.1	-47.9	178.9	-165	86.4	0	0	0	112.3	K442 F446 R457 E458 I459 T464 R465	K442-D461 WeakPolarHBondContact CE-OD1 3.48Å; K442-D461 PolarHBondContact NZ-O 2.99Å; K442-D461 VanDerWaalsContact NZ-O 3.15Å; K442-D461 IonicContact NZ-OD1 2.69Å; K442-D461 PolarHBondContact NZ-OD1 3.37Å; K442-D461 IonicContact NZ-OD2 2.74Å; K442-D461 PolarHBondContact NZ-OD2 2.96Å; F446-D461 HydrophobicContact CE2-CB 4.33Å; F446-D461 HydrophobicContact CZ-CB 3.96Å; F446-D461 WeakPolarHBondContact CZ-OD1 3.42Å; R457-D461 VanDerWaalsContact O-CB 3.28Å; R457-D461 WeakPolarHBondContact O-CB 3.47Å; R457-D461 PolarHBondContact O-N 3.3Å; E458-D461 PolarHBondContact O-N 2.82Å; E458-D461 VanDerWaalsContact O-N 3.16Å; I459-D461 VanDerWaalsContact C-N 3.33Å; I459-D461 PolarHBondContact O-N 3.07Å; D461-T464 CarbonylContact O-C 3.59Å; D461-R465 WeakPolarHBondContact O-CG 3.44Å; D461-R465 PolarHBondContact O-N 3.45Å
462	R	90.3	Very high	89	Confident	36 Å²	36	47.6 Å²	47.6	14%	0.136	23%	0.231	C	C	.	.	H	α-helix	trans	-65.8	-47.4	177.3	-63.1	-125.5	-154.7	165.9	12.6	112.3	E458 I459 I460 T464 R465 Y472 D591	E458-R462 HydrophobicContact CG-CG 4.47Å; E458-R462 WeakPolarHBondContact O-CG 3.32Å; E458-R462 PolarHBondContact O-N 2.71Å; E458-R462 IonicContact OE1-CZ 3.91Å; E458-R462 IonicContact OE1-NE 3.06Å; E458-R462 PolarHBondContact OE1-NE 3.34Å; E458-R462 IonicContact OE1-NH2 2.91Å; E458-R462 PolarHBondContact OE1-NH2 2.93Å; I459-R462 PolarHBondContact O-N 2.89Å; I460-R462 PolarHBondContact O-N 3.07Å; R462-T464 PolarHBondContact O-N 3.06Å; R462-R465 PolarHBondContact O-N 3.45Å; R462-Y472 HydrophobicContact CB-CD2 3.6Å; R462-Y472 HydrophobicContact CB-CE2 3.52Å; R462-Y472 HydrophobicContact CG-CD2 4.25Å; R462-Y472 HydrophobicContact CG-CE2 3.65Å; R462-Y472 PolarHBondContact NE-OH 2.72Å; R462-Y472 PolarHBondContact NH2-OH 2.78Å; R462-Y472 VanDerWaalsContact NH2-OH 3.16Å; R462-D591 IonicContact CZ-OD1 3.34Å; R462-D591 IonicContact NH1-OD1 2.7Å; R462-D591 PolarHBondContact NH1-OD1 2.87Å; R462-D591 IonicContact NH2-OD1 3.51Å; R462-D591 PolarHBondContact NH2-OD1 3.48Å; R462-D591 VanDerWaalsContact NH2-OD1 3.14Å; R462-D591 IonicContact NH2-OD2 2.76Å
463	C	94.6	Very high	89.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.8	-32.7	179.2	-64.8	0	0	0	0	112.3	V396 Y397 I459 I460 R471	V396-C463 HydrophobicContact CG1-CB 4.08Å; Y397-C463 WeakPolarHBondContact CA-O 3.43Å; I459-C463 WeakPolarHBondContact O-CB 3.44Å; I459-C463 PolarHBondContact O-N 3.25Å; I459-C463 PolarHBondContact O-SG 3.07Å; I460-C463 PolarHBondContact O-N 3.11Å; C463-R471 WeakPolarHBondContact O-CD 3.46Å
464	T	93.2	Very high	90	Very high	9 Å²	9	43.4 Å²	43.4	6%	0.055	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	22.3	-179.3	60.8	0	0	0	0	113.6	M401 K442 I460 D461 R462	M401-T464 HydrophobicContact CE-CG2 3.79Å; M401-T464 HydrophobicContact CG-CG2 4.36Å; M401-T464 HydrophobicContact SD-CG2 4.02Å; K442-T464 WeakPolarHBondContact CE-OG1 3.35Å; I460-T464 HydrophobicContact CG2-CG2 4.33Å; I460-T464 WeakPolarHBondContact O-CB 3.5Å; I460-T464 PolarHBondContact O-N 3.37Å; I460-T464 PolarHBondContact O-OG1 3.26Å; D461-T464 CarbonylContact O-C 3.59Å; R462-T464 PolarHBondContact O-N 3.06Å
465	R	89.4	Confident	90.3	Very high	45 Å²	45	45.5 Å²	45.5	17%	0.17	20%	0.204	C	C	.	.			trans	-65.8	138.4	170.5	-78	-173.5	175.2	-146.8	7	110.7	D461 R462 E470 R471 E598	D461-R465 WeakPolarHBondContact O-CG 3.44Å; D461-R465 PolarHBondContact O-N 3.45Å; R462-R465 PolarHBondContact O-N 3.45Å; R465-E470 HydrophobicContact CB-CB 4.25Å; R465-E470 VanDerWaalsContact CD-CB 3.43Å; R465-E470 HydrophobicContact CG-CB 4.48Å; R465-E470 IonicContact CZ-OE2 3.59Å; R465-E470 IonicContact NH1-OE2 3.74Å; R465-E470 PolarHBondContact NH1-OE2 2.64Å; R465-R471 HydrophobicContact CB-CG 4.37Å; R465-R471 PolarHBondContact O-NE 3.18Å; R465-E598 IonicContact CZ-OE2 3.7Å; R465-E598 VanDerWaalsContact CZ-OE2 3.28Å; R465-E598 IonicContact NH1-OE1 2.73Å; R465-E598 IonicContact NH1-OE2 3.49Å; R465-E598 PolarHBondContact NH1-OE2 2.84Å; R465-E598 IonicContact NH2-OE2 3.69Å; R465-E598 PolarHBondContact NH2-OE2 3.45Å
466	P	84.1	Confident	90.5	Very high	38 Å²	38	43.1 Å²	43.1	25%	0.247	19%	0.193	C	C	.	.	S	Bend	trans	-61	-50	-178.5	-24.4	33.8	0	0	0	112.8	P383 R468 R471	P383-P466 WeakPolarHBondContact CG-O 3.47Å; P466-R468 PolarHBondContact O-N 3.49Å; P466-R471 PolarHBondContact O-NH2 3.26Å
467	R	82.2	Confident	90.5	Very high	109 Å²	109	43 Å²	43	41%	0.411	19%	0.193	S	C	.	.	S	Bend	trans	-69.9	125.2	172.3	-68.5	-164.7	-176.3	169.5	-5.9	109.9	E469 E470	R467-E469 VanDerWaalsContact C-N 3.29Å; R467-E469 PolarHBondContact O-N 2.92Å; R467-E470 HydrophobicContact CB-CG 4.3Å; R467-E470 WeakPolarHBondContact CB-OE1 3.21Å; R467-E470 WeakPolarHBondContact CD-OE1 3.42Å; R467-E470 PolarHBondContact O-N 3.49Å
468	R	87.8	Confident	90.5	Very high	89 Å²	89	40.7 Å²	40.7	34%	0.336	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-62.1	-34.3	178.6	56.7	-179.1	-174.1	176.6	-4.8	113.2	D391 S393 P466 E470 R471	D391-R468 VanDerWaalsContact OD2-CD 3.23Å; D391-R468 WeakPolarHBondContact OD2-CD 3.39Å; D391-R468 IonicContact OD2-CZ 3.7Å; D391-R468 IonicContact OD2-NE 3.19Å; D391-R468 IonicContact OD2-NH1 3.47Å; D391-R468 PolarHBondContact OD2-NH1 2.97Å; S393-R468 WeakPolarHBondContact OG-CB 3.29Å; P466-R468 PolarHBondContact O-N 3.49Å; R468-E470 PolarHBondContact O-N 3.41Å; R468-E470 VanDerWaalsContact O-N 3.13Å; R468-R471 WeakPolarHBondContact O-CB 3.47Å; R468-R471 PolarHBondContact O-N 3.17Å
469	E	85.9	Confident	90.2	Very high	115 Å²	115	39.4 Å²	39.4	54%	0.537	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-67.7	-13.8	-177.4	-56.4	76.6	-166.7	0	0	113	R467 L594	R467-E469 VanDerWaalsContact C-N 3.29Å; R467-E469 PolarHBondContact O-N 2.92Å; E469-L594 WeakPolarHBondContact O-CD2 3.38Å
470	E	85.2	Confident	89.8	Confident	26 Å²	26	39.6 Å²	39.6	12%	0.121	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-100.4	-3.2	176.6	-61.4	170.7	-137.3	0	0	113.1	R465 R467 R468 R601	R465-E470 HydrophobicContact CB-CB 4.25Å; R465-E470 VanDerWaalsContact CD-CB 3.43Å; R465-E470 HydrophobicContact CG-CB 4.48Å; R465-E470 IonicContact CZ-OE2 3.59Å; R465-E470 IonicContact NH1-OE2 3.74Å; R465-E470 PolarHBondContact NH1-OE2 2.64Å; R467-E470 HydrophobicContact CB-CG 4.3Å; R467-E470 WeakPolarHBondContact CB-OE1 3.21Å; R467-E470 WeakPolarHBondContact CD-OE1 3.42Å; R467-E470 PolarHBondContact O-N 3.49Å; R468-E470 PolarHBondContact O-N 3.41Å; R468-E470 VanDerWaalsContact O-N 3.13Å; E470-R601 VanDerWaalsContact CD-NH1 3.34Å; E470-R601 IonicContact OE1-CZ 2.8Å; E470-R601 VanDerWaalsContact OE1-CZ 3.3Å; E470-R601 IonicContact OE1-NH1 2.7Å; E470-R601 PolarHBondContact OE1-NH1 3.13Å; E470-R601 IonicContact OE1-NH2 2.71Å; E470-R601 PolarHBondContact OE1-NH2 2.95Å; E470-R601 IonicContact OE2-CZ 2.92Å; E470-R601 IonicContact OE2-NH1 2.73Å; E470-R601 PolarHBondContact OE2-NH1 3.29Å; E470-R601 IonicContact OE2-NH2 2.63Å; E470-R601 PolarHBondContact OE2-NH2 3.32Å
471	R	92.3	Very high	89.1	Confident	11 Å²	11	40.4 Å²	40.4	4%	0.042	19%	0.188	C	C	.	.	S	Bend	trans	-79.8	153.4	175.9	-56.6	179	-163.3	148.2	13.8	109.6	E384 S393 C463 R465 P466 R468	E384-R471 VanDerWaalsContact CD-NH2 3.32Å; E384-R471 IonicContact OE1-CZ 2.79Å; E384-R471 IonicContact OE1-NH1 2.61Å; E384-R471 PolarHBondContact OE1-NH1 3.39Å; E384-R471 IonicContact OE1-NH2 3.18Å; E384-R471 PolarHBondContact OE1-NH2 3.17Å; E384-R471 VanDerWaalsContact OE1-NH2 3.16Å; E384-R471 IonicContact OE2-CZ 2.78Å; E384-R471 IonicContact OE2-NH1 2.71Å; E384-R471 IonicContact OE2-NH2 2.92Å; E384-R471 PolarHBondContact OE2-NH2 2.8Å; S393-R471 PolarHBondContact O-NH1 3.38Å; S393-R471 PolarHBondContact OG-NH1 3.11Å; C463-R471 WeakPolarHBondContact O-CD 3.46Å; R465-R471 HydrophobicContact CB-CG 4.37Å; R465-R471 PolarHBondContact O-NE 3.18Å; P466-R471 PolarHBondContact O-NH2 3.26Å; R468-R471 WeakPolarHBondContact O-CB 3.47Å; R468-R471 PolarHBondContact O-N 3.17Å
472	Y	92.3	Very high	88.8	Confident	9 Å²	9	38.6 Å²	38.6	4%	0.035	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-66.4	158.2	164.4	-67.4	-63.7	0	0	0	110.3	V396 E458 R462 D476 L477	V396-Y472 WeakPolarHBondContact CG1-O 3.48Å; E458-Y472 PolarHBondContact OE1-OH 2.94Å; R462-Y472 HydrophobicContact CB-CD2 3.6Å; R462-Y472 HydrophobicContact CB-CE2 3.52Å; R462-Y472 HydrophobicContact CG-CD2 4.25Å; R462-Y472 HydrophobicContact CG-CE2 3.65Å; R462-Y472 PolarHBondContact NE-OH 2.72Å; R462-Y472 PolarHBondContact NH2-OH 2.78Å; R462-Y472 VanDerWaalsContact NH2-OH 3.16Å; Y472-D476 HydrophobicContact CD1-CB 3.92Å; Y472-L477 HydrophobicContact CD2-CD2 3.56Å; Y472-L477 HydrophobicContact CD2-CG 4.31Å; Y472-L477 HydrophobicContact CE2-CD2 4.25Å; Y472-L477 HydrophobicContact CG-CD2 3.95Å; Y472-L477 HydrophobicContact CG-CG 4.23Å
473	S	93	Very high	88.6	Confident	38 Å²	38	37 Å²	37	27%	0.266	17%	0.171	S	C	.	.	P	Polyproline II helix	trans	-88.5	165.8	160.3	72.4	0	0	0	0	110.6	K475 D476 L477	S473-K475 PolarHBondContact O-N 2.96Å; S473-K475 PolarHBondContact OG-N 3.24Å; S473-D476 WeakPolarHBondContact CA-OD2 3.38Å; S473-D476 VanDerWaalsContact CB-OD2 3.24Å; S473-D476 WeakPolarHBondContact CB-OD2 3.5Å; S473-D476 PolarHBondContact N-OD2 2.76Å; S473-D476 PolarHBondContact O-N 3.35Å; S473-D476 VanDerWaalsContact OG-CG 3.25Å; S473-D476 PolarHBondContact OG-N 2.9Å; S473-D476 PolarHBondContact OG-OD2 3.47Å; S473-L477 WeakPolarHBondContact O-CG 3.41Å; S473-L477 PolarHBondContact O-N 3.49Å; S473-L477 VanDerWaalsContact O-N 3.12Å
474	A	94	Very high	87.6	Confident	2 Å²	2	37.9 Å²	37.9	2%	0.017	18%	0.176	C	C	.	.	H	α-helix	trans	-57.2	-29.5	172.3	0	0	0	0	0	112.9	L323 L326 A327 L478	L323-A474 HydrophobicContact CD2-CB 4.45Å; L326-A474 HydrophobicContact CB-CB 4.07Å; A327-A474 HydrophobicContact CB-CB 4.08Å; A474-L478 WeakPolarHBondContact O-CG 3.4Å; A474-L478 PolarHBondContact O-N 2.7Å
475	K	90.9	Very high	86.3	Confident	135 Å²	135	39 Å²	39	59%	0.587	18%	0.183	S	C	*	.	H	α-helix	trans	-71.1	-47	176.1	-65.6	179	-178.7	173.8	0	111.9	S473 L477 L478 I479	S473-K475 PolarHBondContact O-N 2.96Å; S473-K475 PolarHBondContact OG-N 3.24Å; K475-L477 VanDerWaalsContact C-N 3.26Å; K475-L477 PolarHBondContact O-N 3.19Å; K475-L478 PolarHBondContact O-N 3.01Å; K475-I479 PolarHBondContact O-N 2.77Å
476	D	90.8	Very high	84.8	Confident	26 Å²	26	40.9 Å²	40.9	14%	0.139	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-36.7	179.2	-47	-70.2	0	0	0	111.4	Y472 S473 I479 H480 Q587 K590	Y472-D476 HydrophobicContact CD1-CB 3.92Å; S473-D476 WeakPolarHBondContact CA-OD2 3.38Å; S473-D476 VanDerWaalsContact CB-OD2 3.24Å; S473-D476 WeakPolarHBondContact CB-OD2 3.5Å; S473-D476 PolarHBondContact N-OD2 2.76Å; S473-D476 PolarHBondContact O-N 3.35Å; S473-D476 VanDerWaalsContact OG-CG 3.25Å; S473-D476 PolarHBondContact OG-N 2.9Å; S473-D476 PolarHBondContact OG-OD2 3.47Å; D476-I479 PolarHBondContact O-N 3.25Å; D476-H480 PolarHBondContact O-N 2.69Å; D476-H480 VanDerWaalsContact O-N 3.09Å; D476-Q587 PolarHBondContact O-NE2 2.71Å; D476-K590 VanDerWaalsContact OD1-CD 3.24Å; D476-K590 WeakPolarHBondContact OD1-CD 3.48Å; D476-K590 IonicContact OD1-NZ 2.67Å; D476-K590 PolarHBondContact OD1-NZ 3.23Å; D476-K590 IonicContact OD2-NZ 3.8Å; D476-K590 PolarHBondContact OD2-NZ 3.13Å
477	L	92.6	Very high	83.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65	-42.3	177	-71.7	168.1	0	0	0	111.7	L323 V396 F399 I459 Y472 S473 K475 I479 H480 F483	L323-L477 HydrophobicContact CD1-CB 3.7Å; L323-L477 HydrophobicContact CD2-CB 3.81Å; L323-L477 HydrophobicContact CD2-CD1 3.6Å; L323-L477 HydrophobicContact CD2-CG 4.34Å; L323-L477 HydrophobicContact CG-CB 4.38Å; V396-L477 HydrophobicContact CG1-CD1 3.89Å; F399-L477 HydrophobicContact CD1-CD1 4.05Å; F399-L477 HydrophobicContact CE1-CD1 3.96Å; I459-L477 HydrophobicContact CG2-CD2 3.98Å; Y472-L477 HydrophobicContact CD2-CD2 3.56Å; Y472-L477 HydrophobicContact CD2-CG 4.31Å; Y472-L477 HydrophobicContact CE2-CD2 4.25Å; Y472-L477 HydrophobicContact CG-CD2 3.95Å; Y472-L477 HydrophobicContact CG-CG 4.23Å; S473-L477 WeakPolarHBondContact O-CG 3.41Å; S473-L477 PolarHBondContact O-N 3.49Å; S473-L477 VanDerWaalsContact O-N 3.12Å; K475-L477 VanDerWaalsContact C-N 3.26Å; K475-L477 PolarHBondContact O-N 3.19Å; L477-I479 PolarHBondContact O-N 3.14Å; L477-I479 VanDerWaalsContact O-N 3.17Å; L477-H480 WeakPolarHBondContact O-CB 3.4Å; L477-H480 PolarHBondContact O-N 3.42Å; L477-H480 VanDerWaalsContact O-N 3.07Å; L477-F483 HydrophobicContact CB-CD2 4.45Å; L477-F483 HydrophobicContact CD2-CE2 4.33Å; L477-F483 WeakPolarHBondContact O-CB 3.39Å; L477-F483 VanDerWaalsContact O-CD2 3.26Å; L477-F483 WeakPolarHBondContact O-CD2 3.46Å
478	L	90.2	Very high	82	Confident	47 Å²	47	43.2 Å²	43.2	25%	0.246	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-22.7	175.5	-73	168.2	0	0	0	113.6	R320 L323 K324 A327 A474 K475	R320-L478 HydrophobicContact CG-CD2 4.18Å; L323-L478 HydrophobicContact CB-CD2 3.67Å; L323-L478 HydrophobicContact CB-CG 3.91Å; K324-L478 HydrophobicContact CG-CD2 4.09Å; A327-L478 HydrophobicContact CB-CD1 3.88Å; A474-L478 WeakPolarHBondContact O-CG 3.4Å; A474-L478 PolarHBondContact O-N 2.7Å; K475-L478 PolarHBondContact O-N 3.01Å
479	I	85.4	Confident	80.6	Confident	39 Å²	39	41.5 Å²	41.5	20%	0.2	21%	0.205	C	C	.	.	H	α-helix	trans	-93.8	-11.8	178.2	-69.2	166.9	0	0	0	112.4	K475 D476 L477 M484 D583 K584 Q587	K475-I479 PolarHBondContact O-N 2.77Å; D476-I479 PolarHBondContact O-N 3.25Å; L477-I479 PolarHBondContact O-N 3.14Å; L477-I479 VanDerWaalsContact O-N 3.17Å; I479-M484 WeakPolarHBondContact O-CG 3.45Å; I479-D583 HydrophobicContact CD1-CB 4.14Å; I479-D583 HydrophobicContact CG1-CB 4.16Å; I479-D583 HydrophobicContact CG2-CB 3.83Å; I479-K584 PolarHBondContact O-NZ 3.35Å; I479-K584 VanDerWaalsContact O-NZ 3.13Å; I479-Q587 HydrophobicContact CG2-CB 4.37Å
480	H	85	Confident	79.7	Confident	3 Å²	3	36.3 Å²	36.3	1%	0.014	18%	0.183	C	C	.	.	S	Bend	trans	-65.7	142.1	178.2	-161.4	-99.8	0	0	0	111.7	D476 L477 F482 F483 M484 R498	D476-H480 PolarHBondContact O-N 2.69Å; D476-H480 VanDerWaalsContact O-N 3.09Å; L477-H480 WeakPolarHBondContact O-CB 3.4Å; L477-H480 PolarHBondContact O-N 3.42Å; L477-H480 VanDerWaalsContact O-N 3.07Å; H480-F482 PolarHBondContact O-N 3.27Å; H480-F483 HydrophobicContact CB-CD2 4.44Å; H480-F483 PolarHBondContact O-N 2.94Å; H480-M484 WeakPolarHBondContact O-CG 3.21Å; H480-M484 PolarHBondContact O-N 2.86Å; H480-R498 PolarHBondContact NE2-NH1 3.33Å
481	D	80.6	Confident	79.3	Confident	18 Å²	18	35.3 Å²	35.3	10%	0.096	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-30.2	-174.7	-61.1	-82.1	0	0	0	114.1	F483 K584	D481-F483 VanDerWaalsContact C-N 3.32Å; D481-F483 PolarHBondContact O-N 3.28Å; D481-K584 WeakPolarHBondContact OD1-CE 3.47Å; D481-K584 IonicContact OD1-NZ 3.64Å; D481-K584 PolarHBondContact OD1-NZ 2.96Å; D481-K584 IonicContact OD2-NZ 2.99Å; D481-K584 PolarHBondContact OD2-NZ 3.47Å
482	F	84.8	Confident	78.6	Confident	16 Å²	16	38.5 Å²	38.5	7%	0.07	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-13.7	175.5	-172.3	-99.9	0	0	0	114.2	V312 L315 K316 M403 E455 I456 I459 H480	V312-F482 HydrophobicContact CG1-CE2 4.12Å; V312-F482 HydrophobicContact CG1-CZ 4.12Å; L315-F482 HydrophobicContact CD2-CE1 4.08Å; L315-F482 HydrophobicContact CD2-CZ 4.17Å; K316-F482 VanDerWaalsContact CE-C 3.48Å; K316-F482 WeakPolarHBondContact CE-O 3.13Å; K316-F482 HydrophobicContact CG-CE1 4.4Å; K316-F482 HydrophobicContact CG-CZ 4.37Å; K316-F482 WeakPolarHBondContact CG-O 3.42Å; M403-F482 HydrophobicContact CE-CD1 4.08Å; M403-F482 HydrophobicContact CE-CE1 3.73Å; E455-F482 HydrophobicContact CB-CB 4.46Å; E455-F482 HydrophobicContact CB-CD2 4.3Å; E455-F482 WeakPolarHBondContact OE2-CB 3.28Å; E455-F482 WeakPolarHBondContact OE2-CD2 3.21Å; I456-F482 HydrophobicContact CD1-CE1 4.3Å; I456-F482 HydrophobicContact CD1-CE2 3.91Å; I456-F482 HydrophobicContact CD1-CZ 3.55Å; I456-F482 HydrophobicContact CG1-CD1 4.48Å; I456-F482 HydrophobicContact CG1-CD2 4.28Å; I456-F482 HydrophobicContact CG1-CE1 3.91Å; I456-F482 HydrophobicContact CG1-CE2 3.68Å; I456-F482 HydrophobicContact CG1-CZ 3.49Å; I456-F482 VanDerWaalsContact CG1-CZ 3.49Å; I459-F482 HydrophobicContact CD1-CB 3.51Å; I459-F482 HydrophobicContact CD1-CD1 3.61Å; I459-F482 HydrophobicContact CD1-CG 3.73Å; H480-F482 PolarHBondContact O-N 3.27Å
483	F	85.8	Confident	78.2	Confident	1 Å²	1	38.1 Å²	38.1	0%	0.004	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-15.2	178.5	-65	-54.3	0	0	0	114.3	C319 R320 L323 F399 M403 I459 L477 H480 D481	C319-F483 HydrophobicContact CB-CD1 4.14Å; C319-F483 HydrophobicContact CB-CE1 3.27Å; C319-F483 HydrophobicContact CB-CZ 3.76Å; R320-F483 WeakPolarHBondContact CD-O 3.37Å; L323-F483 HydrophobicContact CD1-CD1 4.43Å; L323-F483 HydrophobicContact CD1-CD2 3.77Å; L323-F483 HydrophobicContact CD1-CE2 3.83Å; L323-F483 HydrophobicContact CD1-CG 4.07Å; L323-F483 HydrophobicContact CD1-CZ 4.21Å; F399-F483 HydrophobicContact CZ-CE2 4.36Å; F399-F483 HydrophobicContact CZ-CZ 4Å; M403-F483 HydrophobicContact CE-CE1 4.46Å; M403-F483 HydrophobicContact CE-CZ 3.78Å; M403-F483 HydrophobicContact SD-CZ 3.75Å; I459-F483 HydrophobicContact CD1-CE2 4.04Å; I459-F483 HydrophobicContact CD1-CZ 4.44Å; I459-F483 HydrophobicContact CG2-CE2 3.98Å; I459-F483 HydrophobicContact CG2-CZ 4.37Å; L477-F483 HydrophobicContact CB-CD2 4.45Å; L477-F483 HydrophobicContact CD2-CE2 4.33Å; L477-F483 WeakPolarHBondContact O-CB 3.39Å; L477-F483 VanDerWaalsContact O-CD2 3.26Å; L477-F483 WeakPolarHBondContact O-CD2 3.46Å; H480-F483 HydrophobicContact CB-CD2 4.44Å; H480-F483 PolarHBondContact O-N 2.94Å; D481-F483 VanDerWaalsContact C-N 3.32Å; D481-F483 PolarHBondContact O-N 3.28Å
484	M	74.4	Confident	77.8	Confident	20 Å²	20	37.8 Å²	37.8	10%	0.099	18%	0.183	C	C	.	.	S	Bend	trans	-53	127.2	164	-66.8	175.8	93.5	0	0	109.6	K316 I479 H480 E486 L580 K584	K316-M484 PolarHBondContact NZ-O 3.02Å; I479-M484 WeakPolarHBondContact O-CG 3.45Å; H480-M484 WeakPolarHBondContact O-CG 3.21Å; H480-M484 PolarHBondContact O-N 2.86Å; M484-E486 PolarHBondContact O-N 3.37Å; M484-L580 HydrophobicContact CE-CD2 3.28Å; M484-K584 WeakPolarHBondContact SD-CE 3.49Å; M484-K584 PolarHBondContact SD-NZ 3.34Å; M484-K584 VanDerWaalsContact SD-NZ 3.45Å
485	P	66.1	Low	77.6	Confident	33 Å²	33	38.7 Å²	38.7	21%	0.214	19%	0.189	C	C	.	.			trans	-62.4	130.5	175.2	-21.9	33.2	0	0	0	110.9	E487 L488	P485-E487 HydrophobicContact CB-CB 4.48Å; P485-E487 PolarHBondContact O-N 3.45Å; P485-E487 VanDerWaalsContact O-N 3.1Å; P485-L488 HydrophobicContact CB-CG 4.11Å; P485-L488 HydrophobicContact CG-CD1 4.23Å; P485-L488 HydrophobicContact CG-CG 3.99Å; P485-L488 PolarHBondContact O-N 3.2Å
486	E	58.4	Low	77.4	Confident	83 Å²	83	35 Å²	35	39%	0.388	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-18.6	166	-74.1	149.7	-135.2	0	0	111.4	K313 K316 M484 L516	K313-E486 IonicContact NZ-OE2 2.69Å; K316-E486 IonicContact NZ-OE1 2.73Å; K316-E486 PolarHBondContact NZ-OE1 3.39Å; M484-E486 PolarHBondContact O-N 3.37Å; E486-L516 HydrophobicContact CB-CD1 4.3Å; E486-L516 HydrophobicContact CG-CD1 4.35Å
487	E	53.4	Low	77.1	Confident	119 Å²	119	38.9 Å²	38.9	56%	0.556	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.1	3.8	-176.4	-64.7	150.4	175.8	0	0	113.7	F106 P485 I489	F106-E487 WeakPolarHBondContact CD2-OE1 3.34Å; P485-E487 HydrophobicContact CB-CB 4.48Å; P485-E487 PolarHBondContact O-N 3.45Å; P485-E487 VanDerWaalsContact O-N 3.1Å; E487-I489 PolarHBondContact O-N 3.45Å
488	L	53.8	Low	76.7	Confident	77 Å²	77	41.5 Å²	41.5	40%	0.403	20%	0.203	S	C	.	.	S	Bend	trans	-71	88	167.3	-88	-180	0	0	0	108.5	P485 G490 L491	P485-L488 HydrophobicContact CB-CG 4.11Å; P485-L488 HydrophobicContact CG-CD1 4.23Å; P485-L488 HydrophobicContact CG-CG 3.99Å; P485-L488 PolarHBondContact O-N 3.2Å; L488-G490 PolarHBondContact O-N 2.93Å; L488-L491 PolarHBondContact O-N 3.46Å
489	I	57.5	Low	76.4	Confident	53 Å²	53	47.5 Å²	47.5	27%	0.272	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.3	2.4	177.2	-61.7	-157.9	0	0	0	113.9	E487 L491 K520 D573 T576	E487-I489 PolarHBondContact O-N 3.45Å; I489-L491 HydrophobicContact CB-CD1 4.33Å; I489-L491 HydrophobicContact CB-CG 4.45Å; I489-L491 HydrophobicContact CG2-CD1 3.7Å; I489-L491 HydrophobicContact CG2-CG 4.02Å; I489-K520 WeakPolarHBondContact O-CE 3.26Å; I489-D573 HydrophobicContact CG2-CB 4.24Å; I489-D573 WeakPolarHBondContact CG2-OD1 3.41Å; I489-D573 VanDerWaalsContact CG2-OD2 3.29Å; I489-D573 WeakPolarHBondContact CG2-OD2 3.49Å; I489-T576 HydrophobicContact CB-CG2 4.33Å; I489-T576 HydrophobicContact CD1-CG2 3.95Å; I489-T576 WeakPolarHBondContact CD1-OG1 3.3Å; I489-T576 HydrophobicContact CG1-CG2 4.11Å
490	G	66.8	Low	76.4	Confident	7 Å²	7	50.2 Å²	50.2	7%	0.072	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.7	28.1	-174.8	0	0	0	0	0	112.4	L488 L516 D517	L488-G490 PolarHBondContact O-N 2.93Å; G490-L516 PolarHBondContact O-N 3.4Å; G490-D517 PolarHBondContact O-N 3.06Å
491	L	76.8	Confident	76.5	Confident	5 Å²	5	51 Å²	51	3%	0.026	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	141.9	-177.1	-60.8	176.3	0	0	0	111	L488 I489 L513 R514 V515 Y524 D573 I577 L580	L488-L491 PolarHBondContact O-N 3.46Å; I489-L491 HydrophobicContact CB-CD1 4.33Å; I489-L491 HydrophobicContact CB-CG 4.45Å; I489-L491 HydrophobicContact CG2-CD1 3.7Å; I489-L491 HydrophobicContact CG2-CG 4.02Å; L491-L513 HydrophobicContact CB-CD1 4.27Å; L491-R514 WeakPolarHBondContact CA-O 3.35Å; L491-V515 HydrophobicContact CD2-CB 4.28Å; L491-V515 HydrophobicContact CD2-CG1 4.19Å; L491-V515 HydrophobicContact CD2-CG2 3.77Å; L491-Y524 HydrophobicContact CD2-CE2 4.46Å; L491-D573 HydrophobicContact CD1-CB 4.23Å; L491-I577 HydrophobicContact CD1-CD1 3.64Å; L491-I577 HydrophobicContact CD1-CG1 3.57Å; L491-L580 HydrophobicContact CB-CD1 4.3Å
492	R	78.4	Confident	76.8	Confident	77 Å²	77	51 Å²	51	29%	0.291	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	129.9	172.7	-170.6	-175.4	-170	-160.2	13.9	110.1	E455 E494 L513 R514 L516	E455-R492 IonicContact OE1-NH2 2.82Å; R492-E494 WeakPolarHBondContact CD-OE1 3.37Å; R492-E494 HydrophobicContact CG-CG 4.17Å; R492-E494 IonicContact CZ-OE1 3.16Å; R492-E494 IonicContact NE-OE1 2.81Å; R492-E494 IonicContact NH1-OE1 2.73Å; R492-E494 PolarHBondContact NH1-OE1 2.83Å; R492-L513 CarbonylContact O-C 3.58Å; R492-L513 WeakPolarHBondContact O-CA 3.48Å; R492-R514 PolarHBondContact N-O 2.86Å; R492-R514 PolarHBondContact O-N 3.28Å; R492-L516 HydrophobicContact CB-CD1 4.16Å; R492-L516 HydrophobicContact CB-CG 4.4Å
493	L	84.2	Confident	76.9	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	110.2	175.5	-173.5	67.6	0	0	0	110.2	F511 L513 F534 L580 L581 K584	L493-F511 HydrophobicContact CD1-CB 4.06Å; L493-F511 HydrophobicContact CD1-CD1 4.18Å; L493-F511 HydrophobicContact CD1-CG 4.41Å; L493-F511 HydrophobicContact CD2-CD1 4.22Å; L493-F511 HydrophobicContact CD2-CE1 4.42Å; L493-F511 HydrophobicContact CG-CD1 4.02Å; L493-L513 HydrophobicContact CD1-CB 4.06Å; L493-L513 HydrophobicContact CD1-CD1 4.4Å; L493-F534 HydrophobicContact CD1-CE1 3.71Å; L493-F534 HydrophobicContact CD1-CZ 3.72Å; L493-L580 HydrophobicContact CB-CB 4.31Å; L493-L580 HydrophobicContact CD2-CB 4.23Å; L493-L581 HydrophobicContact CD2-CB 3.94Å; L493-L581 HydrophobicContact CD2-CD1 4.09Å; L493-K584 HydrophobicContact CD2-CB 4.45Å; L493-K584 HydrophobicContact CD2-CG 4.2Å; L493-K584 WeakPolarHBondContact O-CE 3.45Å
494	E	84.9	Confident	76.9	Confident	31 Å²	31	54.1 Å²	54.1	15%	0.145	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	148.6	-178.6	-64.1	169.9	-177.2	0	0	110.9	R492 F511 L512 R514	R492-E494 WeakPolarHBondContact CD-OE1 3.37Å; R492-E494 HydrophobicContact CG-CG 4.17Å; R492-E494 IonicContact CZ-OE1 3.16Å; R492-E494 IonicContact NE-OE1 2.81Å; R492-E494 IonicContact NH1-OE1 2.73Å; R492-E494 PolarHBondContact NH1-OE1 2.83Å; E494-F511 CarbonylContact O-C 3.55Å; E494-F511 WeakPolarHBondContact O-CA 3.49Å; E494-L512 HydrophobicContact CB-CB 4.37Å; E494-L512 PolarHBondContact N-O 2.77Å; E494-L512 PolarHBondContact O-N 3.24Å; E494-R514 WeakPolarHBondContact OE1-CD 3.44Å; E494-R514 IonicContact OE1-NE 2.72Å; E494-R514 PolarHBondContact OE1-NE 2.98Å; E494-R514 IonicContact OE2-CZ 2.7Å; E494-R514 VanDerWaalsContact OE2-CZ 3.27Å; E494-R514 IonicContact OE2-NE 2.7Å; E494-R514 PolarHBondContact OE2-NE 2.93Å; E494-R514 IonicContact OE2-NH2 3.61Å; E494-R514 PolarHBondContact OE2-NH2 2.84Å
495	V	88.5	Confident	77.3	Confident	22 Å²	22	58.3 Å²	58.3	13%	0.133	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	124.5	170.3	-176.1	0	0	0	0	108.8	R498 T501 V509 F511 K584 I588	V495-R498 HydrophobicContact CB-CB 4.34Å; V495-R498 HydrophobicContact CG1-CB 4.38Å; V495-T501 HydrophobicContact CG1-CG2 3.81Å; V495-V509 HydrophobicContact CG1-CG1 3.96Å; V495-F511 HydrophobicContact CG2-CD1 4.26Å; V495-F511 HydrophobicContact CG2-CE1 3.86Å; V495-K584 HydrophobicContact CG2-CD 4.4Å; V495-I588 HydrophobicContact CG1-CD1 4.37Å; V495-I588 HydrophobicContact CG2-CD1 3.85Å; V495-I588 HydrophobicContact CG2-CG1 4.08Å
496	K	87	Confident	78.3	Confident	57 Å²	57	61.6 Å²	61.6	25%	0.248	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	136.7	175.5	-163.7	173.4	161.5	-168.3	0	110	R498 T501 Q510 L512 Q533	K496-R498 VanDerWaalsContact C-N 3.26Å; K496-R498 PolarHBondContact O-N 2.79Å; K496-R498 VanDerWaalsContact O-N 3.17Å; K496-T501 PolarHBondContact O-OG1 3.48Å; K496-Q510 HydrophobicContact CB-CB 3.86Å; K496-Q510 VanDerWaalsContact CB-O 3.23Å; K496-Q510 WeakPolarHBondContact CB-O 3.34Å; K496-Q510 HydrophobicContact CD-CB 3.98Å; K496-Q510 PolarHBondContact N-O 3.39Å; K496-L512 HydrophobicContact CB-CD1 3.56Å; K496-L512 HydrophobicContact CD-CD1 4.37Å; K496-L512 HydrophobicContact CG-CD1 3.94Å; K496-Q533 HydrophobicContact CD-CG 4.5Å
497	D	84.7	Confident	79.8	Confident	108 Å²	108	60.6 Å²	60.6	58%	0.578	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.9	47.3	176.7	-54.5	-40.9	0	0	0	112.7	E499 T500 T501	D497-E499 PolarHBondContact O-N 2.86Å; D497-T500 WeakPolarHBondContact O-CA 3.42Å; D497-T500 WeakPolarHBondContact O-CB 3.4Å; D497-T500 PolarHBondContact O-N 3.19Å; D497-T501 PolarHBondContact O-N 3.14Å; D497-T501 PolarHBondContact O-OG1 3.3Å
498	R	83.6	Confident	81.6	Confident	55 Å²	55	60.1 Å²	60.1	21%	0.208	32%	0.323	C	S	.	.	H	α-helix	trans	-45.7	-42.5	-169.9	-176.4	179.9	173	-162.8	-3.5	113.7	E458 H480 V495 K496 T501 V502 D591	E458-R498 IonicContact OE2-NH1 2.77Å; H480-R498 PolarHBondContact NE2-NH1 3.33Å; V495-R498 HydrophobicContact CB-CB 4.34Å; V495-R498 HydrophobicContact CG1-CB 4.38Å; K496-R498 VanDerWaalsContact C-N 3.26Å; K496-R498 PolarHBondContact O-N 2.79Å; K496-R498 VanDerWaalsContact O-N 3.17Å; R498-T501 PolarHBondContact O-N 2.99Å; R498-V502 HydrophobicContact CG-CG2 4.36Å; R498-V502 WeakPolarHBondContact O-CB 3.25Å; R498-V502 VanDerWaalsContact O-CG2 3.29Å; R498-V502 WeakPolarHBondContact O-CG2 3.25Å; R498-V502 PolarHBondContact O-N 2.72Å; R498-D591 IonicContact CZ-OD2 2.71Å; R498-D591 IonicContact NE-OD2 3.49Å; R498-D591 PolarHBondContact NE-OD2 2.8Å; R498-D591 IonicContact NH2-OD1 2.77Å; R498-D591 IonicContact NH2-OD2 3.18Å; R498-D591 PolarHBondContact NH2-OD2 3.03Å
499	E	83.7	Confident	83.3	Confident	173 Å²	173	56.5 Å²	56.5	81%	0.808	30%	0.304	S	S	*	.	H	α-helix	trans	-60.4	-49	177.6	-62.7	-174.3	172.1	0	0	112.2	D497 V502 A503	D497-E499 PolarHBondContact O-N 2.86Å; E499-V502 PolarHBondContact O-N 2.88Å; E499-A503 WeakPolarHBondContact O-CB 3.22Å; E499-A503 PolarHBondContact O-N 3.24Å
500	T	86.4	Confident	84.9	Confident	96 Å²	96	57 Å²	57	59%	0.589	31%	0.305	S	S	*	.	H	α-helix	trans	-64.6	-41.3	175.4	-49.9	0	0	0	0	111.2	D497 V502 A503 S504	D497-T500 WeakPolarHBondContact O-CA 3.42Å; D497-T500 WeakPolarHBondContact O-CB 3.4Å; D497-T500 PolarHBondContact O-N 3.19Å; T500-V502 VanDerWaalsContact C-N 3.31Å; T500-V502 PolarHBondContact O-N 2.83Å; T500-A503 PolarHBondContact O-N 2.83Å; T500-S504 WeakPolarHBondContact O-CB 3.29Å; T500-S504 PolarHBondContact O-N 2.99Å
501	T	86.4	Confident	86	Confident	18 Å²	18	56.7 Å²	56.7	11%	0.11	30%	0.302	C	S	.	.	H	α-helix	trans	-61.7	-36.3	176.6	-70.8	0	0	0	0	112.4	V495 K496 D497 R498 V509 I588 R592	V495-T501 HydrophobicContact CG1-CG2 3.81Å; K496-T501 PolarHBondContact O-OG1 3.48Å; D497-T501 PolarHBondContact O-N 3.14Å; D497-T501 PolarHBondContact O-OG1 3.3Å; R498-T501 PolarHBondContact O-N 2.99Å; T501-V509 HydrophobicContact CG2-CB 4.41Å; T501-V509 HydrophobicContact CG2-CG1 3.76Å; T501-V509 HydrophobicContact CG2-CG2 3.87Å; T501-I588 HydrophobicContact CG2-CG2 4.21Å; T501-R592 VanDerWaalsContact O-CZ 3.28Å; T501-R592 PolarHBondContact O-NE 3.27Å; T501-R592 PolarHBondContact O-NH2 3.23Å
502	V	86.7	Confident	86.6	Confident	20 Å²	20	57.9 Å²	57.9	12%	0.121	31%	0.308	C	S	.	.	H	α-helix	trans	-80	-33.2	177.2	168.9	0	0	0	0	112.4	R498 E499 T500 D591 Y595	R498-V502 HydrophobicContact CG-CG2 4.36Å; R498-V502 WeakPolarHBondContact O-CB 3.25Å; R498-V502 VanDerWaalsContact O-CG2 3.29Å; R498-V502 WeakPolarHBondContact O-CG2 3.25Å; R498-V502 PolarHBondContact O-N 2.72Å; E499-V502 PolarHBondContact O-N 2.88Å; T500-V502 VanDerWaalsContact C-N 3.31Å; T500-V502 PolarHBondContact O-N 2.83Å; V502-D591 HydrophobicContact CG1-CB 3.98Å; V502-D591 HydrophobicContact CG2-CB 3.64Å; V502-Y595 HydrophobicContact CG1-CD2 4.27Å; V502-Y595 HydrophobicContact CG1-CG 4.2Å
503	A	86.9	Confident	86.9	Confident	48 Å²	48	54.4 Å²	54.4	40%	0.397	30%	0.295	S	S	.	.	H	α-helix	trans	-77.5	-23.9	175.2	0	0	0	0	0	113.8	E499 T500 Y595	E499-A503 WeakPolarHBondContact O-CB 3.22Å; E499-A503 PolarHBondContact O-N 3.24Å; T500-A503 PolarHBondContact O-N 2.83Å; A503-Y595 HydrophobicContact CB-CE1 3.97Å; A503-Y595 HydrophobicContact CB-CE2 4.25Å
504	S	85.9	Confident	86.8	Confident	34 Å²	34	57.7 Å²	57.7	24%	0.238	31%	0.308	C	S	.	.			trans	-81.5	146.7	-176.8	-178	0	0	0	0	113.4	T500 N506 R592	T500-S504 WeakPolarHBondContact O-CB 3.29Å; T500-S504 PolarHBondContact O-N 2.99Å; S504-N506 WeakPolarHBondContact OG-CB 3.36Å; S504-N506 PolarHBondContact OG-N 3.38Å; S504-N506 VanDerWaalsContact OG-N 3.11Å; S504-N506 PolarHBondContact OG-OD1 3.01Å; S504-R592 PolarHBondContact O-NE 2.84Å; S504-R592 PolarHBondContact O-NH2 3.3Å
505	S	83.7	Confident	86.5	Confident	108 Å²	108	56.7 Å²	56.7	76%	0.755	30%	0.304	S	S	*	.			trans	-84.6	-7.7	170.4	51.1	0	0	0	0	114.2
506	N	87.5	Confident	85.8	Confident	102 Å²	102	58.7 Å²	58.7	55%	0.545	31%	0.313	S	S	.	.			trans	-64.7	136.5	-175.2	-64.1	4.8	0	0	0	111.5	S504 R592	S504-N506 WeakPolarHBondContact OG-CB 3.36Å; S504-N506 PolarHBondContact OG-N 3.38Å; S504-N506 VanDerWaalsContact OG-N 3.11Å; S504-N506 PolarHBondContact OG-OD1 3.01Å; N506-R592 PolarHBondContact O-NH1 3.36Å; N506-R592 PolarHBondContact O-NH2 3.26Å
507	N	89.1	Confident	85.2	Confident	62 Å²	62	58.7 Å²	58.7	33%	0.332	32%	0.316	S	S	.	.	S	Bend	trans	-73.4	-31.5	178.5	-61.1	-29.4	0	0	0	112.6	D537 L538 L539	N507-D537 WeakPolarHBondContact CB-OD1 3.21Å; N507-L538 WeakPolarHBondContact O-CB 3.37Å; N507-L538 VanDerWaalsContact O-CG 3.29Å; N507-L538 WeakPolarHBondContact O-CG 3.3Å; N507-L538 PolarHBondContact O-N 3.11Å; N507-L539 HydrophobicContact CB-CG 4.41Å; N507-L539 VanDerWaalsContact ND2-CD1 3.31Å; N507-L539 WeakPolarHBondContact ND2-CD1 3.21Å
508	E	90.3	Very high	84.6	Confident	108 Å²	108	58.8 Å²	58.8	51%	0.505	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	130.1	175	-167.3	-173	-171	0	0	111.2	S535 F536	E508-S535 WeakPolarHBondContact OE1-CB 3.49Å; E508-S535 PolarHBondContact OE1-OG 3.5Å; E508-F536 CarbonylContact C-O 3.59Å; E508-F536 WeakPolarHBondContact CA-O 3.26Å
509	V	90.7	Very high	84.2	Confident	1 Å²	1	63 Å²	63	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	133	173.2	176.3	0	0	0	0	109.6	V495 T501 F511 S535 F536 L538 I588	V495-V509 HydrophobicContact CG1-CG1 3.96Å; T501-V509 HydrophobicContact CG2-CB 4.41Å; T501-V509 HydrophobicContact CG2-CG1 3.76Å; T501-V509 HydrophobicContact CG2-CG2 3.87Å; V509-F511 HydrophobicContact CB-CE2 4.2Å; V509-F511 HydrophobicContact CG1-CD2 4.24Å; V509-F511 HydrophobicContact CG1-CE2 3.94Å; V509-F511 HydrophobicContact CG1-CZ 4.15Å; V509-S535 CarbonylContact O-C 3.58Å; V509-S535 VanDerWaalsContact O-CA 3.25Å; V509-S535 WeakPolarHBondContact O-CA 3.18Å; V509-F536 PolarHBondContact N-O 3.24Å; V509-F536 PolarHBondContact O-N 2.78Å; V509-L538 HydrophobicContact CG2-CD1 3.55Å; V509-L538 HydrophobicContact CG2-CD2 4.32Å; V509-L538 HydrophobicContact CG2-CG 3.8Å; V509-I588 HydrophobicContact CG1-CD1 4Å; V509-I588 HydrophobicContact CG2-CG2 4.46Å
510	Q	91.1	Very high	83.7	Confident	65 Å²	65	56 Å²	56	30%	0.304	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	128.8	171.6	-70.1	-178.8	11.4	0	0	110.9	K496 F534	K496-Q510 HydrophobicContact CB-CB 3.86Å; K496-Q510 VanDerWaalsContact CB-O 3.23Å; K496-Q510 WeakPolarHBondContact CB-O 3.34Å; K496-Q510 HydrophobicContact CD-CB 3.98Å; K496-Q510 PolarHBondContact N-O 3.39Å; Q510-F534 CarbonylContact C-O 3.57Å; Q510-F534 WeakPolarHBondContact CA-O 3.45Å
511	F	90.5	Very high	83	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	155.2	177.1	-76.3	-77.4	0	0	0	110.9	L493 E494 V495 V509 Q533 F534 F536 L581 K584 I585 I588	L493-F511 HydrophobicContact CD1-CB 4.06Å; L493-F511 HydrophobicContact CD1-CD1 4.18Å; L493-F511 HydrophobicContact CD1-CG 4.41Å; L493-F511 HydrophobicContact CD2-CD1 4.22Å; L493-F511 HydrophobicContact CD2-CE1 4.42Å; L493-F511 HydrophobicContact CG-CD1 4.02Å; E494-F511 CarbonylContact O-C 3.55Å; E494-F511 WeakPolarHBondContact O-CA 3.49Å; V495-F511 HydrophobicContact CG2-CD1 4.26Å; V495-F511 HydrophobicContact CG2-CE1 3.86Å; V509-F511 HydrophobicContact CB-CE2 4.2Å; V509-F511 HydrophobicContact CG1-CD2 4.24Å; V509-F511 HydrophobicContact CG1-CE2 3.94Å; V509-F511 HydrophobicContact CG1-CZ 4.15Å; F511-Q533 WeakPolarHBondContact O-CA 3.14Å; F511-F534 HydrophobicContact CB-CD1 4.05Å; F511-F534 HydrophobicContact CB-CD2 4.14Å; F511-F534 HydrophobicContact CB-CE1 3.61Å; F511-F534 HydrophobicContact CB-CE2 3.71Å; F511-F534 HydrophobicContact CB-CG 4.31Å; F511-F534 HydrophobicContact CB-CZ 3.44Å; F511-F534 VanDerWaalsContact CB-CZ 3.44Å; F511-F534 HydrophobicContact CD2-CD2 4.41Å; F511-F534 AromaticContact CD2-CE2 3.77Å; F511-F534 HydrophobicContact CD2-CE2 3.77Å; F511-F534 HydrophobicContact CD2-CZ 4.17Å; F511-F534 HydrophobicContact CG-CE2 4Å; F511-F534 AromaticContact CG-CZ 3.94Å; F511-F534 HydrophobicContact CG-CZ 3.94Å; F511-F534 PolarHBondContact N-O 3.35Å; F511-F534 PolarHBondContact O-N 3.09Å; F511-F534 VanDerWaalsContact O-N 3.12Å; F511-F536 HydrophobicContact CD2-CB 3.85Å; F511-F536 HydrophobicContact CE2-CB 3.7Å; F511-F536 HydrophobicContact CE2-CG 4.23Å; F511-L581 HydrophobicContact CD2-CD1 3.95Å; F511-L581 HydrophobicContact CE1-CD1 4.25Å; F511-L581 HydrophobicContact CE2-CD1 3.6Å; F511-L581 HydrophobicContact CG-CD1 4.41Å; F511-L581 HydrophobicContact CZ-CD1 3.76Å; F511-K584 HydrophobicContact CE1-CB 3.81Å; F511-K584 HydrophobicContact CZ-CB 4.34Å; F511-I585 HydrophobicContact CZ-CG1 4.26Å; F511-I588 HydrophobicContact CE1-CD1 3.86Å; F511-I588 HydrophobicContact CE2-CD1 4.49Å; F511-I588 HydrophobicContact CZ-CD1 3.5Å
512	L	87.7	Confident	82.3	Confident	30 Å²	30	59.3 Å²	59.3	16%	0.157	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	115.5	167.4	-55.8	95.5	0	0	0	110.3	E494 K496 A531 V532	E494-L512 HydrophobicContact CB-CB 4.37Å; E494-L512 PolarHBondContact N-O 2.77Å; E494-L512 PolarHBondContact O-N 3.24Å; K496-L512 HydrophobicContact CB-CD1 3.56Å; K496-L512 HydrophobicContact CD-CD1 4.37Å; K496-L512 HydrophobicContact CG-CD1 3.94Å; L512-A531 HydrophobicContact CB-CB 4.29Å; L512-A531 HydrophobicContact CD2-CB 4.15Å; L512-V532 CarbonylContact C-O 3.57Å; L512-V532 WeakPolarHBondContact CA-O 3.27Å
513	L	86.3	Confident	81.5	Confident	3 Å²	3	62.6 Å²	62.6	2%	0.016	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	123.1	167.4	179.2	68.9	0	0	0	109.5	L491 R492 L493 A531 V532 F534 I569 I577	L491-L513 HydrophobicContact CB-CD1 4.27Å; R492-L513 CarbonylContact O-C 3.58Å; R492-L513 WeakPolarHBondContact O-CA 3.48Å; L493-L513 HydrophobicContact CD1-CB 4.06Å; L493-L513 HydrophobicContact CD1-CD1 4.4Å; L513-A531 CarbonylContact O-C 3.57Å; L513-A531 WeakPolarHBondContact O-CA 3.47Å; L513-V532 HydrophobicContact CB-CB 4.14Å; L513-V532 HydrophobicContact CB-CG2 4.39Å; L513-V532 PolarHBondContact N-O 3.21Å; L513-V532 PolarHBondContact O-N 3.22Å; L513-F534 HydrophobicContact CB-CE1 4.29Å; L513-I569 HydrophobicContact CD2-CD1 4.08Å; L513-I569 HydrophobicContact CD2-CG1 4.38Å; L513-I577 HydrophobicContact CD2-CD1 4.08Å; L513-I577 HydrophobicContact CD2-CG2 4.38Å
514	R	80.6	Confident	80.6	Confident	70 Å²	70	60.8 Å²	60.8	26%	0.264	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	138	174.3	-59.7	-172	-170	-80.8	-8.2	110.8	L491 R492 E494 L516 N529 A531	L491-R514 WeakPolarHBondContact CA-O 3.35Å; R492-R514 PolarHBondContact N-O 2.86Å; R492-R514 PolarHBondContact O-N 3.28Å; E494-R514 WeakPolarHBondContact OE1-CD 3.44Å; E494-R514 IonicContact OE1-NE 2.72Å; E494-R514 PolarHBondContact OE1-NE 2.98Å; E494-R514 IonicContact OE2-CZ 2.7Å; E494-R514 VanDerWaalsContact OE2-CZ 3.27Å; E494-R514 IonicContact OE2-NE 2.7Å; E494-R514 PolarHBondContact OE2-NE 2.93Å; E494-R514 IonicContact OE2-NH2 3.61Å; E494-R514 PolarHBondContact OE2-NH2 2.84Å; R514-L516 HydrophobicContact CB-CD2 4.5Å; R514-N529 PolarHBondContact NH1-O 2.86Å; R514-A531 HydrophobicContact CG-CB 3.89Å
515	V	78.9	Confident	79.7	Confident	11 Å²	11	66.2 Å²	66.2	7%	0.067	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.3	169.7	-171.8	0	0	0	0	109.1	L491 K520 R521 Y524 Q526	L491-V515 HydrophobicContact CD2-CB 4.28Å; L491-V515 HydrophobicContact CD2-CG1 4.19Å; L491-V515 HydrophobicContact CD2-CG2 3.77Å; V515-K520 HydrophobicContact CG1-CB 3.33Å; V515-R521 HydrophobicContact CB-CG 3.86Å; V515-R521 HydrophobicContact CG1-CB 4.49Å; V515-R521 HydrophobicContact CG1-CG 3.76Å; V515-R521 VanDerWaalsContact O-CD 3.3Å; V515-R521 WeakPolarHBondContact O-CD 3.32Å; V515-R521 WeakPolarHBondContact O-CG 3.33Å; V515-Y524 HydrophobicContact CG1-CD2 4.06Å; V515-Y524 HydrophobicContact CG2-CD2 3.73Å; V515-Y524 HydrophobicContact CG2-CE2 4.33Å; V515-Q526 VanDerWaalsContact CB-OE1 3.29Å
516	L	75.1	Confident	78.9	Confident	63 Å²	63	62 Å²	62	33%	0.33	29%	0.288	S	S	.	.			trans	-88.2	-41.8	-178.2	-57.9	-178.6	0	0	0	112.1	E486 G490 R492 R514 R521	E486-L516 HydrophobicContact CB-CD1 4.3Å; E486-L516 HydrophobicContact CG-CD1 4.35Å; G490-L516 PolarHBondContact O-N 3.4Å; R492-L516 HydrophobicContact CB-CD1 4.16Å; R492-L516 HydrophobicContact CB-CG 4.4Å; R514-L516 HydrophobicContact CB-CD2 4.5Å; L516-R521 PolarHBondContact O-NE 3.36Å; L516-R521 PolarHBondContact O-NH2 2.66Å
517	D	72.9	Confident	77.9	Confident	58 Å²	58	64.2 Å²	64.2	31%	0.31	29%	0.293	S	S	.	.	S	Bend	trans	-67.2	133.7	-179.7	179.7	10	0	0	0	111	G490 K519 K520 R521	G490-D517 PolarHBondContact O-N 3.06Å; D517-K519 VanDerWaalsContact C-N 3.29Å; D517-K519 PolarHBondContact O-N 2.88Å; D517-K519 PolarHBondContact OD1-N 3.11Å; D517-K520 HydrophobicContact CB-CB 4.07Å; D517-K520 HydrophobicContact CB-CG 3.95Å; D517-R521 WeakPolarHBondContact O-CB 3.05Å; D517-R521 WeakPolarHBondContact O-CG 3.48Å; D517-R521 PolarHBondContact O-N 3.27Å; D517-R521 PolarHBondContact O-NE 3.08Å
518	E	73.6	Confident	76.7	Confident	110 Å²	110	67.5 Å²	67.5	51%	0.514	31%	0.306	S	S	.	.	H	α-helix	trans	-67.6	-28.5	177.7	-158.1	-162.8	140.5	0	0	112.1	K522	E518-K522 WeakPolarHBondContact O-CD 3.28Å; E518-K522 VanDerWaalsContact O-CG 3.32Å; E518-K522 WeakPolarHBondContact O-CG 3.35Å; E518-K522 PolarHBondContact O-N 2.73Å; E518-K522 VanDerWaalsContact OE1-CE 3.24Å; E518-K522 WeakPolarHBondContact OE1-CE 3.16Å; E518-K522 IonicContact OE1-NZ 2.6Å; E518-K522 PolarHBondContact OE1-NZ 3.24Å
519	K	74.5	Confident	75.5	Confident	144 Å²	144	69 Å²	69	63%	0.626	32%	0.317	S	S	*	.	H	α-helix	trans	-68.2	-56.2	174.2	-60.6	174.8	179.8	175.8	0	110.4	D517 R521 K522 E523	D517-K519 VanDerWaalsContact C-N 3.29Å; D517-K519 PolarHBondContact O-N 2.88Å; D517-K519 PolarHBondContact OD1-N 3.11Å; K519-R521 VanDerWaalsContact C-N 3.28Å; K519-R521 PolarHBondContact O-N 3.49Å; K519-K522 WeakPolarHBondContact O-CA 3.09Å; K519-K522 WeakPolarHBondContact O-CB 3.47Å; K519-K522 PolarHBondContact O-N 2.87Å; K519-E523 PolarHBondContact O-N 3.24Å
520	K	72.3	Confident	74.8	Confident	25 Å²	25	72.6 Å²	72.6	11%	0.109	33%	0.334	C	S	.	.	H	α-helix	trans	-55	-40.9	174.7	-64.6	-85.9	-178.5	-178.2	0	111.9	I489 V515 D517 K522 E523 Y524 D573	I489-K520 WeakPolarHBondContact O-CE 3.26Å; V515-K520 HydrophobicContact CG1-CB 3.33Å; D517-K520 HydrophobicContact CB-CB 4.07Å; D517-K520 HydrophobicContact CB-CG 3.95Å; K520-K522 VanDerWaalsContact C-N 3.32Å; K520-K522 PolarHBondContact O-N 3.08Å; K520-E523 PolarHBondContact O-N 2.85Å; K520-Y524 HydrophobicContact CB-CD2 4.17Å; K520-Y524 HydrophobicContact CB-CE2 4.08Å; K520-Y524 HydrophobicContact CD-CE2 3.93Å; K520-Y524 WeakPolarHBondContact O-CB 3.13Å; K520-Y524 WeakPolarHBondContact O-CD2 3.33Å; K520-Y524 PolarHBondContact O-N 3.45Å; K520-D573 IonicContact NZ-OD1 3.17Å; K520-D573 PolarHBondContact NZ-OD1 2.79Å; K520-D573 IonicContact NZ-OD2 3.75Å; K520-D573 PolarHBondContact NZ-OD2 3.14Å
521	R	72.4	Confident	74.1	Confident	44 Å²	44	71 Å²	71	17%	0.166	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-37.9	174.2	-83.1	-176.9	-81.2	159	-15.2	113	V515 L516 D517 K519 K525 Q526 E528	V515-R521 HydrophobicContact CB-CG 3.86Å; V515-R521 HydrophobicContact CG1-CB 4.49Å; V515-R521 HydrophobicContact CG1-CG 3.76Å; V515-R521 VanDerWaalsContact O-CD 3.3Å; V515-R521 WeakPolarHBondContact O-CD 3.32Å; V515-R521 WeakPolarHBondContact O-CG 3.33Å; L516-R521 PolarHBondContact O-NE 3.36Å; L516-R521 PolarHBondContact O-NH2 2.66Å; D517-R521 WeakPolarHBondContact O-CB 3.05Å; D517-R521 WeakPolarHBondContact O-CG 3.48Å; D517-R521 PolarHBondContact O-N 3.27Å; D517-R521 PolarHBondContact O-NE 3.08Å; K519-R521 VanDerWaalsContact C-N 3.28Å; K519-R521 PolarHBondContact O-N 3.49Å; R521-K525 CarbonylContact O-C 3.57Å; R521-K525 WeakPolarHBondContact O-CA 3.38Å; R521-K525 PolarHBondContact O-N 2.94Å; R521-Q526 PolarHBondContact O-N 3.3Å; R521-E528 IonicContact CZ-OE1 2.75Å; R521-E528 IonicContact NH1-OE1 2.7Å; R521-E528 PolarHBondContact NH1-OE1 3.06Å; R521-E528 IonicContact NH2-OE1 3.27Å
522	K	70.7	Confident	73.8	Confident	139 Å²	139	72 Å²	72	60%	0.604	34%	0.338	S	S	*	.	H	α-helix	trans	-71.3	-40	175.1	-70.8	164.3	-174.8	168.7	0	112.3	E518 K519 K520 K525	E518-K522 WeakPolarHBondContact O-CD 3.28Å; E518-K522 VanDerWaalsContact O-CG 3.32Å; E518-K522 WeakPolarHBondContact O-CG 3.35Å; E518-K522 PolarHBondContact O-N 2.73Å; E518-K522 VanDerWaalsContact OE1-CE 3.24Å; E518-K522 WeakPolarHBondContact OE1-CE 3.16Å; E518-K522 IonicContact OE1-NZ 2.6Å; E518-K522 PolarHBondContact OE1-NZ 3.24Å; K519-K522 WeakPolarHBondContact O-CA 3.09Å; K519-K522 WeakPolarHBondContact O-CB 3.47Å; K519-K522 PolarHBondContact O-N 2.87Å; K520-K522 VanDerWaalsContact C-N 3.32Å; K520-K522 PolarHBondContact O-N 3.08Å; K522-K525 PolarHBondContact O-N 2.96Å
523	E	70	Confident	73.7	Confident	89 Å²	89	75.4 Å²	75.4	42%	0.416	35%	0.353	S	S	.	.	H	α-helix	trans	-62.2	-47.3	175.4	-68.7	160.3	-147	0	0	111.6	K519 K520 K525 Q570	K519-E523 PolarHBondContact O-N 3.24Å; K520-E523 PolarHBondContact O-N 2.85Å; E523-K525 VanDerWaalsContact C-N 3.28Å; E523-K525 PolarHBondContact O-N 3.28Å; E523-Q570 PolarHBondContact OE2-NE2 3.33Å
524	Y	68.7	Low	73.9	Confident	11 Å²	11	76.5 Å²	76.5	4%	0.043	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-0.9	178	-58.3	-40.4	0	0	0	114.4	L491 V515 K520 Q526 L568 I569 Q570 D573	L491-Y524 HydrophobicContact CD2-CE2 4.46Å; V515-Y524 HydrophobicContact CG1-CD2 4.06Å; V515-Y524 HydrophobicContact CG2-CD2 3.73Å; V515-Y524 HydrophobicContact CG2-CE2 4.33Å; K520-Y524 HydrophobicContact CB-CD2 4.17Å; K520-Y524 HydrophobicContact CB-CE2 4.08Å; K520-Y524 HydrophobicContact CD-CE2 3.93Å; K520-Y524 WeakPolarHBondContact O-CB 3.13Å; K520-Y524 WeakPolarHBondContact O-CD2 3.33Å; K520-Y524 PolarHBondContact O-N 3.45Å; Y524-Q526 PolarHBondContact O-N 3.47Å; Y524-L568 VanDerWaalsContact CD1-C 3.44Å; Y524-L568 WeakPolarHBondContact CD1-O 3.24Å; Y524-L568 WeakPolarHBondContact CE1-O 3.26Å; Y524-L568 VanDerWaalsContact CG-O 3.26Å; Y524-I569 VanDerWaalsContact CE1-C 3.49Å; Y524-Q570 HydrophobicContact CE1-CB 4.18Å; Y524-Q570 HydrophobicContact CE1-CG 3.46Å; Y524-Q570 VanDerWaalsContact CE1-CG 3.46Å; Y524-Q570 PolarHBondContact OH-N 2.99Å; Y524-D573 PolarHBondContact OH-OD2 2.63Å
525	K	68	Low	74.3	Confident	147 Å²	147	75.7 Å²	75.7	64%	0.639	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	20.4	-177.1	-53.6	172.2	-170.9	166.9	0	114.1	R521 K522 E523	R521-K525 CarbonylContact O-C 3.57Å; R521-K525 WeakPolarHBondContact O-CA 3.38Å; R521-K525 PolarHBondContact O-N 2.94Å; K522-K525 PolarHBondContact O-N 2.96Å; E523-K525 VanDerWaalsContact C-N 3.28Å; E523-K525 PolarHBondContact O-N 3.28Å
526	Q	66.1	Low	74.9	Confident	19 Å²	19	75.3 Å²	75.3	9%	0.089	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-82.1	136.7	-176	-175.9	169.7	68.4	0	0	110.3	V515 R521 Y524 E530	V515-Q526 VanDerWaalsContact CB-OE1 3.29Å; R521-Q526 PolarHBondContact O-N 3.3Å; Y524-Q526 PolarHBondContact O-N 3.47Å; Q526-E530 HydrophobicContact CG-CB 3.74Å; Q526-E530 HydrophobicContact CG-CG 4Å
527	K	66.2	Low	75.7	Confident	149 Å²	149	74 Å²	74	65%	0.648	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-72.3	159.3	177.8	-67	169.4	-175.8	161.7	0	111.3	N529 E530	K527-N529 PolarHBondContact O-N 3.12Å; K527-E530 HydrophobicContact CB-CB 4.08Å; K527-E530 WeakPolarHBondContact CB-OE2 3.42Å; K527-E530 PolarHBondContact N-OE2 3.08Å; K527-E530 WeakPolarHBondContact O-CB 3.47Å; K527-E530 PolarHBondContact O-N 2.79Å
528	E	64.5	Low	76.4	Confident	132 Å²	132	71.5 Å²	71.5	62%	0.617	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	132.7	171.7	-174.9	151.8	-106.8	0	0	111.2	R521 E530	R521-E528 IonicContact CZ-OE1 2.75Å; R521-E528 IonicContact NH1-OE1 2.7Å; R521-E528 PolarHBondContact NH1-OE1 3.06Å; R521-E528 IonicContact NH2-OE1 3.27Å; E528-E530 PolarHBondContact O-N 3.04Å
529	N	65.6	Low	77.1	Confident	139 Å²	139	72.1 Å²	72.1	74%	0.743	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	-2.9	-174.4	-49.9	-56.5	0	0	0	117.1	R514 K527	R514-N529 PolarHBondContact NH1-O 2.86Å; K527-N529 PolarHBondContact O-N 3.12Å
530	E	74.3	Confident	77.7	Confident	77 Å²	77	71.4 Å²	71.4	36%	0.36	35%	0.35	S	S	.	.			trans	-67.6	149	171.9	-171	165.1	-125.2	0	0	110.5	Q526 K527 E528	Q526-E530 HydrophobicContact CG-CB 3.74Å; Q526-E530 HydrophobicContact CG-CG 4Å; K527-E530 HydrophobicContact CB-CB 4.08Å; K527-E530 WeakPolarHBondContact CB-OE2 3.42Å; K527-E530 PolarHBondContact N-OE2 3.08Å; K527-E530 WeakPolarHBondContact O-CB 3.47Å; K527-E530 PolarHBondContact O-N 2.79Å; E528-E530 PolarHBondContact O-N 3.04Å
531	A	78.1	Confident	78.5	Confident	30 Å²	30	74.3 Å²	74.3	25%	0.248	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	138.9	-173.2	0	0	0	0	0	110.8	L512 L513 R514 Q533	L512-A531 HydrophobicContact CB-CB 4.29Å; L512-A531 HydrophobicContact CD2-CB 4.15Å; L513-A531 CarbonylContact O-C 3.57Å; L513-A531 WeakPolarHBondContact O-CA 3.47Å; R514-A531 HydrophobicContact CG-CB 3.89Å; A531-Q533 PolarHBondContact O-N 3.19Å
532	V	82.3	Confident	79.4	Confident	21 Å²	21	78.6 Å²	78.6	13%	0.127	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	104.4	174.6	-165.1	0	0	0	0	108.2	L512 L513 L568	L512-V532 CarbonylContact C-O 3.57Å; L512-V532 WeakPolarHBondContact CA-O 3.27Å; L513-V532 HydrophobicContact CB-CB 4.14Å; L513-V532 HydrophobicContact CB-CG2 4.39Å; L513-V532 PolarHBondContact N-O 3.21Å; L513-V532 PolarHBondContact O-N 3.22Å; V532-L568 HydrophobicContact CB-CD1 4.49Å; V532-L568 HydrophobicContact CG1-CD1 3.58Å; V532-L568 HydrophobicContact CG2-CD1 4.1Å; V532-L568 HydrophobicContact CG2-CD2 3.66Å; V532-L568 HydrophobicContact CG2-CG 4.34Å
533	Q	87.5	Confident	80.3	Confident	103 Å²	103	72.2 Å²	72.2	48%	0.481	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	127.1	170.6	-162.4	-162.2	-89.8	0	0	109.7	K496 F511 A531	K496-Q533 HydrophobicContact CD-CG 4.5Å; F511-Q533 WeakPolarHBondContact O-CA 3.14Å; A531-Q533 PolarHBondContact O-N 3.19Å
534	F	88.8	Confident	81.3	Confident	25 Å²	25	71.5 Å²	71.5	11%	0.11	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	161.4	172.4	63.6	-85.3	0	0	0	109.8	L493 Q510 F511 L513 V546 M550 L581	L493-F534 HydrophobicContact CD1-CE1 3.71Å; L493-F534 HydrophobicContact CD1-CZ 3.72Å; Q510-F534 CarbonylContact C-O 3.57Å; Q510-F534 WeakPolarHBondContact CA-O 3.45Å; F511-F534 HydrophobicContact CB-CD1 4.05Å; F511-F534 HydrophobicContact CB-CD2 4.14Å; F511-F534 HydrophobicContact CB-CE1 3.61Å; F511-F534 HydrophobicContact CB-CE2 3.71Å; F511-F534 HydrophobicContact CB-CG 4.31Å; F511-F534 HydrophobicContact CB-CZ 3.44Å; F511-F534 VanDerWaalsContact CB-CZ 3.44Å; F511-F534 HydrophobicContact CD2-CD2 4.41Å; F511-F534 AromaticContact CD2-CE2 3.77Å; F511-F534 HydrophobicContact CD2-CE2 3.77Å; F511-F534 HydrophobicContact CD2-CZ 4.17Å; F511-F534 HydrophobicContact CG-CE2 4Å; F511-F534 AromaticContact CG-CZ 3.94Å; F511-F534 HydrophobicContact CG-CZ 3.94Å; F511-F534 PolarHBondContact N-O 3.35Å; F511-F534 PolarHBondContact O-N 3.09Å; F511-F534 VanDerWaalsContact O-N 3.12Å; L513-F534 HydrophobicContact CB-CE1 4.29Å; F534-V546 HydrophobicContact CD2-CG1 4.22Å; F534-V546 HydrophobicContact CE2-CG1 4.29Å; F534-M550 HydrophobicContact CB-CE 3.99Å; F534-M550 HydrophobicContact CD1-CE 3.48Å; F534-M550 VanDerWaalsContact CD1-CE 3.48Å; F534-M550 HydrophobicContact CD2-CE 3.37Å; F534-M550 HydrophobicContact CE1-CE 3.62Å; F534-M550 HydrophobicContact CE2-CE 3.53Å; F534-M550 HydrophobicContact CG-CE 3.35Å; F534-M550 HydrophobicContact CZ-CE 3.63Å; F534-L581 HydrophobicContact CE2-CD1 4.1Å; F534-L581 HydrophobicContact CE2-CD2 4.29Å; F534-L581 HydrophobicContact CZ-CD1 4.23Å
535	S	90.1	Very high	82.3	Confident	53 Å²	53	73.7 Å²	73.7	37%	0.371	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	162.3	166.6	42.8	0	0	0	0	112	E508 V509	E508-S535 WeakPolarHBondContact OE1-CB 3.49Å; E508-S535 PolarHBondContact OE1-OG 3.5Å; V509-S535 CarbonylContact O-C 3.58Å; V509-S535 VanDerWaalsContact O-CA 3.25Å; V509-S535 WeakPolarHBondContact O-CA 3.18Å
536	F	91.5	Very high	83.2	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.018	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	130.4	179.5	-174.1	-84.3	0	0	0	110.3	E508 V509 F511 L538 E541 V546 L581 I585	E508-F536 CarbonylContact C-O 3.59Å; E508-F536 WeakPolarHBondContact CA-O 3.26Å; V509-F536 PolarHBondContact N-O 3.24Å; V509-F536 PolarHBondContact O-N 2.78Å; F511-F536 HydrophobicContact CD2-CB 3.85Å; F511-F536 HydrophobicContact CE2-CB 3.7Å; F511-F536 HydrophobicContact CE2-CG 4.23Å; F536-L538 HydrophobicContact CD1-CD2 4.45Å; F536-E541 WeakPolarHBondContact CA-OE2 3.46Å; F536-E541 HydrophobicContact CD2-CB 4.32Å; F536-E541 HydrophobicContact CE1-CB 4.29Å; F536-E541 HydrophobicContact CE2-CB 3.83Å; F536-E541 HydrophobicContact CZ-CB 3.81Å; F536-E541 WeakPolarHBondContact CZ-O 3.23Å; F536-V546 HydrophobicContact CD2-CB 4.13Å; F536-V546 HydrophobicContact CD2-CG1 4.16Å; F536-V546 HydrophobicContact CD2-CG2 3.79Å; F536-V546 HydrophobicContact CE2-CB 4.17Å; F536-V546 HydrophobicContact CE2-CG2 3.8Å; F536-L581 HydrophobicContact CD2-CD1 4.27Å; F536-L581 HydrophobicContact CD2-CD2 3.99Å; F536-L581 HydrophobicContact CD2-CG 4.45Å; F536-L581 HydrophobicContact CE2-CD2 4.06Å; F536-L581 HydrophobicContact CE2-CG 4.49Å; F536-I585 HydrophobicContact CD1-CD1 3.85Å; F536-I585 HydrophobicContact CD1-CG1 4.15Å; F536-I585 HydrophobicContact CD2-CD1 4.34Å; F536-I585 HydrophobicContact CE1-CD1 3.34Å; F536-I585 HydrophobicContact CE1-CG1 3.96Å; F536-I585 HydrophobicContact CE2-CD1 3.89Å; F536-I585 HydrophobicContact CG-CD1 4.34Å; F536-I585 HydrophobicContact CZ-CD1 3.36Å; F536-I585 HydrophobicContact CZ-CG1 4.45Å
537	D	91.1	Very high	84.2	Confident	34 Å²	34	66.6 Å²	66.6	18%	0.182	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	112	173.1	-172.3	-43.2	0	0	0	111.2	N507 L539 N540 E541	N507-D537 WeakPolarHBondContact CB-OD1 3.21Å; D537-L539 PolarHBondContact O-N 3.38Å; D537-L539 WeakPolarHBondContact OD1-CA 3.26Å; D537-L539 PolarHBondContact OD1-N 2.94Å; D537-N540 HydrophobicContact CB-CB 4.18Å; D537-N540 VanDerWaalsContact CG-ND2 3.34Å; D537-N540 PolarHBondContact O-N 3.25Å; D537-N540 PolarHBondContact OD1-N 2.77Å; D537-N540 PolarHBondContact OD1-ND2 3.28Å; D537-N540 PolarHBondContact OD2-ND2 3.18Å; D537-E541 HydrophobicContact CB-CB 4.49Å; D537-E541 HydrophobicContact CB-CG 4.1Å; D537-E541 PolarHBondContact N-OE2 3.38Å; D537-E541 PolarHBondContact O-N 3.44Å
538	L	89	Confident	85.1	Confident	6 Å²	6	64 Å²	64	3%	0.031	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-11.5	-178.9	-72.1	173	0	0	0	115.8	N507 V509 F536 I585 I588 R589	N507-L538 WeakPolarHBondContact O-CB 3.37Å; N507-L538 VanDerWaalsContact O-CG 3.29Å; N507-L538 WeakPolarHBondContact O-CG 3.3Å; N507-L538 PolarHBondContact O-N 3.11Å; V509-L538 HydrophobicContact CG2-CD1 3.55Å; V509-L538 HydrophobicContact CG2-CD2 4.32Å; V509-L538 HydrophobicContact CG2-CG 3.8Å; F536-L538 HydrophobicContact CD1-CD2 4.45Å; L538-I585 HydrophobicContact CD2-CB 4.42Å; L538-I585 HydrophobicContact CD2-CG1 4.23Å; L538-I585 HydrophobicContact CD2-CG2 3.88Å; L538-I588 HydrophobicContact CD1-CG2 4.06Å; L538-R589 PolarHBondContact O-NH2 2.7Å
539	L	87.3	Confident	85.9	Confident	123 Å²	123	64 Å²	64	64%	0.644	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.6	-43.5	176.3	-60.5	-172.2	0	0	0	113	N507 D537	N507-L539 HydrophobicContact CB-CG 4.41Å; N507-L539 VanDerWaalsContact ND2-CD1 3.31Å; N507-L539 WeakPolarHBondContact ND2-CD1 3.21Å; D537-L539 PolarHBondContact O-N 3.38Å; D537-L539 WeakPolarHBondContact OD1-CA 3.26Å; D537-L539 PolarHBondContact OD1-N 2.94Å
540	N	87.1	Confident	86.5	Confident	130 Å²	130	58.4 Å²	58.4	70%	0.695	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-24.4	-166.7	-65	-54.1	0	0	0	114.1	D537	D537-N540 HydrophobicContact CB-CB 4.18Å; D537-N540 VanDerWaalsContact CG-ND2 3.34Å; D537-N540 PolarHBondContact O-N 3.25Å; D537-N540 PolarHBondContact OD1-N 2.77Å; D537-N540 PolarHBondContact OD1-ND2 3.28Å; D537-N540 PolarHBondContact OD2-ND2 3.18Å
541	E	90	Very high	86.7	Confident	86 Å²	86	55 Å²	55	40%	0.402	28%	0.276	S	S	.	.			trans	-105.1	156.8	-172.1	-71.3	171.5	179.5	0	0	113.4	F536 D537 V546	F536-E541 WeakPolarHBondContact CA-OE2 3.46Å; F536-E541 HydrophobicContact CD2-CB 4.32Å; F536-E541 HydrophobicContact CE1-CB 4.29Å; F536-E541 HydrophobicContact CE2-CB 3.83Å; F536-E541 HydrophobicContact CZ-CB 3.81Å; F536-E541 WeakPolarHBondContact CZ-O 3.23Å; D537-E541 HydrophobicContact CB-CB 4.49Å; D537-E541 HydrophobicContact CB-CG 4.1Å; D537-E541 PolarHBondContact N-OE2 3.38Å; D537-E541 PolarHBondContact O-N 3.44Å; E541-V546 HydrophobicContact CB-CG2 4Å; E541-V546 HydrophobicContact CG-CG2 4.22Å
542	K	90.1	Very high	86.4	Confident	133 Å²	133	58.2 Å²	58.2	58%	0.578	29%	0.289	S	S	*	.			trans	-112.8	140.9	171.6	-59.2	179.5	-169	161.6	0	109.7	E544 D545 V546	K542-E544 PolarHBondContact O-N 2.96Å; K542-D545 HydrophobicContact CB-CB 4.4Å; K542-D545 WeakPolarHBondContact CD-OD2 3.33Å; K542-D545 PolarHBondContact O-N 2.92Å; K542-V546 PolarHBondContact O-N 2.92Å; K542-V546 VanDerWaalsContact O-N 3.1Å
543	A	90.4	Very high	85.4	Confident	5 Å²	5	58.6 Å²	58.6	4%	0.041	29%	0.293	C	S	.	.	H	α-helix	trans	-59.6	-37.5	179	0	0	0	0	0	112	D545 V547 V578 L581 Q582 I585	A543-D545 VanDerWaalsContact C-N 3.28Å; A543-D545 PolarHBondContact O-N 2.94Å; A543-V547 WeakPolarHBondContact O-CB 3.47Å; A543-V547 VanDerWaalsContact O-CG2 3.26Å; A543-V547 WeakPolarHBondContact O-CG2 3.4Å; A543-V547 PolarHBondContact O-N 2.84Å; A543-V547 VanDerWaalsContact O-N 3.08Å; A543-V578 HydrophobicContact CB-CG1 4.37Å; A543-L581 HydrophobicContact CB-CB 4.14Å; A543-L581 HydrophobicContact CB-CD2 3.83Å; A543-L581 HydrophobicContact CB-CG 3.83Å; A543-Q582 HydrophobicContact CB-CG 3.57Å; A543-I585 HydrophobicContact CB-CD1 4.36Å
544	E	90.2	Very high	83.7	Confident	74 Å²	74	61.7 Å²	61.7	35%	0.346	30%	0.3	S	S	.	.	H	α-helix	trans	-56.5	-39.9	173.6	-70.8	83.5	165.5	0	0	112.7	K542 R548 Y574 V578 Q582	K542-E544 PolarHBondContact O-N 2.96Å; E544-R548 VanDerWaalsContact C-NH2 3.25Å; E544-R548 VanDerWaalsContact O-CB 3.28Å; E544-R548 WeakPolarHBondContact O-CB 3.39Å; E544-R548 PolarHBondContact O-N 2.83Å; E544-R548 PolarHBondContact O-NH2 2.94Å; E544-Y574 PolarHBondContact O-OH 2.91Å; E544-V578 HydrophobicContact CG-CG1 3.96Å; E544-Q582 PolarHBondContact OE1-NE2 3.28Å; E544-Q582 PolarHBondContact OE2-NE2 2.97Å
545	D	89.7	Confident	81.5	Confident	57 Å²	57	65.8 Å²	65.8	31%	0.305	33%	0.332	S	S	.	.	H	α-helix	trans	-82.9	-46.3	-173	-62.1	-31	0	0	0	110.2	K542 A543 V547 R548 E549	K542-D545 HydrophobicContact CB-CB 4.4Å; K542-D545 WeakPolarHBondContact CD-OD2 3.33Å; K542-D545 PolarHBondContact O-N 2.92Å; A543-D545 VanDerWaalsContact C-N 3.28Å; A543-D545 PolarHBondContact O-N 2.94Å; D545-V547 PolarHBondContact O-N 3.28Å; D545-R548 CarbonylContact O-C 3.49Å; D545-R548 WeakPolarHBondContact O-CA 3.32Å; D545-R548 WeakPolarHBondContact O-CB 3.22Å; D545-R548 PolarHBondContact O-N 3.47Å; D545-R548 IonicContact OD1-CZ 3.36Å; D545-R548 IonicContact OD1-NH1 2.68Å; D545-R548 PolarHBondContact OD1-NH1 3.16Å; D545-R548 IonicContact OD1-NH2 3.69Å; D545-R548 PolarHBondContact OD1-NH2 3.45Å; D545-E549 PolarHBondContact O-N 2.96Å
546	V	87.1	Confident	79	Confident	17 Å²	17	66.5 Å²	66.5	10%	0.103	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-41.9	176.5	170.7	0	0	0	0	112.2	F534 F536 E541 K542 R548 E549 M550 L581	F534-V546 HydrophobicContact CD2-CG1 4.22Å; F534-V546 HydrophobicContact CE2-CG1 4.29Å; F536-V546 HydrophobicContact CD2-CB 4.13Å; F536-V546 HydrophobicContact CD2-CG1 4.16Å; F536-V546 HydrophobicContact CD2-CG2 3.79Å; F536-V546 HydrophobicContact CE2-CB 4.17Å; F536-V546 HydrophobicContact CE2-CG2 3.8Å; E541-V546 HydrophobicContact CB-CG2 4Å; E541-V546 HydrophobicContact CG-CG2 4.22Å; K542-V546 PolarHBondContact O-N 2.92Å; K542-V546 VanDerWaalsContact O-N 3.1Å; V546-R548 VanDerWaalsContact C-N 3.33Å; V546-E549 PolarHBondContact O-N 2.85Å; V546-M550 HydrophobicContact CG1-CE 3.71Å; V546-M550 WeakPolarHBondContact O-CG 3.49Å; V546-M550 PolarHBondContact O-N 3.4Å; V546-M550 VanDerWaalsContact O-N 3.16Å; V546-L581 HydrophobicContact CG1-CD2 4.37Å
547	V	86.4	Confident	76.8	Confident	0 Å²	0	74 Å²	74	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-71.8	-29.2	175.6	179.4	0	0	0	0	111.6	A543 D545 M550 V551 Y574 I577 V578 L581	A543-V547 WeakPolarHBondContact O-CB 3.47Å; A543-V547 VanDerWaalsContact O-CG2 3.26Å; A543-V547 WeakPolarHBondContact O-CG2 3.4Å; A543-V547 PolarHBondContact O-N 2.84Å; A543-V547 VanDerWaalsContact O-N 3.08Å; D545-V547 PolarHBondContact O-N 3.28Å; V547-M550 HydrophobicContact CG2-SD 4.48Å; V547-M550 PolarHBondContact O-N 3.33Å; V547-V551 WeakPolarHBondContact O-CG2 3.09Å; V547-V551 PolarHBondContact O-N 3.41Å; V547-Y574 HydrophobicContact CB-CD2 4.44Å; V547-Y574 HydrophobicContact CB-CE2 4.38Å; V547-Y574 HydrophobicContact CG1-CD2 3.79Å; V547-Y574 HydrophobicContact CG1-CE2 4.22Å; V547-I577 HydrophobicContact CG1-CB 3.93Å; V547-I577 HydrophobicContact CG1-CG2 3.88Å; V547-I577 HydrophobicContact CG2-CB 4.47Å; V547-I577 HydrophobicContact CG2-CG2 3.78Å; V547-V578 HydrophobicContact CB-CG2 3.73Å; V547-V578 HydrophobicContact CG1-CG2 3.95Å; V547-V578 HydrophobicContact CG2-CG2 4.07Å; V547-L581 HydrophobicContact CG2-CD2 3.83Å
548	R	85.3	Confident	74.8	Confident	95 Å²	95	81.3 Å²	81.3	36%	0.358	40%	0.402	S	S	.	.	H	α-helix	trans	-69.1	-34.8	173.1	-158.5	-178.6	-47.7	111.2	22.9	111.6	E544 D545 V546 V551 N552 Y574	E544-R548 VanDerWaalsContact C-NH2 3.25Å; E544-R548 VanDerWaalsContact O-CB 3.28Å; E544-R548 WeakPolarHBondContact O-CB 3.39Å; E544-R548 PolarHBondContact O-N 2.83Å; E544-R548 PolarHBondContact O-NH2 2.94Å; D545-R548 CarbonylContact O-C 3.49Å; D545-R548 WeakPolarHBondContact O-CA 3.32Å; D545-R548 WeakPolarHBondContact O-CB 3.22Å; D545-R548 PolarHBondContact O-N 3.47Å; D545-R548 IonicContact OD1-CZ 3.36Å; D545-R548 IonicContact OD1-NH1 2.68Å; D545-R548 PolarHBondContact OD1-NH1 3.16Å; D545-R548 IonicContact OD1-NH2 3.69Å; D545-R548 PolarHBondContact OD1-NH2 3.45Å; V546-R548 VanDerWaalsContact C-N 3.33Å; R548-V551 PolarHBondContact O-N 3Å; R548-N552 WeakPolarHBondContact O-CB 3.26Å; R548-N552 VanDerWaalsContact O-CG 3.28Å; R548-N552 PolarHBondContact O-N 3.42Å; R548-Y574 HydrophobicContact CB-CE2 3.89Å; R548-Y574 HydrophobicContact CG-CE2 4.32Å; R548-Y574 PolarHBondContact NH2-OH 2.88Å
549	E	82	Confident	72.7	Confident	131 Å²	131	88.7 Å²	88.7	61%	0.612	43%	0.43	S	S	*	.	H	α-helix	trans	-66.1	-38.8	172.4	-70.3	-167.7	175	0	0	112.2	D545 V546 V551 N552 S553	D545-E549 PolarHBondContact O-N 2.96Å; V546-E549 PolarHBondContact O-N 2.85Å; E549-V551 VanDerWaalsContact C-N 3.29Å; E549-V551 PolarHBondContact O-N 3.32Å; E549-N552 PolarHBondContact O-N 2.94Å; E549-S553 WeakPolarHBondContact O-CB 3.35Å; E549-S553 PolarHBondContact O-N 3.18Å
550	M	79.4	Confident	70.4	Confident	22 Å²	22	90.1 Å²	90.1	11%	0.108	43%	0.433	C	S	.	.	H	α-helix	trans	-59.8	-39.5	173.6	-63.5	169.4	-172.4	0	0	112.3	F534 V546 V547 S553 I569	F534-M550 HydrophobicContact CB-CE 3.99Å; F534-M550 HydrophobicContact CD1-CE 3.48Å; F534-M550 VanDerWaalsContact CD1-CE 3.48Å; F534-M550 HydrophobicContact CD2-CE 3.37Å; F534-M550 HydrophobicContact CE1-CE 3.62Å; F534-M550 HydrophobicContact CE2-CE 3.53Å; F534-M550 HydrophobicContact CG-CE 3.35Å; F534-M550 HydrophobicContact CZ-CE 3.63Å; V546-M550 HydrophobicContact CG1-CE 3.71Å; V546-M550 WeakPolarHBondContact O-CG 3.49Å; V546-M550 PolarHBondContact O-N 3.4Å; V546-M550 VanDerWaalsContact O-N 3.16Å; V547-M550 HydrophobicContact CG2-SD 4.48Å; V547-M550 PolarHBondContact O-N 3.33Å; M550-S553 PolarHBondContact O-OG 2.91Å; M550-I569 HydrophobicContact CB-CD1 3.67Å; M550-I569 HydrophobicContact CG-CD1 4.36Å; M550-I569 HydrophobicContact SD-CD1 3.83Å
551	V	77.2	Confident	68.6	Low	7 Å²	7	91.8 Å²	91.8	4%	0.042	44%	0.442	C	S	.	.	H	α-helix	trans	-73.1	-46	175.8	173.5	0	0	0	0	111.8	V547 R548 E549 S553 I569 D571 Y574	V547-V551 WeakPolarHBondContact O-CG2 3.09Å; V547-V551 PolarHBondContact O-N 3.41Å; R548-V551 PolarHBondContact O-N 3Å; E549-V551 VanDerWaalsContact C-N 3.29Å; E549-V551 PolarHBondContact O-N 3.32Å; V551-S553 PolarHBondContact O-N 3.29Å; V551-I569 HydrophobicContact CG2-CB 3.95Å; V551-I569 HydrophobicContact CG2-CG2 3.61Å; V551-D571 WeakPolarHBondContact CG1-OD1 3.37Å; V551-Y574 HydrophobicContact CG2-CD2 4.38Å
552	N	72	Confident	66.3	Low	97 Å²	97	91.3 Å²	91.3	52%	0.519	45%	0.445	S	S	.	.	H	α-helix	trans	-76.5	-5.7	-178.7	-71.8	-4.6	0	0	0	114	R548 E549 R554 S555	R548-N552 WeakPolarHBondContact O-CB 3.26Å; R548-N552 VanDerWaalsContact O-CG 3.28Å; R548-N552 PolarHBondContact O-N 3.42Å; E549-N552 PolarHBondContact O-N 2.94Å; N552-R554 PolarHBondContact O-N 2.96Å; N552-S555 PolarHBondContact O-N 2.89Å; N552-S555 VanDerWaalsContact O-N 3.07Å
553	S	62	Low	64	Low	28 Å²	28	90 Å²	90	20%	0.196	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-16.3	173.9	67.3	0	0	0	0	113.6	E549 M550 V551 S555	E549-S553 WeakPolarHBondContact O-CB 3.35Å; E549-S553 PolarHBondContact O-N 3.18Å; M550-S553 PolarHBondContact O-OG 2.91Å; V551-S553 PolarHBondContact O-N 3.29Å; S553-S555 PolarHBondContact O-N 3.43Å
554	R	50.7	Low	61.4	Low	168 Å²	168	97.1 Å²	97.1	63%	0.634	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.3	-19.1	163	-80.1	178.7	165.1	157.6	-1.9	116.4	N552 D571	N552-R554 PolarHBondContact O-N 2.96Å; R554-D571 IonicContact NH1-OD2 3.45Å; R554-D571 PolarHBondContact NH1-OD2 3.39Å
555	S	43.3	Very low	59.2	Low	111 Å²	111	96.8 Å²	96.8	78%	0.776	50%	0.496	S	S	*	.	S	Bend	trans	-144.9	2.2	-171.6	-62.2	0	0	0	0	118.9	N552 S553	N552-S555 PolarHBondContact O-N 2.89Å; N552-S555 VanDerWaalsContact O-N 3.07Å; S553-S555 PolarHBondContact O-N 3.43Å
556	S	37.7	Very low	57.2	Low	69 Å²	69	96.3 Å²	96.3	48%	0.483	50%	0.5	S	S	.	.			trans	-94	119.2	178.1	-172.6	0	0	0	0	112.9	F558	S556-F558 PolarHBondContact O-N 3.45Å; S556-F558 VanDerWaalsContact O-N 3.16Å; S556-F558 PolarHBondContact OG-N 3.04Å
557	Q	44.5	Very low	55.5	Low	160 Å²	160	101.1 Å²	101.1	75%	0.748	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-69.1	-3.1	175.4	-70.7	178.9	-18.1	0	0	113.9	W559 H560	Q557-W559 PolarHBondContact O-N 2.94Å; Q557-H560 PolarHBondContact O-CD2 3.33Å
558	F	50.4	Low	54.2	Low	189 Å²	189	102.2 Å²	102.2	83%	0.829	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-70.5	-16.9	-174.6	-133.9	-103	0	0	0	114.4	S556 H560	S556-F558 PolarHBondContact O-N 3.45Å; S556-F558 VanDerWaalsContact O-N 3.16Å; S556-F558 PolarHBondContact OG-N 3.04Å; F558-H560 PolarHBondContact O-N 3.09Å
559	W	43.3	Very low	53.4	Low	160 Å²	160	98.2 Å²	98.2	61%	0.606	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-97.5	27.7	-171.6	-70.1	109.1	0	0	0	115.3	Q557 N561 V562	Q557-W559 PolarHBondContact O-N 2.94Å; W559-N561 PolarHBondContact O-N 3.48Å; W559-V562 HydrophobicContact CE3-CG2 3.58Å; W559-V562 HydrophobicContact CZ3-CG2 4.06Å; W559-V562 PolarHBondContact O-N 2.51Å
560	H	40.6	Very low	52.8	Low	153 Å²	153	95.1 Å²	95.1	71%	0.708	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-13.2	-171.2	-89.1	-55.1	0	0	0	117.2	Q557 F558	Q557-H560 PolarHBondContact O-CD2 3.33Å; F558-H560 PolarHBondContact O-N 3.09Å
561	N	47.7	Very low	52.4	Low	166 Å²	166	98.8 Å²	98.8	89%	0.888	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.2	7.9	-180	-75.1	-23.5	0	0	0	114.9	W559	W559-N561 PolarHBondContact O-N 3.48Å
562	V	43	Very low	52.3	Low	75 Å²	75	105.7 Å²	105.7	46%	0.455	55%	0.55	S	S	.	.	S	Bend	trans	-93.2	129.8	173.7	177.1	0	0	0	0	110	W559 V564	W559-V562 HydrophobicContact CE3-CG2 3.58Å; W559-V562 HydrophobicContact CZ3-CG2 4.06Å; W559-V562 PolarHBondContact O-N 2.51Å; V562-V564 PolarHBondContact O-N 2.87Å
563	P	41.1	Very low	52.7	Low	106 Å²	106	101.2 Å²	101.2	69%	0.688	53%	0.526	S	S	*	.			trans	-55.2	132.1	176.6	-27.3	35.7	0	0	0	112.4	T565	P563-T565 WeakPolarHBondContact O-CB 3.47Å; P563-T565 WeakPolarHBondContact O-CG2 3.44Å; P563-T565 PolarHBondContact O-N 2.84Å; P563-T565 PolarHBondContact O-OG1 3.43Å
564	V	35.8	Very low	53.8	Low	155 Å²	155	102.6 Å²	102.6	94%	0.939	53%	0.527	S	S	*	.	S	Bend	trans	-45	94	-171	-175.3	0	0	0	0	112.9	V562	V562-V564 PolarHBondContact O-N 2.87Å
565	T	45.2	Very low	55.3	Low	67 Å²	67	104.6 Å²	104.6	41%	0.411	54%	0.535	S	S	.	.			trans	-131.4	-23.2	-179.9	39.3	0	0	0	0	113.1	P563 Q567 L568	P563-T565 WeakPolarHBondContact O-CB 3.47Å; P563-T565 WeakPolarHBondContact O-CG2 3.44Å; P563-T565 PolarHBondContact O-N 2.84Å; P563-T565 PolarHBondContact O-OG1 3.43Å; T565-Q567 VanDerWaalsContact C-N 3.28Å; T565-Q567 PolarHBondContact O-N 2.9Å; T565-L568 WeakPolarHBondContact O-CD2 3.4Å; T565-L568 WeakPolarHBondContact O-CG 3.38Å
566	A	46	Very low	57.2	Low	47 Å²	47	100.9 Å²	100.9	39%	0.388	51%	0.507	S	S	.	.			trans	-65	60.6	-172.6	0	0	0	0	0	116.9
567	Q	52	Low	59.4	Low	117 Å²	117	97.7 Å²	97.7	55%	0.547	49%	0.485	S	S	.	.			trans	-136.9	40.1	167.6	-64	-169.4	-9.3	0	0	110.3	T565	T565-Q567 VanDerWaalsContact C-N 3.28Å; T565-Q567 PolarHBondContact O-N 2.9Å
568	L	59.4	Low	61.5	Low	24 Å²	24	90.6 Å²	90.6	13%	0.126	45%	0.452	C	S	.	.			trans	-91.6	-25.8	-146.8	-71	167.6	0	0	0	117.9	Y524 V532 T565	Y524-L568 VanDerWaalsContact CD1-C 3.44Å; Y524-L568 WeakPolarHBondContact CD1-O 3.24Å; Y524-L568 WeakPolarHBondContact CE1-O 3.26Å; Y524-L568 VanDerWaalsContact CG-O 3.26Å; V532-L568 HydrophobicContact CB-CD1 4.49Å; V532-L568 HydrophobicContact CG1-CD1 3.58Å; V532-L568 HydrophobicContact CG2-CD1 4.1Å; V532-L568 HydrophobicContact CG2-CD2 3.66Å; V532-L568 HydrophobicContact CG2-CG 4.34Å; T565-L568 WeakPolarHBondContact O-CD2 3.4Å; T565-L568 WeakPolarHBondContact O-CG 3.38Å
569	I	67.9	Low	63.2	Low	11 Å²	11	87.4 Å²	87.4	6%	0.056	44%	0.438	C	S	.	.			trans	-143.5	137.5	-166.4	-64.5	172.1	0	0	0	109.5	L513 Y524 M550 V551 D573 I577	L513-I569 HydrophobicContact CD2-CD1 4.08Å; L513-I569 HydrophobicContact CD2-CG1 4.38Å; Y524-I569 VanDerWaalsContact CE1-C 3.49Å; M550-I569 HydrophobicContact CB-CD1 3.67Å; M550-I569 HydrophobicContact CG-CD1 4.36Å; M550-I569 HydrophobicContact SD-CD1 3.83Å; V551-I569 HydrophobicContact CG2-CB 3.95Å; V551-I569 HydrophobicContact CG2-CG2 3.61Å; I569-D573 HydrophobicContact CG2-CB 4.26Å; I569-I577 HydrophobicContact CB-CD1 4.3Å; I569-I577 HydrophobicContact CD1-CD1 3.54Å; I569-I577 HydrophobicContact CD1-CG2 4.43Å; I569-I577 HydrophobicContact CG1-CD1 3.7Å; I569-I577 HydrophobicContact CG2-CD1 3.6Å
570	Q	70	Confident	65.2	Low	65 Å²	65	80 Å²	80	30%	0.304	41%	0.411	S	S	.	.			trans	-86.8	147.4	171.5	-61.2	-138.9	56.1	0	0	109.7	E523 Y524 E572 D573 Y574	E523-Q570 PolarHBondContact OE2-NE2 3.33Å; Y524-Q570 HydrophobicContact CE1-CB 4.18Å; Y524-Q570 HydrophobicContact CE1-CG 3.46Å; Y524-Q570 VanDerWaalsContact CE1-CG 3.46Å; Y524-Q570 PolarHBondContact OH-N 2.99Å; Q570-E572 PolarHBondContact O-N 3.07Å; Q570-E572 VanDerWaalsContact O-N 3.08Å; Q570-D573 PolarHBondContact O-N 2.94Å; Q570-Y574 PolarHBondContact O-N 3.32Å
571	D	71.3	Confident	67.4	Low	100 Å²	100	72.8 Å²	72.8	54%	0.535	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-27.7	177.3	-60.7	-80.2	0	0	0	112.9	V551 R554 D573 Y574	V551-D571 WeakPolarHBondContact CG1-OD1 3.37Å; R554-D571 IonicContact NH1-OD2 3.45Å; R554-D571 PolarHBondContact NH1-OD2 3.39Å; D571-D573 VanDerWaalsContact C-N 3.34Å; D571-D573 PolarHBondContact O-N 3.01Å; D571-Y574 WeakPolarHBondContact O-CB 3.23Å; D571-Y574 PolarHBondContact O-N 3.42Å
572	E	75.2	Confident	69.4	Low	151 Å²	151	68.5 Å²	68.5	71%	0.706	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-37.1	173.5	-57.9	-175.4	171.9	0	0	113.1	Q570	Q570-E572 PolarHBondContact O-N 3.07Å; Q570-E572 VanDerWaalsContact O-N 3.08Å
573	D	79.6	Confident	71.5	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.021	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-15.7	-175.2	-71.4	-0.7	0	0	0	112.6	I489 L491 K520 Y524 I569 Q570 D571 R575 T576 I577	I489-D573 HydrophobicContact CG2-CB 4.24Å; I489-D573 WeakPolarHBondContact CG2-OD1 3.41Å; I489-D573 VanDerWaalsContact CG2-OD2 3.29Å; I489-D573 WeakPolarHBondContact CG2-OD2 3.49Å; L491-D573 HydrophobicContact CD1-CB 4.23Å; K520-D573 IonicContact NZ-OD1 3.17Å; K520-D573 PolarHBondContact NZ-OD1 2.79Å; K520-D573 IonicContact NZ-OD2 3.75Å; K520-D573 PolarHBondContact NZ-OD2 3.14Å; Y524-D573 PolarHBondContact OH-OD2 2.63Å; I569-D573 HydrophobicContact CG2-CB 4.26Å; Q570-D573 PolarHBondContact O-N 2.94Å; D571-D573 VanDerWaalsContact C-N 3.34Å; D571-D573 PolarHBondContact O-N 3.01Å; D573-R575 VanDerWaalsContact C-N 3.33Å; D573-R575 PolarHBondContact O-N 2.79Å; D573-T576 PolarHBondContact O-N 2.7Å; D573-I577 HydrophobicContact CB-CD1 4.05Å; D573-I577 HydrophobicContact CB-CG1 4.49Å; D573-I577 PolarHBondContact O-N 3.3Å
574	Y	84.1	Confident	73.7	Confident	57 Å²	57	62.1 Å²	62.1	22%	0.224	31%	0.309	C	S	.	.	H	α-helix	trans	-45.3	-52.6	-178.2	171.7	-94.5	0	0	0	112.6	E544 V547 R548 V551 Q570 D571 T576 I577 V578	E544-Y574 PolarHBondContact O-OH 2.91Å; V547-Y574 HydrophobicContact CB-CD2 4.44Å; V547-Y574 HydrophobicContact CB-CE2 4.38Å; V547-Y574 HydrophobicContact CG1-CD2 3.79Å; V547-Y574 HydrophobicContact CG1-CE2 4.22Å; R548-Y574 HydrophobicContact CB-CE2 3.89Å; R548-Y574 HydrophobicContact CG-CE2 4.32Å; R548-Y574 PolarHBondContact NH2-OH 2.88Å; V551-Y574 HydrophobicContact CG2-CD2 4.38Å; Q570-Y574 PolarHBondContact O-N 3.32Å; D571-Y574 WeakPolarHBondContact O-CB 3.23Å; D571-Y574 PolarHBondContact O-N 3.42Å; Y574-T576 VanDerWaalsContact C-N 3.27Å; Y574-T576 PolarHBondContact O-N 2.98Å; Y574-I577 PolarHBondContact O-N 3.18Å; Y574-V578 HydrophobicContact CD1-CG2 4.34Å; Y574-V578 HydrophobicContact CD2-CG2 4.28Å; Y574-V578 HydrophobicContact CE1-CG2 4.03Å; Y574-V578 HydrophobicContact CE2-CG2 3.95Å; Y574-V578 HydrophobicContact CG-CG2 4.47Å; Y574-V578 WeakPolarHBondContact O-CB 3.18Å; Y574-V578 VanDerWaalsContact O-CG2 3.31Å; Y574-V578 WeakPolarHBondContact O-CG2 3.36Å; Y574-V578 PolarHBondContact O-N 2.71Å
575	R	83.8	Confident	76.3	Confident	210 Å²	210	55.4 Å²	55.4	79%	0.792	27%	0.268	S	S	*	.	H	α-helix	trans	-61.9	-34.9	-177.3	-63.8	-174.5	-176.8	-133.6	1.6	112.6	D573 K579	D573-R575 VanDerWaalsContact C-N 3.33Å; D573-R575 PolarHBondContact O-N 2.79Å; R575-K579 WeakPolarHBondContact O-CB 3.42Å; R575-K579 PolarHBondContact O-N 3.4Å
576	T	82.1	Confident	78.3	Confident	33 Å²	33	54 Å²	54	20%	0.202	27%	0.267	C	S	.	.	H	α-helix	trans	-75.6	-42.1	178.4	-65.8	0	0	0	0	111.2	I489 D573 Y574 K579 L580	I489-T576 HydrophobicContact CB-CG2 4.33Å; I489-T576 HydrophobicContact CD1-CG2 3.95Å; I489-T576 WeakPolarHBondContact CD1-OG1 3.3Å; I489-T576 HydrophobicContact CG1-CG2 4.11Å; D573-T576 PolarHBondContact O-N 2.7Å; Y574-T576 VanDerWaalsContact C-N 3.27Å; Y574-T576 PolarHBondContact O-N 2.98Å; T576-K579 PolarHBondContact O-N 2.69Å; T576-L580 HydrophobicContact CG2-CD1 3.95Å; T576-L580 HydrophobicContact CG2-CG 4.2Å; T576-L580 WeakPolarHBondContact O-CB 3.16Å; T576-L580 VanDerWaalsContact O-CG 3.24Å; T576-L580 WeakPolarHBondContact O-CG 3.48Å; T576-L580 PolarHBondContact O-N 2.98Å
577	I	84.6	Confident	80.1	Confident	1 Å²	1	52.4 Å²	52.4	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-69.8	-39.2	-179.7	-59.9	171.4	0	0	0	111	L491 L513 V547 I569 D573 Y574 K579 L580 L581	L491-I577 HydrophobicContact CD1-CD1 3.64Å; L491-I577 HydrophobicContact CD1-CG1 3.57Å; L513-I577 HydrophobicContact CD2-CD1 4.08Å; L513-I577 HydrophobicContact CD2-CG2 4.38Å; V547-I577 HydrophobicContact CG1-CB 3.93Å; V547-I577 HydrophobicContact CG1-CG2 3.88Å; V547-I577 HydrophobicContact CG2-CB 4.47Å; V547-I577 HydrophobicContact CG2-CG2 3.78Å; I569-I577 HydrophobicContact CB-CD1 4.3Å; I569-I577 HydrophobicContact CD1-CD1 3.54Å; I569-I577 HydrophobicContact CD1-CG2 4.43Å; I569-I577 HydrophobicContact CG1-CD1 3.7Å; I569-I577 HydrophobicContact CG2-CD1 3.6Å; D573-I577 HydrophobicContact CB-CD1 4.05Å; D573-I577 HydrophobicContact CB-CG1 4.49Å; D573-I577 PolarHBondContact O-N 3.3Å; Y574-I577 PolarHBondContact O-N 3.18Å; I577-K579 VanDerWaalsContact C-N 3.3Å; I577-K579 PolarHBondContact O-N 2.94Å; I577-L580 PolarHBondContact O-N 2.8Å; I577-L581 WeakPolarHBondContact O-CB 3.43Å; I577-L581 PolarHBondContact O-N 3.44Å
578	V	88.1	Confident	81.9	Confident	11 Å²	11	47 Å²	47	7%	0.067	23%	0.226	C	C	.	.	H	α-helix	trans	-53.7	-49.7	168.6	168.6	0	0	0	0	110.3	A543 E544 V547 Y574 L581 Q582	A543-V578 HydrophobicContact CB-CG1 4.37Å; E544-V578 HydrophobicContact CG-CG1 3.96Å; V547-V578 HydrophobicContact CB-CG2 3.73Å; V547-V578 HydrophobicContact CG1-CG2 3.95Å; V547-V578 HydrophobicContact CG2-CG2 4.07Å; Y574-V578 HydrophobicContact CD1-CG2 4.34Å; Y574-V578 HydrophobicContact CD2-CG2 4.28Å; Y574-V578 HydrophobicContact CE1-CG2 4.03Å; Y574-V578 HydrophobicContact CE2-CG2 3.95Å; Y574-V578 HydrophobicContact CG-CG2 4.47Å; Y574-V578 WeakPolarHBondContact O-CB 3.18Å; Y574-V578 VanDerWaalsContact O-CG2 3.31Å; Y574-V578 WeakPolarHBondContact O-CG2 3.36Å; Y574-V578 PolarHBondContact O-N 2.71Å; V578-L581 PolarHBondContact O-N 2.85Å; V578-Q582 HydrophobicContact CG1-CG 4.4Å; V578-Q582 VanDerWaalsContact O-CG 3.31Å; V578-Q582 WeakPolarHBondContact O-CG 3.48Å; V578-Q582 PolarHBondContact O-N 2.74Å
579	K	85.9	Confident	83.3	Confident	122 Å²	122	52.3 Å²	52.3	53%	0.53	25%	0.245	S	C	.	.	H	α-helix	trans	-63.7	-45.9	179.1	-179.2	170.9	179.9	174.4	0	113	R575 T576 I577 L581 Q582 D583	R575-K579 WeakPolarHBondContact O-CB 3.42Å; R575-K579 PolarHBondContact O-N 3.4Å; T576-K579 PolarHBondContact O-N 2.69Å; I577-K579 VanDerWaalsContact C-N 3.3Å; I577-K579 PolarHBondContact O-N 2.94Å; K579-L581 PolarHBondContact O-N 2.84Å; K579-Q582 PolarHBondContact O-N 2.85Å; K579-D583 WeakPolarHBondContact CE-OD2 3.43Å; K579-D583 WeakPolarHBondContact CG-OD2 3.5Å; K579-D583 VanDerWaalsContact O-CB 3.31Å; K579-D583 WeakPolarHBondContact O-CB 3.4Å; K579-D583 PolarHBondContact O-N 3.47Å
580	L	84.7	Confident	84.2	Confident	6 Å²	6	55.3 Å²	55.3	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-56.4	-40.7	176.7	-71	169.4	0	0	0	111	M484 L491 L493 T576 I577 K584	M484-L580 HydrophobicContact CE-CD2 3.28Å; L491-L580 HydrophobicContact CB-CD1 4.3Å; L493-L580 HydrophobicContact CB-CB 4.31Å; L493-L580 HydrophobicContact CD2-CB 4.23Å; T576-L580 HydrophobicContact CG2-CD1 3.95Å; T576-L580 HydrophobicContact CG2-CG 4.2Å; T576-L580 WeakPolarHBondContact O-CB 3.16Å; T576-L580 VanDerWaalsContact O-CG 3.24Å; T576-L580 WeakPolarHBondContact O-CG 3.48Å; T576-L580 PolarHBondContact O-N 2.98Å; I577-L580 PolarHBondContact O-N 2.8Å; L580-K584 WeakPolarHBondContact O-CB 3.3Å; L580-K584 VanDerWaalsContact O-CG 3.26Å; L580-K584 WeakPolarHBondContact O-CG 3.35Å; L580-K584 PolarHBondContact O-N 2.93Å; L580-K584 VanDerWaalsContact O-N 3.08Å
581	L	88.3	Confident	85	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.8	-46.1	177.4	-178.2	55.8	0	0	0	111.9	L493 F511 F534 F536 A543 V546 V547 I577 V578 K579 K584 I585	L493-L581 HydrophobicContact CD2-CB 3.94Å; L493-L581 HydrophobicContact CD2-CD1 4.09Å; F511-L581 HydrophobicContact CD2-CD1 3.95Å; F511-L581 HydrophobicContact CE1-CD1 4.25Å; F511-L581 HydrophobicContact CE2-CD1 3.6Å; F511-L581 HydrophobicContact CG-CD1 4.41Å; F511-L581 HydrophobicContact CZ-CD1 3.76Å; F534-L581 HydrophobicContact CE2-CD1 4.1Å; F534-L581 HydrophobicContact CE2-CD2 4.29Å; F534-L581 HydrophobicContact CZ-CD1 4.23Å; F536-L581 HydrophobicContact CD2-CD1 4.27Å; F536-L581 HydrophobicContact CD2-CD2 3.99Å; F536-L581 HydrophobicContact CD2-CG 4.45Å; F536-L581 HydrophobicContact CE2-CD2 4.06Å; F536-L581 HydrophobicContact CE2-CG 4.49Å; A543-L581 HydrophobicContact CB-CB 4.14Å; A543-L581 HydrophobicContact CB-CD2 3.83Å; A543-L581 HydrophobicContact CB-CG 3.83Å; V546-L581 HydrophobicContact CG1-CD2 4.37Å; V547-L581 HydrophobicContact CG2-CD2 3.83Å; I577-L581 WeakPolarHBondContact O-CB 3.43Å; I577-L581 PolarHBondContact O-N 3.44Å; V578-L581 PolarHBondContact O-N 2.85Å; K579-L581 PolarHBondContact O-N 2.84Å; L581-K584 PolarHBondContact O-N 2.82Å; L581-I585 HydrophobicContact CD1-CD1 3.85Å; L581-I585 HydrophobicContact CD1-CG1 4.18Å; L581-I585 HydrophobicContact CG-CD1 3.76Å; L581-I585 WeakPolarHBondContact O-CB 3.43Å; L581-I585 WeakPolarHBondContact O-CD1 3.48Å; L581-I585 WeakPolarHBondContact O-CG1 3.28Å; L581-I585 PolarHBondContact O-N 2.65Å
582	Q	89.9	Confident	85.8	Confident	77 Å²	77	49 Å²	49	36%	0.36	22%	0.224	S	C	.	.	H	α-helix	trans	-58	-49.3	173.9	-72.2	173.4	-17.1	0	0	112.4	A543 E544 V578 K579 K584 I585 G586	A543-Q582 HydrophobicContact CB-CG 3.57Å; E544-Q582 PolarHBondContact OE1-NE2 3.28Å; E544-Q582 PolarHBondContact OE2-NE2 2.97Å; V578-Q582 HydrophobicContact CG1-CG 4.4Å; V578-Q582 VanDerWaalsContact O-CG 3.31Å; V578-Q582 WeakPolarHBondContact O-CG 3.48Å; V578-Q582 PolarHBondContact O-N 2.74Å; K579-Q582 PolarHBondContact O-N 2.85Å; Q582-K584 VanDerWaalsContact C-N 3.3Å; Q582-K584 PolarHBondContact O-N 2.9Å; Q582-I585 PolarHBondContact O-N 2.99Å; Q582-G586 PolarHBondContact O-N 2.85Å
583	D	85.7	Confident	86.4	Confident	47 Å²	47	45.6 Å²	45.6	25%	0.251	21%	0.208	S	C	.	.	H	α-helix	trans	-58.4	-42.3	178.4	-76.6	-21.8	0	0	0	110.5	I479 K579 Q587	I479-D583 HydrophobicContact CD1-CB 4.14Å; I479-D583 HydrophobicContact CG1-CB 4.16Å; I479-D583 HydrophobicContact CG2-CB 3.83Å; K579-D583 WeakPolarHBondContact CE-OD2 3.43Å; K579-D583 WeakPolarHBondContact CG-OD2 3.5Å; K579-D583 VanDerWaalsContact O-CB 3.31Å; K579-D583 WeakPolarHBondContact O-CB 3.4Å; K579-D583 PolarHBondContact O-N 3.47Å; D583-Q587 PolarHBondContact O-N 2.85Å; D583-Q587 VanDerWaalsContact O-N 3.12Å
584	K	87.6	Confident	86.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-71	-39.8	176.1	-72.3	-72.7	162.4	-158.9	0	113.8	I479 D481 M484 L493 V495 F511 L580 L581 Q582 G586 Q587 I588	I479-K584 PolarHBondContact O-NZ 3.35Å; I479-K584 VanDerWaalsContact O-NZ 3.13Å; D481-K584 WeakPolarHBondContact OD1-CE 3.47Å; D481-K584 IonicContact OD1-NZ 3.64Å; D481-K584 PolarHBondContact OD1-NZ 2.96Å; D481-K584 IonicContact OD2-NZ 2.99Å; D481-K584 PolarHBondContact OD2-NZ 3.47Å; M484-K584 WeakPolarHBondContact SD-CE 3.49Å; M484-K584 PolarHBondContact SD-NZ 3.34Å; M484-K584 VanDerWaalsContact SD-NZ 3.45Å; L493-K584 HydrophobicContact CD2-CB 4.45Å; L493-K584 HydrophobicContact CD2-CG 4.2Å; L493-K584 WeakPolarHBondContact O-CE 3.45Å; V495-K584 HydrophobicContact CG2-CD 4.4Å; F511-K584 HydrophobicContact CE1-CB 3.81Å; F511-K584 HydrophobicContact CZ-CB 4.34Å; L580-K584 WeakPolarHBondContact O-CB 3.3Å; L580-K584 VanDerWaalsContact O-CG 3.26Å; L580-K584 WeakPolarHBondContact O-CG 3.35Å; L580-K584 PolarHBondContact O-N 2.93Å; L580-K584 VanDerWaalsContact O-N 3.08Å; L581-K584 PolarHBondContact O-N 2.82Å; Q582-K584 VanDerWaalsContact C-N 3.3Å; Q582-K584 PolarHBondContact O-N 2.9Å; K584-G586 VanDerWaalsContact C-N 3.31Å; K584-G586 PolarHBondContact O-N 2.77Å; K584-Q587 WeakPolarHBondContact O-CB 3.42Å; K584-Q587 PolarHBondContact O-N 2.69Å; K584-I588 WeakPolarHBondContact O-CD1 3.06Å; K584-I588 WeakPolarHBondContact O-CG1 3.15Å; K584-I588 PolarHBondContact O-N 3.04Å
585	I	89.9	Confident	86.8	Confident	13 Å²	13	48.2 Å²	48.2	7%	0.067	22%	0.219	C	C	.	.	H	α-helix	trans	-59.6	-44	174.9	-72.9	159.7	0	0	0	110.4	F511 F536 L538 A543 L581 Q582 I588 R589	F511-I585 HydrophobicContact CZ-CG1 4.26Å; F536-I585 HydrophobicContact CD1-CD1 3.85Å; F536-I585 HydrophobicContact CD1-CG1 4.15Å; F536-I585 HydrophobicContact CD2-CD1 4.34Å; F536-I585 HydrophobicContact CE1-CD1 3.34Å; F536-I585 HydrophobicContact CE1-CG1 3.96Å; F536-I585 HydrophobicContact CE2-CD1 3.89Å; F536-I585 HydrophobicContact CG-CD1 4.34Å; F536-I585 HydrophobicContact CZ-CD1 3.36Å; F536-I585 HydrophobicContact CZ-CG1 4.45Å; L538-I585 HydrophobicContact CD2-CB 4.42Å; L538-I585 HydrophobicContact CD2-CG1 4.23Å; L538-I585 HydrophobicContact CD2-CG2 3.88Å; A543-I585 HydrophobicContact CB-CD1 4.36Å; L581-I585 HydrophobicContact CD1-CD1 3.85Å; L581-I585 HydrophobicContact CD1-CG1 4.18Å; L581-I585 HydrophobicContact CG-CD1 3.76Å; L581-I585 WeakPolarHBondContact O-CB 3.43Å; L581-I585 WeakPolarHBondContact O-CD1 3.48Å; L581-I585 WeakPolarHBondContact O-CG1 3.28Å; L581-I585 PolarHBondContact O-N 2.65Å; Q582-I585 PolarHBondContact O-N 2.99Å; I585-I588 PolarHBondContact O-N 2.92Å; I585-R589 WeakPolarHBondContact O-CB 3.34Å; I585-R589 WeakPolarHBondContact O-CG 3.49Å; I585-R589 PolarHBondContact O-N 3.23Å
586	G	87.7	Confident	87	Confident	38 Å²	38	44.8 Å²	44.8	39%	0.392	21%	0.206	S	C	.	.	H	α-helix	trans	-59.1	-45.9	173.7	0	0	0	0	0	112.4	Q582 K584 R589 K590	Q582-G586 PolarHBondContact O-N 2.85Å; K584-G586 VanDerWaalsContact C-N 3.31Å; K584-G586 PolarHBondContact O-N 2.77Å; G586-R589 PolarHBondContact O-N 2.86Å; G586-K590 WeakPolarHBondContact O-CB 2.89Å; G586-K590 PolarHBondContact O-N 3.19Å; G586-K590 VanDerWaalsContact O-N 3.08Å
587	Q	84.9	Confident	87.1	Confident	13 Å²	13	48.4 Å²	48.4	6%	0.061	22%	0.219	C	C	.	.	H	α-helix	trans	-61.3	-43.9	177	-175.2	162	73.5	0	0	112.7	D476 I479 D583 K584 K590 D591	D476-Q587 PolarHBondContact O-NE2 2.71Å; I479-Q587 HydrophobicContact CG2-CB 4.37Å; D583-Q587 PolarHBondContact O-N 2.85Å; D583-Q587 VanDerWaalsContact O-N 3.12Å; K584-Q587 WeakPolarHBondContact O-CB 3.42Å; K584-Q587 PolarHBondContact O-N 2.69Å; Q587-K590 PolarHBondContact O-N 2.99Å; Q587-D591 WeakPolarHBondContact O-CB 3.26Å; Q587-D591 PolarHBondContact O-N 3.37Å
588	I	89.3	Confident	87	Confident	5 Å²	5	51 Å²	51	3%	0.026	23%	0.231	C	C	.	.	H	α-helix	trans	-64.6	-46.1	177.1	-65.1	153.9	0	0	0	111.4	V495 T501 V509 F511 L538 K584 I585 K590 D591 R592	V495-I588 HydrophobicContact CG1-CD1 4.37Å; V495-I588 HydrophobicContact CG2-CD1 3.85Å; V495-I588 HydrophobicContact CG2-CG1 4.08Å; T501-I588 HydrophobicContact CG2-CG2 4.21Å; V509-I588 HydrophobicContact CG1-CD1 4Å; V509-I588 HydrophobicContact CG2-CG2 4.46Å; F511-I588 HydrophobicContact CE1-CD1 3.86Å; F511-I588 HydrophobicContact CE2-CD1 4.49Å; F511-I588 HydrophobicContact CZ-CD1 3.5Å; L538-I588 HydrophobicContact CD1-CG2 4.06Å; K584-I588 WeakPolarHBondContact O-CD1 3.06Å; K584-I588 WeakPolarHBondContact O-CG1 3.15Å; K584-I588 PolarHBondContact O-N 3.04Å; I585-I588 PolarHBondContact O-N 2.92Å; I588-K590 VanDerWaalsContact C-N 3.27Å; I588-K590 PolarHBondContact O-N 3.29Å; I588-D591 PolarHBondContact O-N 2.85Å; I588-R592 WeakPolarHBondContact O-CB 3.28Å; I588-R592 WeakPolarHBondContact O-CG 3.25Å; I588-R592 PolarHBondContact O-N 2.99Å
589	R	89.4	Confident	86.8	Confident	135 Å²	135	53.6 Å²	53.6	51%	0.509	24%	0.243	S	C	.	.	H	α-helix	trans	-57.5	-42.2	178.3	-75	174.6	174.1	-179.5	-0.1	111.1	L538 I585 G586 E593	L538-R589 PolarHBondContact O-NH2 2.7Å; I585-R589 WeakPolarHBondContact O-CB 3.34Å; I585-R589 WeakPolarHBondContact O-CG 3.49Å; I585-R589 PolarHBondContact O-N 3.23Å; G586-R589 PolarHBondContact O-N 2.86Å; R589-E593 PolarHBondContact O-N 2.75Å
590	K	86.3	Confident	86.9	Confident	73 Å²	73	53 Å²	53	32%	0.317	24%	0.242	S	C	.	.	H	α-helix	trans	-71	-44	177.4	-169.1	172.1	-173.1	168.3	0	113.3	D476 G586 Q587 I588 R592 E593 L594	D476-K590 VanDerWaalsContact OD1-CD 3.24Å; D476-K590 WeakPolarHBondContact OD1-CD 3.48Å; D476-K590 IonicContact OD1-NZ 2.67Å; D476-K590 PolarHBondContact OD1-NZ 3.23Å; D476-K590 IonicContact OD2-NZ 3.8Å; D476-K590 PolarHBondContact OD2-NZ 3.13Å; G586-K590 WeakPolarHBondContact O-CB 2.89Å; G586-K590 PolarHBondContact O-N 3.19Å; G586-K590 VanDerWaalsContact O-N 3.08Å; Q587-K590 PolarHBondContact O-N 2.99Å; I588-K590 VanDerWaalsContact C-N 3.27Å; I588-K590 PolarHBondContact O-N 3.29Å; K590-R592 VanDerWaalsContact C-N 3.3Å; K590-R592 PolarHBondContact O-N 3.46Å; K590-E593 PolarHBondContact O-N 3.45Å; K590-L594 HydrophobicContact CG-CD1 4.42Å; K590-L594 WeakPolarHBondContact O-CG 3.22Å; K590-L594 PolarHBondContact O-N 2.9Å
591	D	86.1	Confident	86.7	Confident	7 Å²	7	54.1 Å²	54.1	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-58.9	-41.4	175.4	-90.6	-15.6	0	0	0	111.3	R462 R498 V502 Q587 I588 L594 Y595	R462-D591 IonicContact CZ-OD1 3.34Å; R462-D591 IonicContact NH1-OD1 2.7Å; R462-D591 PolarHBondContact NH1-OD1 2.87Å; R462-D591 IonicContact NH2-OD1 3.51Å; R462-D591 PolarHBondContact NH2-OD1 3.48Å; R462-D591 VanDerWaalsContact NH2-OD1 3.14Å; R462-D591 IonicContact NH2-OD2 2.76Å; R498-D591 IonicContact CZ-OD2 2.71Å; R498-D591 IonicContact NE-OD2 3.49Å; R498-D591 PolarHBondContact NE-OD2 2.8Å; R498-D591 IonicContact NH2-OD1 2.77Å; R498-D591 IonicContact NH2-OD2 3.18Å; R498-D591 PolarHBondContact NH2-OD2 3.03Å; V502-D591 HydrophobicContact CG1-CB 3.98Å; V502-D591 HydrophobicContact CG2-CB 3.64Å; Q587-D591 WeakPolarHBondContact O-CB 3.26Å; Q587-D591 PolarHBondContact O-N 3.37Å; I588-D591 PolarHBondContact O-N 2.85Å; D591-L594 PolarHBondContact O-N 2.9Å; D591-Y595 WeakPolarHBondContact O-CB 3.47Å; D591-Y595 PolarHBondContact O-N 3.35Å
592	R	89.2	Confident	86.5	Confident	27 Å²	27	57 Å²	57	10%	0.102	26%	0.261	C	S	.	.	H	α-helix	trans	-62.3	-41.2	174.2	-77.9	-176.9	170.9	-170.8	-0.2	113	T501 S504 N506 I588 K590 Y595 R596	T501-R592 VanDerWaalsContact O-CZ 3.28Å; T501-R592 PolarHBondContact O-NE 3.27Å; T501-R592 PolarHBondContact O-NH2 3.23Å; S504-R592 PolarHBondContact O-NE 2.84Å; S504-R592 PolarHBondContact O-NH2 3.3Å; N506-R592 PolarHBondContact O-NH1 3.36Å; N506-R592 PolarHBondContact O-NH2 3.26Å; I588-R592 WeakPolarHBondContact O-CB 3.28Å; I588-R592 WeakPolarHBondContact O-CG 3.25Å; I588-R592 PolarHBondContact O-N 2.99Å; K590-R592 VanDerWaalsContact C-N 3.3Å; K590-R592 PolarHBondContact O-N 3.46Å; R592-Y595 PolarHBondContact O-N 2.84Å; R592-R596 WeakPolarHBondContact O-CG 3.37Å; R592-R596 PolarHBondContact O-N 3.12Å
593	E	88	Confident	86.3	Confident	78 Å²	78	60.1 Å²	60.1	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-65.1	-44.7	176.5	-171.2	-169.8	147.2	0	0	112	R589 K590 Y595 R596 K597	R589-E593 PolarHBondContact O-N 2.75Å; K590-E593 PolarHBondContact O-N 3.45Å; E593-Y595 VanDerWaalsContact C-N 3.32Å; E593-Y595 PolarHBondContact O-N 2.92Å; E593-R596 PolarHBondContact O-N 3.22Å; E593-K597 HydrophobicContact CG-CD 4.42Å; E593-K597 PolarHBondContact O-N 2.93Å; E593-K597 VanDerWaalsContact O-N 3.08Å; E593-K597 WeakPolarHBondContact OE1-CE 3.01Å; E593-K597 IonicContact OE1-NZ 3.96Å; E593-K597 PolarHBondContact OE1-NZ 3.19Å
594	L	85	Confident	86.4	Confident	26 Å²	26	62 Å²	62	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-61.8	-40.3	175.4	-69.4	174.9	0	0	0	111.5	E469 K590 D591 K597 E598	E469-L594 WeakPolarHBondContact O-CD2 3.38Å; K590-L594 HydrophobicContact CG-CD1 4.42Å; K590-L594 WeakPolarHBondContact O-CG 3.22Å; K590-L594 PolarHBondContact O-N 2.9Å; D591-L594 PolarHBondContact O-N 2.9Å; L594-K597 PolarHBondContact O-N 3.34Å; L594-E598 WeakPolarHBondContact O-CB 3.37Å; L594-E598 PolarHBondContact O-N 3.19Å
595	Y	86.1	Confident	86	Confident	90 Å²	90	63.3 Å²	63.3	35%	0.353	29%	0.287	S	S	.	.	H	α-helix	trans	-62.4	-43.4	175.7	-172.6	-93.7	0	0	0	112.3	V502 A503 D591 R592 E593 E598 Q599	V502-Y595 HydrophobicContact CG1-CD2 4.27Å; V502-Y595 HydrophobicContact CG1-CG 4.2Å; A503-Y595 HydrophobicContact CB-CE1 3.97Å; A503-Y595 HydrophobicContact CB-CE2 4.25Å; D591-Y595 WeakPolarHBondContact O-CB 3.47Å; D591-Y595 PolarHBondContact O-N 3.35Å; R592-Y595 PolarHBondContact O-N 2.84Å; E593-Y595 VanDerWaalsContact C-N 3.32Å; E593-Y595 PolarHBondContact O-N 2.92Å; Y595-E598 PolarHBondContact O-N 3.48Å; Y595-Q599 HydrophobicContact CD1-CG 4.06Å; Y595-Q599 HydrophobicContact CE1-CG 3.72Å; Y595-Q599 WeakPolarHBondContact O-CG 3.49Å; Y595-Q599 PolarHBondContact O-N 3.23Å; Y595-Q599 PolarHBondContact OH-NE2 2.91Å; Y595-Q599 VanDerWaalsContact OH-NE2 3.1Å
596	R	86.9	Confident	85.8	Confident	139 Å²	139	66.3 Å²	66.3	53%	0.525	30%	0.301	S	S	.	.	H	α-helix	trans	-59	-49.6	173.9	-70.3	-167.2	-52.5	-99.9	0.5	111.8	R592 E593 E598 Q599 E600	R592-R596 WeakPolarHBondContact O-CG 3.37Å; R592-R596 PolarHBondContact O-N 3.12Å; E593-R596 PolarHBondContact O-N 3.22Å; R596-E598 VanDerWaalsContact C-N 3.3Å; R596-E598 PolarHBondContact O-N 2.82Å; R596-Q599 PolarHBondContact O-N 2.87Å; R596-Q599 VanDerWaalsContact O-N 3.11Å; R596-E600 WeakPolarHBondContact O-CB 3.35Å; R596-E600 VanDerWaalsContact O-CG 3.31Å; R596-E600 WeakPolarHBondContact O-CG 3.38Å; R596-E600 PolarHBondContact O-N 3.3Å
597	K	85.7	Confident	85.8	Confident	108 Å²	108	69.9 Å²	69.9	47%	0.47	31%	0.306	S	S	.	.	H	α-helix	trans	-60.6	-36.9	178.2	-72.7	172.1	171.3	173.8	0	112.7	E593 L594 R601	E593-K597 HydrophobicContact CG-CD 4.42Å; E593-K597 PolarHBondContact O-N 2.93Å; E593-K597 VanDerWaalsContact O-N 3.08Å; E593-K597 WeakPolarHBondContact OE1-CE 3.01Å; E593-K597 IonicContact OE1-NZ 3.96Å; E593-K597 PolarHBondContact OE1-NZ 3.19Å; L594-K597 PolarHBondContact O-N 3.34Å; K597-R601 WeakPolarHBondContact O-CB 3.34Å; K597-R601 PolarHBondContact O-N 2.87Å
598	E	81.8	Confident	85.8	Confident	56 Å²	56	74 Å²	74	26%	0.262	32%	0.323	S	S	.	.	H	α-helix	trans	-66.8	-42.8	173.9	179	124.1	-125.3	0	0	111.5	R465 L594 Y595 R596 R601 L602	R465-E598 IonicContact CZ-OE2 3.7Å; R465-E598 VanDerWaalsContact CZ-OE2 3.28Å; R465-E598 IonicContact NH1-OE1 2.73Å; R465-E598 IonicContact NH1-OE2 3.49Å; R465-E598 PolarHBondContact NH1-OE2 2.84Å; R465-E598 IonicContact NH2-OE2 3.69Å; R465-E598 PolarHBondContact NH2-OE2 3.45Å; L594-E598 WeakPolarHBondContact O-CB 3.37Å; L594-E598 PolarHBondContact O-N 3.19Å; Y595-E598 PolarHBondContact O-N 3.48Å; R596-E598 VanDerWaalsContact C-N 3.3Å; R596-E598 PolarHBondContact O-N 2.82Å; E598-R601 PolarHBondContact O-N 2.72Å; E598-R601 IonicContact OE1-CZ 3.67Å; E598-R601 IonicContact OE1-NH2 3.39Å; E598-R601 PolarHBondContact OE1-NH2 3.39Å; E598-L602 HydrophobicContact CG-CD1 4.43Å; E598-L602 VanDerWaalsContact O-CG 3.32Å; E598-L602 WeakPolarHBondContact O-CG 3.14Å; E598-L602 PolarHBondContact O-N 3.1Å
599	Q	84.6	Confident	85.6	Confident	66 Å²	66	75.3 Å²	75.3	31%	0.308	34%	0.335	S	S	.	.	H	α-helix	trans	-66.8	-40	175.4	-70.7	-67.2	-9.8	0	0	113.2	Y595 R596 L602 K603	Y595-Q599 HydrophobicContact CD1-CG 4.06Å; Y595-Q599 HydrophobicContact CE1-CG 3.72Å; Y595-Q599 WeakPolarHBondContact O-CG 3.49Å; Y595-Q599 PolarHBondContact O-N 3.23Å; Y595-Q599 PolarHBondContact OH-NE2 2.91Å; Y595-Q599 VanDerWaalsContact OH-NE2 3.1Å; R596-Q599 PolarHBondContact O-N 2.87Å; R596-Q599 VanDerWaalsContact O-N 3.11Å; Q599-L602 PolarHBondContact O-N 3.43Å; Q599-K603 WeakPolarHBondContact O-CG 3.28Å; Q599-K603 PolarHBondContact O-N 3.47Å
600	E	87.4	Confident	85.5	Confident	109 Å²	109	75.7 Å²	75.7	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-60.1	-46.8	173.3	-73.4	155.8	-160.5	0	0	110.9	R596 L602 K603 E604	R596-E600 WeakPolarHBondContact O-CB 3.35Å; R596-E600 VanDerWaalsContact O-CG 3.31Å; R596-E600 WeakPolarHBondContact O-CG 3.38Å; R596-E600 PolarHBondContact O-N 3.3Å; E600-L602 PolarHBondContact O-N 3.29Å; E600-K603 PolarHBondContact O-N 2.98Å; E600-E604 WeakPolarHBondContact O-CB 3.48Å; E600-E604 PolarHBondContact O-N 3.5Å
601	R	80.3	Confident	85.5	Confident	30 Å²	30	76.3 Å²	76.3	11%	0.113	34%	0.344	C	S	.	.	H	α-helix	trans	-60.8	-39.8	173.3	176.3	179.2	69.5	-174.6	-12.4	112.9	E470 K597 E598 E604 N605	E470-R601 VanDerWaalsContact CD-NH1 3.34Å; E470-R601 IonicContact OE1-CZ 2.8Å; E470-R601 VanDerWaalsContact OE1-CZ 3.3Å; E470-R601 IonicContact OE1-NH1 2.7Å; E470-R601 PolarHBondContact OE1-NH1 3.13Å; E470-R601 IonicContact OE1-NH2 2.71Å; E470-R601 PolarHBondContact OE1-NH2 2.95Å; E470-R601 IonicContact OE2-CZ 2.92Å; E470-R601 IonicContact OE2-NH1 2.73Å; E470-R601 PolarHBondContact OE2-NH1 3.29Å; E470-R601 IonicContact OE2-NH2 2.63Å; E470-R601 PolarHBondContact OE2-NH2 3.32Å; K597-R601 WeakPolarHBondContact O-CB 3.34Å; K597-R601 PolarHBondContact O-N 2.87Å; E598-R601 PolarHBondContact O-N 2.72Å; E598-R601 IonicContact OE1-CZ 3.67Å; E598-R601 IonicContact OE1-NH2 3.39Å; E598-R601 PolarHBondContact OE1-NH2 3.39Å; R601-E604 PolarHBondContact O-N 2.83Å; R601-N605 WeakPolarHBondContact O-CB 3.44Å; R601-N605 VanDerWaalsContact O-CG 3.27Å; R601-N605 PolarHBondContact O-N 3.45Å; R601-N605 PolarHBondContact O-ND2 2.87Å
602	L	84	Confident	85.4	Confident	59 Å²	59	80.5 Å²	80.5	31%	0.309	36%	0.364	S	S	.	.	H	α-helix	trans	-63.4	-44	177.5	-74.7	168.6	0	0	0	110.6	E598 Q599 E600 N605 E606	E598-L602 HydrophobicContact CG-CD1 4.43Å; E598-L602 VanDerWaalsContact O-CG 3.32Å; E598-L602 WeakPolarHBondContact O-CG 3.14Å; E598-L602 PolarHBondContact O-N 3.1Å; Q599-L602 PolarHBondContact O-N 3.43Å; E600-L602 PolarHBondContact O-N 3.29Å; L602-N605 PolarHBondContact O-N 3.3Å; L602-E606 WeakPolarHBondContact O-CB 3.38Å; L602-E606 WeakPolarHBondContact O-CG 3.23Å; L602-E606 PolarHBondContact O-N 3.09Å
603	K	87.3	Confident	85.4	Confident	144 Å²	144	81.9 Å²	81.9	63%	0.626	38%	0.381	S	S	*	.	H	α-helix	trans	-62	-41.7	173.2	-67.1	168.2	-176.3	178	0	112.5	Q599 E600 E606 K607	Q599-K603 WeakPolarHBondContact O-CG 3.28Å; Q599-K603 PolarHBondContact O-N 3.47Å; E600-K603 PolarHBondContact O-N 2.98Å; K603-E606 PolarHBondContact O-N 2.94Å; K603-K607 PolarHBondContact O-N 3.35Å
604	E	85.8	Confident	85.5	Confident	86 Å²	86	84.8 Å²	84.8	40%	0.402	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-45.9	176	-168.1	-160.4	177.3	0	0	111.7	E600 R601 K607 K608	E600-E604 WeakPolarHBondContact O-CB 3.48Å; E600-E604 PolarHBondContact O-N 3.5Å; R601-E604 PolarHBondContact O-N 2.83Å; E604-K607 PolarHBondContact O-N 3.11Å; E604-K608 WeakPolarHBondContact O-CG 3.32Å; E604-K608 PolarHBondContact O-N 2.96Å; E604-K608 WeakPolarHBondContact OE1-CE 3.47Å; E604-K608 IonicContact OE1-NZ 2.69Å; E604-K608 PolarHBondContact OE1-NZ 3.39Å
605	N	81.1	Confident	85.6	Confident	27 Å²	27	88.4 Å²	88.4	14%	0.144	41%	0.414	C	S	.	.	H	α-helix	trans	-66.6	-36.5	176.7	-71.1	-24	0	0	0	111.9	R601 L602 K608 A609	R601-N605 WeakPolarHBondContact O-CB 3.44Å; R601-N605 VanDerWaalsContact O-CG 3.27Å; R601-N605 PolarHBondContact O-N 3.45Å; R601-N605 PolarHBondContact O-ND2 2.87Å; L602-N605 PolarHBondContact O-N 3.3Å; N605-K608 PolarHBondContact O-N 3.16Å; N605-A609 VanDerWaalsContact O-CB 3.3Å; N605-A609 WeakPolarHBondContact O-CB 3.47Å; N605-A609 PolarHBondContact O-N 2.88Å
606	E	84.3	Confident	85.6	Confident	77 Å²	77	89.7 Å²	89.7	36%	0.36	42%	0.423	S	S	.	.	H	α-helix	trans	-71.3	-31.8	174.7	-73.9	-169.4	167.2	0	0	113	R436 L602 K603 K610	R436-E606 IonicContact NH1-OE1 2.65Å; R436-E606 PolarHBondContact NH1-OE1 2.74Å; R436-E606 VanDerWaalsContact NH1-OE1 3.12Å; L602-E606 WeakPolarHBondContact O-CB 3.38Å; L602-E606 WeakPolarHBondContact O-CG 3.23Å; L602-E606 PolarHBondContact O-N 3.09Å; K603-E606 PolarHBondContact O-N 2.94Å; E606-K610 WeakPolarHBondContact O-CD 3.33Å; E606-K610 VanDerWaalsContact O-CG 3.24Å; E606-K610 WeakPolarHBondContact O-CG 3.39Å; E606-K610 PolarHBondContact O-N 3.21Å; E606-K610 VanDerWaalsContact O-N 3.1Å
607	K	87.8	Confident	85.8	Confident	112 Å²	112	87.6 Å²	87.6	49%	0.487	42%	0.422	S	S	.	.	H	α-helix	trans	-61.7	-52.7	168.8	178.6	174	174.8	177.4	0	110.1	K603 E604 A609 K610 E611	K603-K607 PolarHBondContact O-N 3.35Å; E604-K607 PolarHBondContact O-N 3.11Å; K607-A609 VanDerWaalsContact C-N 3.34Å; K607-A609 PolarHBondContact O-N 3.09Å; K607-K610 WeakPolarHBondContact O-CB 3.32Å; K607-K610 PolarHBondContact O-N 3.02Å; K607-K610 VanDerWaalsContact O-N 3.08Å; K607-E611 WeakPolarHBondContact CE-OE1 3.21Å; K607-E611 VanDerWaalsContact CG-OE1 3.31Å; K607-E611 WeakPolarHBondContact CG-OE1 3.24Å; K607-E611 WeakPolarHBondContact O-CG 3.42Å; K607-E611 PolarHBondContact O-N 3.07Å
608	K	85.9	Confident	85.9	Confident	99 Å²	99	87.5 Å²	87.5	43%	0.43	42%	0.423	S	S	.	.	H	α-helix	trans	-60.5	-38.7	178.1	-69.3	172.8	-172.8	172.5	0	113.3	E604 N605 K610 E611 E612	E604-K608 WeakPolarHBondContact O-CG 3.32Å; E604-K608 PolarHBondContact O-N 2.96Å; E604-K608 WeakPolarHBondContact OE1-CE 3.47Å; E604-K608 IonicContact OE1-NZ 2.69Å; E604-K608 PolarHBondContact OE1-NZ 3.39Å; N605-K608 PolarHBondContact O-N 3.16Å; K608-K610 VanDerWaalsContact C-N 3.33Å; K608-K610 PolarHBondContact O-N 3.43Å; K608-E611 PolarHBondContact O-N 3.37Å; K608-E612 WeakPolarHBondContact O-CB 3.35Å; K608-E612 PolarHBondContact O-N 3Å
609	A	85.1	Confident	86.2	Confident	33 Å²	33	90 Å²	90	27%	0.273	44%	0.437	S	S	.	.	H	α-helix	trans	-68.3	-30.4	176.2	0	0	0	0	0	113	N605 K607 A613	N605-A609 VanDerWaalsContact O-CB 3.3Å; N605-A609 WeakPolarHBondContact O-CB 3.47Å; N605-A609 PolarHBondContact O-N 2.88Å; K607-A609 VanDerWaalsContact C-N 3.34Å; K607-A609 PolarHBondContact O-N 3.09Å; A609-A613 VanDerWaalsContact O-CB 3.29Å; A609-A613 WeakPolarHBondContact O-CB 3.43Å; A609-A613 PolarHBondContact O-N 3.03Å; A609-A613 VanDerWaalsContact O-N 3.07Å
610	K	87.2	Confident	86.4	Confident	143 Å²	143	92.5 Å²	92.5	62%	0.622	45%	0.447	S	S	*	.	H	α-helix	trans	-72.3	-43.4	171.9	-72.1	165	-175.5	173	0	111.3	E606 K607 K608 A613 Q614	E606-K610 WeakPolarHBondContact O-CD 3.33Å; E606-K610 VanDerWaalsContact O-CG 3.24Å; E606-K610 WeakPolarHBondContact O-CG 3.39Å; E606-K610 PolarHBondContact O-N 3.21Å; E606-K610 VanDerWaalsContact O-N 3.1Å; K607-K610 WeakPolarHBondContact O-CB 3.32Å; K607-K610 PolarHBondContact O-N 3.02Å; K607-K610 VanDerWaalsContact O-N 3.08Å; K608-K610 VanDerWaalsContact C-N 3.33Å; K608-K610 PolarHBondContact O-N 3.43Å; K610-A613 PolarHBondContact O-N 2.84Å; K610-Q614 WeakPolarHBondContact O-CB 3.49Å; K610-Q614 PolarHBondContact O-N 3.09Å
611	E	86.2	Confident	86.4	Confident	86 Å²	86	91.9 Å²	91.9	40%	0.402	44%	0.444	S	S	.	.	H	α-helix	trans	-59.7	-45.7	174.6	-69	163.6	172.2	0	0	111.2	K607 K608 Q614 L615	K607-E611 WeakPolarHBondContact CE-OE1 3.21Å; K607-E611 VanDerWaalsContact CG-OE1 3.31Å; K607-E611 WeakPolarHBondContact CG-OE1 3.24Å; K607-E611 WeakPolarHBondContact O-CG 3.42Å; K607-E611 PolarHBondContact O-N 3.07Å; K608-E611 PolarHBondContact O-N 3.37Å; E611-Q614 PolarHBondContact O-N 2.79Å; E611-L615 WeakPolarHBondContact O-CG 3.36Å; E611-L615 PolarHBondContact O-N 3.31Å
612	E	83.8	Confident	86.5	Confident	96 Å²	96	95.2 Å²	95.2	45%	0.449	46%	0.464	S	S	.	.	H	α-helix	trans	-62.6	-44.3	175.4	-166.3	-169.8	163.4	0	0	112	K608 Q614 L615 Q616	K608-E612 WeakPolarHBondContact O-CB 3.35Å; K608-E612 PolarHBondContact O-N 3Å; E612-Q614 VanDerWaalsContact C-N 3.34Å; E612-Q614 PolarHBondContact O-N 3.36Å; E612-L615 PolarHBondContact O-N 3.23Å; E612-Q616 WeakPolarHBondContact O-CG 3.45Å; E612-Q616 PolarHBondContact O-N 2.88Å; E612-Q616 PolarHBondContact OE1-NE2 2.93Å; E612-Q616 VanDerWaalsContact OE1-NE2 3.14Å
613	A	88.9	Confident	86.5	Confident	55 Å²	55	98.9 Å²	98.9	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-64.7	-36.2	177.3	0	0	0	0	0	112.7	A609 K610 Q616 L617	A609-A613 VanDerWaalsContact O-CB 3.29Å; A609-A613 WeakPolarHBondContact O-CB 3.43Å; A609-A613 PolarHBondContact O-N 3.03Å; A609-A613 VanDerWaalsContact O-N 3.07Å; K610-A613 PolarHBondContact O-N 2.84Å; A613-Q616 PolarHBondContact O-N 2.88Å; A613-L617 PolarHBondContact O-N 2.81Å
614	Q	90.1	Very high	86.3	Confident	140 Å²	140	95.1 Å²	95.1	65%	0.654	46%	0.462	S	S	*	.	H	α-helix	trans	-66.2	-45.1	175.5	-176.1	171.2	-11.5	0	0	111.3	K610 E611 E612 Q616 L617 E618	K610-Q614 WeakPolarHBondContact O-CB 3.49Å; K610-Q614 PolarHBondContact O-N 3.09Å; E611-Q614 PolarHBondContact O-N 2.79Å; E612-Q614 VanDerWaalsContact C-N 3.34Å; E612-Q614 PolarHBondContact O-N 3.36Å; Q614-Q616 VanDerWaalsContact C-N 3.34Å; Q614-Q616 PolarHBondContact O-N 2.83Å; Q614-L617 PolarHBondContact O-N 3Å; Q614-E618 PolarHBondContact O-N 3.44Å
615	L	88.4	Confident	86	Confident	102 Å²	102	97.3 Å²	97.3	53%	0.534	47%	0.47	S	S	.	.	H	α-helix	trans	-62.1	-38.9	174	-71.6	168.3	0	0	0	112.2	E611 E612 E618 L619	E611-L615 WeakPolarHBondContact O-CG 3.36Å; E611-L615 PolarHBondContact O-N 3.31Å; E612-L615 PolarHBondContact O-N 3.23Å; L615-E618 PolarHBondContact O-N 3.34Å; L615-L619 WeakPolarHBondContact O-CB 3.47Å; L615-L619 VanDerWaalsContact O-CG 3.26Å; L615-L619 WeakPolarHBondContact O-CG 3.29Å; L615-L619 PolarHBondContact O-N 3.48Å
616	Q	85.6	Confident	85.9	Confident	116 Å²	116	101 Å²	101	54%	0.542	49%	0.485	S	S	.	.	H	α-helix	trans	-65.1	-37.4	174.5	-72.2	-179.4	27.6	0	0	112.3	E612 A613 Q614 K620	E612-Q616 WeakPolarHBondContact O-CG 3.45Å; E612-Q616 PolarHBondContact O-N 2.88Å; E612-Q616 PolarHBondContact OE1-NE2 2.93Å; E612-Q616 VanDerWaalsContact OE1-NE2 3.14Å; A613-Q616 PolarHBondContact O-N 2.88Å; Q614-Q616 VanDerWaalsContact C-N 3.34Å; Q614-Q616 PolarHBondContact O-N 2.83Å; Q616-K620 PolarHBondContact O-N 2.85Å
617	L	90.7	Very high	85.5	Confident	96 Å²	96	102.6 Å²	102.6	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-67.6	-43.3	175.2	-178.9	61.6	0	0	0	111.9	A613 Q614 K620 Q621	A613-L617 PolarHBondContact O-N 2.81Å; Q614-L617 PolarHBondContact O-N 3Å; L617-K620 WeakPolarHBondContact O-CB 3.38Å; L617-K620 PolarHBondContact O-N 2.88Å; L617-K620 VanDerWaalsContact O-N 3.14Å; L617-Q621 WeakPolarHBondContact O-CG 3.39Å; L617-Q621 PolarHBondContact O-N 2.84Å
618	E	87.7	Confident	84.8	Confident	106 Å²	106	103.8 Å²	103.8	50%	0.495	50%	0.497	S	S	.	.	H	α-helix	trans	-62.2	-45.1	176.1	-173.5	173.8	-169	0	0	111.6	Q614 L615 K620 Q621 L622	Q614-E618 PolarHBondContact O-N 3.44Å; L615-E618 PolarHBondContact O-N 3.34Å; E618-K620 PolarHBondContact O-N 3.28Å; E618-Q621 PolarHBondContact O-N 3.5Å; E618-L622 HydrophobicContact CG-CD1 4.37Å; E618-L622 WeakPolarHBondContact O-CG 3.43Å; E618-L622 PolarHBondContact O-N 2.81Å
619	L	88.8	Confident	83.7	Confident	107 Å²	107	105 Å²	105	56%	0.56	51%	0.506	S	S	*	.	H	α-helix	trans	-60.9	-30.2	173	-73.7	169.4	0	0	0	113.1	L615 K623	L615-L619 WeakPolarHBondContact O-CB 3.47Å; L615-L619 VanDerWaalsContact O-CG 3.26Å; L615-L619 WeakPolarHBondContact O-CG 3.29Å; L615-L619 PolarHBondContact O-N 3.48Å; L619-K623 WeakPolarHBondContact O-CG 3.49Å; L619-K623 PolarHBondContact O-N 2.88Å
620	K	88.7	Confident	82.4	Confident	120 Å²	120	108.1 Å²	108.1	52%	0.522	52%	0.515	S	S	.	.	H	α-helix	trans	-71.9	-46.2	173	-171.4	175.8	-176.2	-75.9	0	111.3	Q616 L617 E618 L622 K623 E624	Q616-K620 PolarHBondContact O-N 2.85Å; L617-K620 WeakPolarHBondContact O-CB 3.38Å; L617-K620 PolarHBondContact O-N 2.88Å; L617-K620 VanDerWaalsContact O-N 3.14Å; E618-K620 PolarHBondContact O-N 3.28Å; K620-L622 VanDerWaalsContact C-N 3.31Å; K620-L622 PolarHBondContact O-N 3.34Å; K620-K623 WeakPolarHBondContact O-CB 3.43Å; K620-K623 PolarHBondContact O-N 2.79Å; K620-E624 IonicContact NZ-OE1 3.75Å; K620-E624 PolarHBondContact NZ-OE1 3.06Å; K620-E624 PolarHBondContact O-N 2.79Å
621	Q	86.2	Confident	81.1	Confident	96 Å²	96	108.1 Å²	108.1	45%	0.449	52%	0.522	S	S	.	.	H	α-helix	trans	-61.6	-37.4	176.4	-68.4	-178.8	16.2	0	0	112.6	L617 E618 E624 K625	L617-Q621 WeakPolarHBondContact O-CG 3.39Å; L617-Q621 PolarHBondContact O-N 2.84Å; E618-Q621 PolarHBondContact O-N 3.5Å; Q621-E624 PolarHBondContact O-N 3.15Å; Q621-K625 WeakPolarHBondContact O-CB 3.24Å; Q621-K625 WeakPolarHBondContact O-CG 3.5Å; Q621-K625 PolarHBondContact O-N 3.49Å
622	L	83.3	Confident	79.7	Confident	99 Å²	99	108.6 Å²	108.6	52%	0.518	53%	0.531	S	S	.	.	H	α-helix	trans	-66	-36.7	175.5	-72.6	170.3	0	0	0	112.5	E618 K620 K626	E618-L622 HydrophobicContact CG-CD1 4.37Å; E618-L622 WeakPolarHBondContact O-CG 3.43Å; E618-L622 PolarHBondContact O-N 2.81Å; K620-L622 VanDerWaalsContact C-N 3.31Å; K620-L622 PolarHBondContact O-N 3.34Å; L622-K626 WeakPolarHBondContact O-CB 3.47Å; L622-K626 PolarHBondContact O-N 2.78Å; L622-K626 VanDerWaalsContact O-N 3.09Å
623	K	84.3	Confident	77.6	Confident	136 Å²	136	108 Å²	108	59%	0.591	55%	0.549	S	S	*	.	H	α-helix	trans	-65.5	-49.7	171.6	-72.5	173.5	-178.4	-178.8	0	111.5	L619 K620 K625 K626 E627	L619-K623 WeakPolarHBondContact O-CG 3.49Å; L619-K623 PolarHBondContact O-N 2.88Å; K620-K623 WeakPolarHBondContact O-CB 3.43Å; K620-K623 PolarHBondContact O-N 2.79Å; K623-K625 VanDerWaalsContact C-N 3.32Å; K623-K625 PolarHBondContact O-N 3.06Å; K623-K626 CarbonylContact O-C 3.59Å; K623-K626 WeakPolarHBondContact O-CA 3.08Å; K623-K626 WeakPolarHBondContact O-CB 3.31Å; K623-K626 PolarHBondContact O-N 2.66Å; K623-E627 WeakPolarHBondContact O-CG 3.37Å; K623-E627 PolarHBondContact O-N 2.88Å
624	E	82.7	Confident	75.2	Confident	65 Å²	65	110.9 Å²	110.9	30%	0.304	56%	0.556	S	S	.	*	H	α-helix	trans	-61.3	-38	178.9	-70.9	175.7	-157.5	0	0	112.8	K620 Q621 K628	K620-E624 IonicContact NZ-OE1 3.75Å; K620-E624 PolarHBondContact NZ-OE1 3.06Å; K620-E624 PolarHBondContact O-N 2.79Å; Q621-E624 PolarHBondContact O-N 3.15Å; E624-K628 WeakPolarHBondContact O-CB 3.26Å; E624-K628 WeakPolarHBondContact O-CD 3.19Å; E624-K628 VanDerWaalsContact O-CG 3.24Å; E624-K628 WeakPolarHBondContact O-CG 3.4Å; E624-K628 PolarHBondContact O-N 2.96Å
625	K	80	Confident	72.6	Confident	132 Å²	132	107.9 Å²	107.9	57%	0.574	55%	0.551	S	S	*	*	H	α-helix	trans	-63	-42.4	172.1	-78.9	179.2	177.4	179.7	0	111.4	Q621 K623 K628 M629	Q621-K625 WeakPolarHBondContact O-CB 3.24Å; Q621-K625 WeakPolarHBondContact O-CG 3.5Å; Q621-K625 PolarHBondContact O-N 3.49Å; K623-K625 VanDerWaalsContact C-N 3.32Å; K623-K625 PolarHBondContact O-N 3.06Å; K625-K628 PolarHBondContact O-N 2.79Å; K625-M629 WeakPolarHBondContact O-CG 3.26Å; K625-M629 PolarHBondContact O-N 3.21Å
626	K	78.7	Confident	69.9	Low	105 Å²	105	111 Å²	111	46%	0.457	56%	0.563	S	S	.	*	H	α-helix	trans	-66.9	-43.2	177.6	-173.8	177.8	172.9	-176	0	112.5	L622 K623 K628 M629 E630	L622-K626 WeakPolarHBondContact O-CB 3.47Å; L622-K626 PolarHBondContact O-N 2.78Å; L622-K626 VanDerWaalsContact O-N 3.09Å; K623-K626 CarbonylContact O-C 3.59Å; K623-K626 WeakPolarHBondContact O-CA 3.08Å; K623-K626 WeakPolarHBondContact O-CB 3.31Å; K623-K626 PolarHBondContact O-N 2.66Å; K626-K628 VanDerWaalsContact C-N 3.3Å; K626-K628 PolarHBondContact O-N 2.75Å; K626-M629 PolarHBondContact O-N 3.08Å; K626-E630 WeakPolarHBondContact CE-OE1 3.36Å; K626-E630 HydrophobicContact CG-CG 4.47Å; K626-E630 IonicContact NZ-OE1 2.75Å; K626-E630 WeakPolarHBondContact O-CG 3.48Å; K626-E630 PolarHBondContact O-N 3.48Å
627	E	74.7	Confident	67.5	Low	110 Å²	110	114 Å²	114	51%	0.514	58%	0.576	S	S	.	*	H	α-helix	trans	-64	-34.8	176.1	-71.9	162.9	-168.1	0	0	111.8	K623 E630 N631	K623-E627 WeakPolarHBondContact O-CG 3.37Å; K623-E627 PolarHBondContact O-N 2.88Å; E627-E630 PolarHBondContact O-N 2.87Å; E627-N631 WeakPolarHBondContact O-CB 3.49Å; E627-N631 PolarHBondContact O-N 2.74Å; E627-N631 VanDerWaalsContact O-N 3.11Å; E627-N631 PolarHBondContact O-ND2 3.37Å
628	K	73.6	Confident	64.8	Low	137 Å²	137	116.3 Å²	116.3	60%	0.596	59%	0.585	S	S	*	*	H	α-helix	trans	-67.7	-39.3	171.7	-74.2	166.2	-177	169.2	0	112.4	E624 K625 K626 N631 V632	E624-K628 WeakPolarHBondContact O-CB 3.26Å; E624-K628 WeakPolarHBondContact O-CD 3.19Å; E624-K628 VanDerWaalsContact O-CG 3.24Å; E624-K628 WeakPolarHBondContact O-CG 3.4Å; E624-K628 PolarHBondContact O-N 2.96Å; K625-K628 PolarHBondContact O-N 2.79Å; K626-K628 VanDerWaalsContact C-N 3.3Å; K626-K628 PolarHBondContact O-N 2.75Å; K628-N631 PolarHBondContact O-N 3.27Å; K628-V632 WeakPolarHBondContact O-CG2 3.3Å; K628-V632 PolarHBondContact O-N 3.01Å
629	M	62.5	Low	62	Low	124 Å²	124	114.6 Å²	114.6	61%	0.611	58%	0.583	S	S	*	*	H	α-helix	trans	-68.3	-37.6	172.7	-69.7	-173.7	-59.5	0	0	112.8	K625 K626 N631	K625-M629 WeakPolarHBondContact O-CG 3.26Å; K625-M629 PolarHBondContact O-N 3.21Å; K626-M629 PolarHBondContact O-N 3.08Å; M629-N631 VanDerWaalsContact C-N 3.29Å; M629-N631 PolarHBondContact O-N 3.25Å
630	E	58.8	Low	59.4	Low	99 Å²	99	115.4 Å²	115.4	46%	0.463	59%	0.587	S	S	.	*	H	α-helix	trans	-73.2	-17.3	177.8	-69.7	-171.5	-179.3	0	0	113.1	K626 E627 R688	K626-E630 WeakPolarHBondContact CE-OE1 3.36Å; K626-E630 HydrophobicContact CG-CG 4.47Å; K626-E630 IonicContact NZ-OE1 2.75Å; K626-E630 WeakPolarHBondContact O-CG 3.48Å; K626-E630 PolarHBondContact O-N 3.48Å; E627-E630 PolarHBondContact O-N 2.87Å; E630-R688 IonicContact OE1-CZ 3.78Å; E630-R688 IonicContact OE1-NH2 3.35Å; E630-R688 PolarHBondContact OE1-NH2 3.21Å; E630-R688 IonicContact OE2-NH2 3.1Å; E630-R688 PolarHBondContact OE2-NH2 2.86Å
631	N	58.9	Low	56.8	Low	144 Å²	144	115.3 Å²	115.3	77%	0.77	60%	0.596	S	S	*	*	H	α-helix	trans	-94.8	-19.5	175	-86.8	-33.2	0	0	0	115	E627 K628 M629 G633	E627-N631 WeakPolarHBondContact O-CB 3.49Å; E627-N631 PolarHBondContact O-N 2.74Å; E627-N631 VanDerWaalsContact O-N 3.11Å; E627-N631 PolarHBondContact O-ND2 3.37Å; K628-N631 PolarHBondContact O-N 3.27Å; M629-N631 VanDerWaalsContact C-N 3.29Å; M629-N631 PolarHBondContact O-N 3.25Å; N631-G633 PolarHBondContact O-N 3.13Å
632	V	57.2	Low	54.2	Low	96 Å²	96	117.9 Å²	117.9	58%	0.582	61%	0.608	S	S	*	*	S	Bend	trans	-88.8	89.4	173.2	178.2	0	0	0	0	108.2	K628 I634	K628-V632 WeakPolarHBondContact O-CG2 3.3Å; K628-V632 PolarHBondContact O-N 3.01Å; V632-I634 HydrophobicContact CG1-CD1 4.12Å; V632-I634 HydrophobicContact CG1-CG1 4.29Å; V632-I634 PolarHBondContact O-N 2.84Å
633	G	39.1	Very low	51.7	Low	82 Å²	82	116.8 Å²	116.8	85%	0.845	60%	0.603	S	S	*	*			trans	-64.1	93.5	-174.5	0	0	0	0	0	113.7	N631	N631-G633 PolarHBondContact O-N 3.13Å
634	I	39.1	Very low	49.3	Very low	116 Å²	116	116.7 Å²	116.7	60%	0.595	61%	0.609	S	S	*	*			trans	-118.6	138.6	169.1	-63	173.2	0	0	0	107.4	V632	V632-I634 HydrophobicContact CG1-CD1 4.12Å; V632-I634 HydrophobicContact CG1-CG1 4.29Å; V632-I634 PolarHBondContact O-N 2.84Å
635	S	35.2	Very low	46.9	Very low	77 Å²	77	120.5 Å²	120.5	54%	0.538	63%	0.626	S	S	.	*			trans	-68.8	146.6	-173.3	43.7	0	0	0	0	113.3	E637	S635-E637 PolarHBondContact O-N 3.45Å
636	E	32.1	Very low	44.6	Very low	169 Å²	169	118.8 Å²	118.8	79%	0.79	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	34.3	-175.4	-58.3	-173.3	139	0	0	114.4	V686	E636-V686 WeakPolarHBondContact OE1-CG2 3.48Å
637	E	35.5	Very low	42.4	Very low	177 Å²	177	119 Å²	119	83%	0.827	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.2	-10.6	-178	-85.4	177	167	0	0	114.8	S635	S635-E637 PolarHBondContact O-N 3.45Å
638	Q	33	Very low	40.2	Very low	146 Å²	146	121.6 Å²	121.6	68%	0.682	64%	0.642	S	S	*	*	S	Bend	trans	-108.6	-0.4	-175.3	-73.7	-171.9	-21.4	0	0	116.1
639	C	28.8	Very low	38.1	Very low	69 Å²	69	118.4 Å²	118.4	47%	0.466	64%	0.637	S	S	.	*	S	Bend	trans	-86.6	-5.8	176.3	-62.4	0	0	0	0	113.5	K684	C639-K684 VanDerWaalsContact CB-CE 3.49Å; C639-K684 PolarHBondContact O-NZ 2.93Å
640	I	34.4	Very low	36.6	Very low	124 Å²	124	121 Å²	121	64%	0.636	65%	0.648	S	S	*	*	S	Bend	trans	-88.6	140.9	162.8	-54.4	172.9	0	0	0	106
641	V	34.4	Very low	35.2	Very low	118 Å²	118	124.2 Å²	124.2	72%	0.715	66%	0.662	S	S	*	*	S	Bend	trans	74.8	38.6	-174.9	-154.4	0	0	0	0	115.1
642	H	31.4	Very low	33.9	Very low	150 Å²	150	123.2 Å²	123.2	69%	0.694	66%	0.661	S	S	*	*	S	Bend	trans	-152.6	50.1	158.6	-123.6	64	0	0	0	115.8
643	N	31.4	Very low	32.5	Very low	77 Å²	77	127.2 Å²	127.2	41%	0.412	67%	0.671	S	S	.	*	S	Bend	trans	-142.6	-11.2	159.7	-137.9	18.8	0	0	0	115.2	Q645 V646	N643-Q645 PolarHBondContact O-N 2.9Å; N643-V646 PolarHBondContact O-N 3Å
644	D	34	Very low	32.1	Very low	133 Å²	133	131.4 Å²	131.4	71%	0.711	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	9.8	170.9	-53.8	-83	0	0	0	114.8
645	Q	31.8	Very low	31.6	Very low	145 Å²	145	136.1 Å²	136.1	68%	0.678	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	5.7	-178	-65.9	-167.7	-32.6	0	0	114	N643	N643-Q645 PolarHBondContact O-N 2.9Å
646	V	31.7	Very low	31.3	Very low	97 Å²	97	136.4 Å²	136.4	59%	0.588	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	-14.8	171.1	-170.3	0	0	0	0	111.8	N643 Q648	N643-V646 PolarHBondContact O-N 3Å; V646-Q648 PolarHBondContact O-N 3.42Å
647	E	32.2	Very low	31.3	Very low	110 Å²	110	134.9 Å²	134.9	51%	0.514	69%	0.693	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.4	12.2	173.2	-64.7	-168.5	-165.4	0	0	114.4	I679	E647-I679 HydrophobicContact CG-CG2 4.39Å; E647-I679 WeakPolarHBondContact OE1-CG2 3.39Å
648	Q	29.2	Very low	30.8	Very low	163 Å²	163	130.8 Å²	130.8	76%	0.762	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.8	13.5	-177.7	-64.4	-169.3	-1.3	0	0	114.6	V646	V646-Q648 PolarHBondContact O-N 3.42Å
649	S	30	Very low	30.6	Very low	70 Å²	70	133.5 Å²	133.5	49%	0.49	70%	0.703	S	S	.	*	S	Bend	trans	-128.8	-7.3	-172.4	46.1	0	0	0	0	116.1
650	E	30.9	Very low	30.6	Very low	180 Å²	180	139 Å²	139	84%	0.841	72%	0.722	S	S	*	*	S	Bend	trans	-110.5	14.2	169.7	-65.1	-161.3	146.2	0	0	113.9
651	E	29.7	Very low	30.3	Very low	166 Å²	166	139.2 Å²	139.2	78%	0.776	73%	0.729	S	S	*	*	S	Bend	trans	-97.5	2.2	166.1	-140.1	167.3	-160.6	0	0	112.3
652	V	30.7	Very low	29.9	Very low	123 Å²	123	140.3 Å²	140.3	75%	0.745	73%	0.73	S	S	*	*	S	Bend	trans	-127.9	42.4	179.9	-161.7	0	0	0	0	111.7
653	K	28.8	Very low	29.8	Very low	180 Å²	180	141.4 Å²	141.4	78%	0.783	74%	0.735	S	S	*	*	S	Bend	trans	-175.3	110.4	166.8	-93.6	150.8	-177.6	178.9	0	103.4
654	E	30.7	Very low	29.8	Very low	170 Å²	170	144.1 Å²	144.1	79%	0.794	76%	0.755	S	S	*	*	S	Bend	cis	-137.7	44.1	37	-162.3	169.8	-152.1	0	0	112.9	A656	E654-A656 PolarHBondContact O-N 2.81Å
655	K	28.5	Very low	29.8	Very low	215 Å²	215	142.5 Å²	142.5	94%	0.935	75%	0.751	S	S	*	*			trans	-74.7	65.8	158.2	-81.4	-173.3	176.1	176.5	0	109.9
656	A	28.9	Very low	29.7	Very low	83 Å²	83	144.3 Å²	144.3	69%	0.686	76%	0.759	S	S	*	*			trans	-142.5	16.9	-175.9	0	0	0	0	0	113.4	E654	E654-A656 PolarHBondContact O-N 2.81Å
657	V	30.4	Very low	29.7	Very low	136 Å²	136	145 Å²	145	82%	0.824	77%	0.768	S	S	*	*	S	Bend	trans	-131.5	71.3	167	-170.3	0	0	0	0	109
658	A	26.4	Very low	29.7	Very low	92 Å²	92	143.3 Å²	143.3	76%	0.76	77%	0.774	S	S	*	*			trans	-147.8	144.5	167.1	0	0	0	0	0	108.1
659	E	27.5	Very low	29.7	Very low	202 Å²	202	143.2 Å²	143.2	94%	0.944	77%	0.773	S	S	*	*			trans	63.1	75.7	-177.6	-58.5	-162.6	113.2	0	0	117.2
660	E	29.3	Very low	29.7	Very low	185 Å²	185	145.7 Å²	145.7	86%	0.864	78%	0.781	S	S	*	*	S	Bend	trans	-138.6	114.9	131.2	-168.3	166.5	-147.1	0	0	109.9
661	T	28	Very low	29.6	Very low	129 Å²	129	142.9 Å²	142.9	79%	0.791	78%	0.776	S	S	*	*	S	Bend	trans	68.1	132.1	173	-48.9	0	0	0	0	117.8
662	L	27.4	Very low	29.7	Very low	141 Å²	141	140.7 Å²	140.7	74%	0.738	77%	0.774	S	S	*	*			cis	-167.8	150.7	-29.6	-159.5	72.1	0	0	0	108.6
663	Q	28.7	Very low	29.8	Very low	173 Å²	173	141.8 Å²	141.8	81%	0.808	78%	0.776	S	S	*	*			trans	70.6	142.6	171.4	-48.6	179.4	0.8	0	0	115.9
664	V	31	Very low	29.8	Very low	134 Å²	134	140.6 Å²	140.6	81%	0.812	78%	0.778	S	S	*	*			cis	-152.2	157.1	-6.4	117.6	0	0	0	0	108.3
665	P	33.3	Very low	30.1	Very low	98 Å²	98	137.7 Å²	137.7	64%	0.636	77%	0.774	S	S	*	*			trans	-116.9	-170.9	-144.2	44.8	-38.8	0	0	0	117.8
666	E	31	Very low	30.4	Very low	183 Å²	183	136.9 Å²	136.9	86%	0.855	77%	0.77	S	S	*	*			trans	72.2	145.8	162.4	-66.2	178.9	124.1	0	0	117.9
667	S	30.8	Very low	30.5	Very low	111 Å²	111	140.7 Å²	140.7	78%	0.776	77%	0.771	S	S	*	*			cis	-166.2	-177.7	-15.8	60.3	0	0	0	0	107.9
668	A	33.6	Very low	30.6	Very low	76 Å²	76	141.6 Å²	141.6	63%	0.628	77%	0.771	S	S	*	*			cis	-156	154.8	4.6	0	0	0	0	0	112.7
669	Q	28.5	Very low	30.6	Very low	161 Å²	161	142.3 Å²	142.3	75%	0.752	76%	0.761	S	S	*	*			trans	54.7	132	135.2	-75	-174.7	-98	0	0	126.1
670	D	30.7	Very low	30.8	Very low	121 Å²	121	139.9 Å²	139.9	65%	0.647	75%	0.754	S	S	*	*			trans	72.6	140.5	135.4	-56.5	-7.8	0	0	0	121.9
671	T	28.3	Very low	30.7	Very low	121 Å²	121	136.1 Å²	136.1	74%	0.742	74%	0.743	S	S	*	*			cis	-161.9	179.4	-18.9	25.8	0	0	0	0	110.4
672	V	30.6	Very low	30.8	Very low	121 Å²	121	136.5 Å²	136.5	73%	0.733	74%	0.739	S	S	*	*			trans	99	107.9	155	-168.3	0	0	0	0	119
673	D	33.7	Very low	30.8	Very low	146 Å²	146	134.7 Å²	134.7	78%	0.781	73%	0.727	S	S	*	*			trans	67.4	66.9	145.5	-57.6	-8.5	0	0	0	123.7
674	N	29.3	Very low	30.7	Very low	155 Å²	155	131.2 Å²	131.2	83%	0.829	71%	0.709	S	S	*	*				52.6	130.1	103.6	-150	25.1	0	0	0	121
675	P	36.8	Very low	30.8	Very low	109 Å²	109	130 Å²	130	71%	0.708	70%	0.702	S	S	*	*			trans	-108.2	-175.2	-171	43	-36.8	0	0	0	115.9
676	K	33.7	Very low	30.5	Very low	197 Å²	197	128.9 Å²	128.9	86%	0.857	69%	0.693	S	S	*	*			trans	-125.7	125	156.2	-70	-176.4	179.4	-179.2	0	107.8
677	K	31	Very low	30.7	Very low	163 Å²	163	131.5 Å²	131.5	71%	0.709	70%	0.695	S	S	*	*				53.6	110.3	82.4	-69.6	-158.9	175.7	-158.3	0	110.4
678	N	32.2	Very low	30.4	Very low	155 Å²	155	134.9 Å²	134.9	83%	0.829	69%	0.691	S	S	*	*			cis	58	132.4	28	-117	25.6	0	0	0	113.4
679	I	27.4	Very low	30.1	Very low	107 Å²	107	136.1 Å²	136.1	55%	0.549	70%	0.701	S	S	.	*			trans	73.2	107.7	-166.1	-47.6	170.9	0	0	0	114	E647	E647-I679 HydrophobicContact CG-CG2 4.39Å; E647-I679 WeakPolarHBondContact OE1-CG2 3.39Å
680	L	30.7	Very low	30.1	Very low	152 Å²	152	133.9 Å²	133.9	80%	0.796	70%	0.703	S	S	*	*				-158.5	127.3	119.5	-135.6	162.2	0	0	0	108.7
681	V	28.6	Very low	30.3	Very low	105 Å²	105	137 Å²	137	64%	0.636	71%	0.714	S	S	*	*			trans	-137.1	136.2	-172.3	164.5	0	0	0	0	109.1
682	I	28.6	Very low	30.4	Very low	137 Å²	137	139.7 Å²	139.7	70%	0.703	72%	0.718	S	S	*	*			trans	75.9	159.3	174.6	-68.2	160.8	0	0	0	115.2
683	E	27.5	Very low	30.4	Very low	103 Å²	103	139.9 Å²	139.9	48%	0.481	73%	0.725	S	S	.	*			trans	79	134.9	178	-59.3	-131.3	102.1	0	0	117.8
684	K	27.9	Very low	30.1	Very low	101 Å²	101	139.9 Å²	139.9	44%	0.439	72%	0.724	S	S	.	*			cis	-137.6	131.5	-18.8	-85.3	165.3	179.2	94.3	0	105.3	C639	C639-K684 VanDerWaalsContact CB-CE 3.49Å; C639-K684 PolarHBondContact O-NZ 2.93Å
685	V	33	Very low	30	Very low	107 Å²	107	139.4 Å²	139.4	65%	0.648	73%	0.726	S	S	*	*				59.5	133.8	73.5	-166.8	0	0	0	0	113.4
686	V	26.5	Very low	29.7	Very low	75 Å²	75	140.3 Å²	140.3	46%	0.455	73%	0.729	S	S	.	*			trans	66	94.1	-178.5	-157.9	0	0	0	0	119.6	E636	E636-V686 WeakPolarHBondContact OE1-CG2 3.48Å
687	R	34.7	Very low	29.4	Very low	239 Å²	239	139.7 Å²	139.7	90%	0.902	73%	0.729	S	S	*	*				-159.9	150.4	111.7	-99.4	160	-165	85.4	-5.2	109.5
688	R	25.9	Very low	29.3	Very low	182 Å²	182	137.5 Å²	137.5	69%	0.687	74%	0.735	S	S	*	*			trans	-123.8	154.7	-163.1	-70.2	177.1	172.6	146.6	-8.3	112.9	E630	E630-R688 IonicContact OE1-CZ 3.78Å; E630-R688 IonicContact OE1-NH2 3.35Å; E630-R688 PolarHBondContact OE1-NH2 3.21Å; E630-R688 IonicContact OE2-NH2 3.1Å; E630-R688 PolarHBondContact OE2-NH2 2.86Å
689	A	26.8	Very low	29.2	Very low	101 Å²	101	133.8 Å²	133.8	84%	0.835	73%	0.733	S	S	*	*			trans	57.1	117.7	152.8	0	0	0	0	0	120.8
690	S	29.1	Very low	29.2	Very low	114 Å²	114	137.7 Å²	137.7	80%	0.797	75%	0.749	S	S	*	*				-165.4	167.3	103.7	-162.2	0	0	0	0	111.9
691	Q	33.8	Very low	29.5	Very low	186 Å²	186	136 Å²	136	87%	0.869	75%	0.747	S	S	*	*			trans	65.4	57.1	170.2	-53.2	-166	18.3	0	0	118.3
692	Q	29.5	Very low	29.5	Very low	179 Å²	179	140.7 Å²	140.7	84%	0.836	76%	0.759	S	S	*	*			trans	-122.2	148.6	137.8	-75.8	-172.9	-8	0	0	108.7
693	S	30.8	Very low	29.5	Very low	125 Å²	125	138.2 Å²	138.2	87%	0.874	76%	0.759	S	S	*	*			trans	-124.1	96.6	168.1	48.1	0	0	0	0	110.8
694	L	28.4	Very low	29.5	Very low	145 Å²	145	139.1 Å²	139.1	76%	0.759	77%	0.772	S	S	*	*			trans	-115.7	142.2	161.6	-82.4	167	0	0	0	107.6
695	V	27.5	Very low	29.5	Very low	145 Å²	145	142.8 Å²	142.8	88%	0.879	79%	0.788	S	S	*	*			trans	-131.9	117.5	159.2	-179	0	0	0	0	107.8
696	V	30.2	Very low	29.5	Very low	128 Å²	128	142 Å²	142	78%	0.776	78%	0.776	S	S	*	*			trans	-128.5	132.1	166.7	173.2	0	0	0	0	105.2
697	E	27.9	Very low	29.8	Very low	184 Å²	184	140.5 Å²	140.5	86%	0.86	77%	0.765	S	S	*	*			trans	-154.1	152.8	161	-140.7	171	-137.6	0	0	111.4
698	S	28.2	Very low	29.7	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	75%	0.745	S	S	*	*			trans	-137.5	135.2	-171.4	53.1	0	0	0	0	110.1
699	G	30.6	Very low	30	Very low	78 Å²	78	127.6 Å²	127.6	80%	0.804	73%	0.73	S	S	*	*			trans	-164	152.2	-179	0	0	0	0	0	113.8
700	E	27.7	Very low	30.2	Very low	188 Å²	188	126.3 Å²	126.3	88%	0.879	72%	0.715	S	S	*	*			trans	-83.7	164.1	-163.1	-68.6	-164.7	127.8	0	0	116.4
701	P	36.4	Very low	30.4	Very low	116 Å²	116	124.4 Å²	124.4	75%	0.753	71%	0.706	S	S	*	*			trans	-99.5	151.4	-177.5	37.6	-34.4	0	0	0	115.2
702	K	27.9	Very low	30.1	Very low	205 Å²	205	124.7 Å²	124.7	89%	0.891	71%	0.707	S	S	*	*			trans	-162.1	115	156.8	-107.7	147	-171	164.7	0	114.8
703	A	28.7	Very low	30	Very low	85 Å²	85	120 Å²	120	70%	0.702	70%	0.699	S	S	*	*			trans	59	127.1	135.8	0	0	0	0	0	125.1
704	T	27.5	Very low	29.9	Very low	122 Å²	122	123.3 Å²	123.3	75%	0.748	70%	0.698	S	S	*	*			trans	86.2	110.5	130.7	46.2	0	0	0	0	125.9
705	F	28.9	Very low	30	Very low	178 Å²	178	121.2 Å²	121.2	78%	0.781	70%	0.695	S	S	*	*				96.1	114.9	120.6	-90.1	-149.7	0	0	0	126.3
706	K	32.1	Very low	30.1	Very low	91 Å²	91	125.6 Å²	125.6	40%	0.396	70%	0.696	S	S	.	*				90.5	147.9	120.9	-84.6	-172	144.2	-73.8	0	127.9	N1360 F1363	K706-N1360 VanDerWaalsContact C-OD1 3.22Å; K706-N1360 PolarHBondContact O-ND2 3.02Å; K706-N1360 PolarHBondContact O-OD1 3.24Å; K706-F1363 PolarHBondContact NZ-O 3.16Å
707	D	33.6	Very low	30.1	Very low	42 Å²	42	123.7 Å²	123.7	23%	0.225	69%	0.689	C	S	.	*			trans	62.2	142.6	142.9	-59.1	-12.3	0	0	0	124.5	N1360 F1363	D707-N1360 VanDerWaalsContact C-CG 3.41Å; D707-N1360 PolarHBondContact N-OD1 3.08Å; D707-N1360 VanDerWaalsContact N-OD1 3.08Å; D707-N1360 VanDerWaalsContact O-CB 3.26Å; D707-N1360 WeakPolarHBondContact O-CB 3.12Å; D707-N1360 PolarHBondContact O-ND2 3.46Å; D707-F1363 PolarHBondContact OD1-N 3.41Å; D707-F1363 VanDerWaalsContact OD1-N 3.11Å
708	N	32.9	Very low	30.3	Very low	88 Å²	88	119.7 Å²	119.7	47%	0.471	68%	0.681	S	S	.	*			cis	-147.9	147.7	18.9	-76.5	-60	0	0	0	116.4	R1361 M1362	N708-R1361 VanDerWaalsContact C-CB 3.44Å; N708-R1361 WeakPolarHBondContact O-CB 3.47Å; N708-R1361 WeakPolarHBondContact O-CG 3.33Å; N708-R1361 PolarHBondContact O-NE 3.11Å; N708-R1361 PolarHBondContact O-NH2 2.97Å; N708-M1362 HydrophobicContact CB-CE 4.44Å; N708-M1362 HydrophobicContact CB-CG 3.91Å; N708-M1362 WeakPolarHBondContact OD1-CG 3.42Å
709	V	32	Very low	30.6	Very low	62 Å²	62	121.7 Å²	121.7	38%	0.376	68%	0.677	S	S	.	*			trans	-72.3	164.4	-161.1	73	0	0	0	0	121	R1361 M1362 F1363	V709-R1361 VanDerWaalsContact C-NH2 3.29Å; V709-R1361 VanDerWaalsContact CA-CB 3.47Å; V709-R1361 HydrophobicContact CB-CB 4.4Å; V709-R1361 PolarHBondContact O-NH2 3.03Å; V709-M1362 HydrophobicContact CB-CB 3.76Å; V709-M1362 HydrophobicContact CG1-CB 4.04Å; V709-M1362 HydrophobicContact CG1-CE 4.45Å; V709-M1362 HydrophobicContact CG1-SD 4.47Å; V709-F1363 HydrophobicContact CG1-CE2 4.29Å
710	S	31.2	Very low	30.6	Very low	74 Å²	74	124.8 Å²	124.8	52%	0.517	68%	0.675	S	S	.	*			trans	81.4	160.3	153.7	-72.9	0	0	0	0	121.8	R1361	S710-R1361 PolarHBondContact O-NH1 3.17Å; S710-R1361 PolarHBondContact O-NH2 2.95Å
711	A	32	Very low	30.9	Very low	74 Å²	74	123.8 Å²	123.8	61%	0.612	67%	0.671	S	S	*	*			cis	-179.5	166.9	-28.2	0	0	0	0	0	109
712	E	27.9	Very low	30.7	Very low	192 Å²	192	126 Å²	126	90%	0.897	67%	0.671	S	S	*	*			trans	60.6	167.5	159	-72.7	-177.1	122.7	0	0	118.4
713	A	27.9	Very low	31	Very low	80 Å²	80	121.8 Å²	121.8	66%	0.661	66%	0.662	S	S	*	*			cis	-160.9	162.8	-30.3	0	0	0	0	0	112
714	K	29.2	Very low	31.1	Very low	195 Å²	195	125.2 Å²	125.2	85%	0.848	67%	0.669	S	S	*	*			trans	42.1	114.7	150.8	-70.2	176.9	179.1	171.9	0	123
715	S	29.6	Very low	31.2	Very low	101 Å²	101	123.1 Å²	123.1	71%	0.706	66%	0.664	S	S	*	*				79.6	146.2	119.4	77.4	0	0	0	0	123.9
716	R	29.7	Very low	31.3	Very low	237 Å²	237	119.8 Å²	119.8	89%	0.894	66%	0.663	S	S	*	*			trans	70.1	152.4	159	-71.5	179.3	175.6	177.2	-3.5	117.6
717	S	29.7	Very low	31.4	Very low	89 Å²	89	124.9 Å²	124.9	62%	0.622	69%	0.685	S	S	*	*			cis	-171	152.1	-19.2	48.3	0	0	0	0	111.5
718	S	32.3	Very low	31.1	Very low	99 Å²	99	133 Å²	133	69%	0.692	72%	0.718	S	S	*	*			trans	56.5	175.6	149.6	60.3	0	0	0	0	117.6
719	E	34.3	Very low	30.7	Very low	160 Å²	160	133.4 Å²	133.4	75%	0.748	73%	0.733	S	S	*	*			cis	-140.7	143.5	8.1	-74.1	172.8	169.2	0	0	110.9
720	D	32.1	Very low	30.5	Very low	143 Å²	143	137 Å²	137	77%	0.765	76%	0.756	S	S	*	*			trans	53.3	166.5	135.6	-48	-30	0	0	0	121.8
721	E	34.1	Very low	30.4	Very low	167 Å²	167	139.6 Å²	139.6	78%	0.78	77%	0.771	S	S	*	*			cis	-154	161.4	14.7	-156.4	172.7	-138.7	0	0	112.6
722	E	31.5	Very low	30.1	Very low	162 Å²	162	141 Å²	141	76%	0.757	78%	0.777	S	S	*	*			trans	22.7	164.7	156.4	-75.1	-166.5	159	0	0	125.6
723	T	33.5	Very low	30.2	Very low	116 Å²	116	140 Å²	140	71%	0.712	77%	0.772	S	S	*	*			cis	-145.9	138.1	8.8	-11.7	0	0	0	0	114.4
724	D	30.4	Very low	30.2	Very low	158 Å²	158	145.2 Å²	145.2	85%	0.845	78%	0.782	S	S	*	*			trans	35.2	159.5	143.4	-153	23.8	0	0	0	126.4
725	A	31.1	Very low	30.1	Very low	77 Å²	77	143.6 Å²	143.6	64%	0.636	78%	0.778	S	S	*	*			trans	112.3	84.2	144.9	0	0	0	0	0	120.7
726	S	29.9	Very low	30.2	Very low	108 Å²	108	147.6 Å²	147.6	76%	0.755	78%	0.782	S	S	*	*			trans	88.6	126.3	136.2	-80	0	0	0	0	124.2
727	K	34.2	Very low	30.6	Very low	198 Å²	198	141.1 Å²	141.1	86%	0.861	77%	0.773	S	S	*	*			trans	77.4	95.7	148.8	-66.4	174.2	-176.6	174.2	0	119.2
728	K	27	Very low	31.8	Very low	214 Å²	214	139.7 Å²	139.7	93%	0.93	76%	0.756	S	S	*	*			trans	-51.9	125.3	173.4	-70.3	176.7	172.8	177.6	0	115.2
729	A	26.5	Very low	33.3	Very low	95 Å²	95	136.5 Å²	136.5	79%	0.785	74%	0.74	S	S	*	*			trans	-154.1	125.8	133	0	0	0	0	0	108.1	P731	A729-P731 WeakPolarHBondContact O-CD 3.47Å
730	T	26.9	Very low	35.5	Very low	138 Å²	138	129 Å²	129	85%	0.847	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-97.2	119.1	-171.4	45.5	0	0	0	0	112.7
731	P	28.9	Very low	38	Very low	128 Å²	128	127.7 Å²	127.7	83%	0.831	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-72.8	152.8	169	-14.2	30.8	0	0	0	112	A729	A729-P731 WeakPolarHBondContact O-CD 3.47Å
732	S	26.6	Very low	40.6	Very low	105 Å²	105	119.9 Å²	119.9	73%	0.734	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-71.5	139.7	-169.7	42.9	0	0	0	0	115.1
733	Q	28.4	Very low	43.3	Very low	170 Å²	170	116.8 Å²	116.8	79%	0.794	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-77.8	135	154.8	-71.5	-176.9	-16.8	0	0	109.4	Q735	Q733-Q735 PolarHBondContact O-N 2.86Å
734	H	27.9	Very low	45.9	Very low	189 Å²	189	111.3 Å²	111.3	88%	0.875	61%	0.606	S	S	*	*			trans	-75.4	100.6	166.3	-79.2	-6.9	0	0	0	110.2
735	Q	28.9	Very low	48.5	Very low	162 Å²	162	107 Å²	107	76%	0.757	58%	0.582	S	S	*	*			trans	-76.5	145.7	165.7	-71	-174.6	-16.4	0	0	110.6	Q733	Q733-Q735 PolarHBondContact O-N 2.86Å
736	K	31	Very low	51	Low	185 Å²	185	109.3 Å²	109.3	80%	0.804	57%	0.574	S	S	*	*			trans	-73.5	142.9	172.9	-70.7	178.4	177.2	176	0	109.6	H738	K736-H738 PolarHBondContact O-CD2 2.89Å; K736-H738 VanDerWaalsContact O-CD2 3.24Å; K736-H738 PolarHBondContact O-N 2.86Å
737	S	38.4	Very low	53.5	Low	101 Å²	101	105.9 Å²	105.9	71%	0.706	55%	0.548	S	S	*	.			trans	-60.6	115.8	177.3	47	0	0	0	0	111.7	G739	S737-G739 PolarHBondContact O-N 2.85Å
738	H	54	Low	55.5	Low	58 Å²	58	98.8 Å²	98.8	27%	0.269	52%	0.518	S	S	.	.			trans	-80.1	39.7	-177.7	-85.8	-89.3	0	0	0	112.9	K736 M740 L799	K736-H738 PolarHBondContact O-CD2 2.89Å; K736-H738 VanDerWaalsContact O-CD2 3.24Å; K736-H738 PolarHBondContact O-N 2.86Å; H738-M740 WeakPolarHBondContact O-CB 3.39Å; H738-M740 PolarHBondContact O-N 2.87Å; H738-L799 HydrophobicContact CB-CD1 4.26Å
739	G	63.2	Low	57.4	Low	33 Å²	33	92.5 Å²	92.5	34%	0.34	50%	0.502	S	S	.	.			trans	-28.5	89.5	-163.4	0	0	0	0	0	116.2	S737	S737-G739 PolarHBondContact O-N 2.85Å
740	M	80.6	Confident	58.7	Low	1 Å²	1	89.7 Å²	89.7	1%	0.005	48%	0.482	C	S	.	.			trans	-134.9	134.4	-179.5	-173.7	177.8	79.9	0	0	109.2	H738 L761 E762 T763 I792 Q796 L799 C800	H738-M740 WeakPolarHBondContact O-CB 3.39Å; H738-M740 PolarHBondContact O-N 2.87Å; M740-L761 HydrophobicContact CE-CD1 4.27Å; M740-L761 HydrophobicContact CG-CD1 3.69Å; M740-L761 HydrophobicContact CG-CG 4.46Å; M740-L761 HydrophobicContact SD-CD1 3.88Å; M740-E762 CarbonylContact C-O 3.38Å; M740-E762 VanDerWaalsContact CA-O 3.3Å; M740-E762 WeakPolarHBondContact CA-O 3.32Å; M740-T763 HydrophobicContact CG-CG2 4.22Å; M740-T763 HydrophobicContact SD-CG2 4.4Å; M740-I792 HydrophobicContact SD-CG2 3.99Å; M740-Q796 HydrophobicContact SD-CB 4.02Å; M740-Q796 HydrophobicContact SD-CG 4.23Å; M740-L799 HydrophobicContact CE-CB 3.86Å; M740-C800 HydrophobicContact CE-CB 3.87Å
741	K	84.8	Confident	59.7	Low	117 Å²	117	95.7 Å²	95.7	51%	0.509	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	130.2	-175.1	-62	179.6	-177.9	178.2	0	111.1	L761 E762 M823	K741-L761 WeakPolarHBondContact O-CA 3.35Å; K741-E762 HydrophobicContact CB-CB 4.45Å; K741-E762 PolarHBondContact N-O 2.72Å; K741-E762 PolarHBondContact O-N 3.23Å; K741-M823 WeakPolarHBondContact CA-O 3.3Å
742	L	89.2	Confident	61	Low	2 Å²	2	99.8 Å²	99.8	1%	0.01	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	126.5	171.7	-171.9	71.1	0	0	0	109.6	C759 L761 F770 Q803 L804 V807 M823	L742-C759 HydrophobicContact CD1-CB 3.94Å; L742-L761 HydrophobicContact CB-CD1 4.48Å; L742-L761 HydrophobicContact CD1-CB 4.27Å; L742-L761 HydrophobicContact CD1-CD1 4.15Å; L742-F770 HydrophobicContact CD1-CE1 3.87Å; L742-F770 HydrophobicContact CD1-CZ 3.84Å; L742-Q803 HydrophobicContact CB-CB 4.3Å; L742-Q803 HydrophobicContact CD2-CB 3.81Å; L742-L804 HydrophobicContact CD2-CD2 4.31Å; L742-L804 HydrophobicContact CD2-CG 4.33Å; L742-V807 HydrophobicContact CD2-CG2 3.83Å; L742-M823 PolarHBondContact N-O 3.14Å; L742-M823 PolarHBondContact O-N 3.28Å
743	K	88.8	Confident	62.5	Low	97 Å²	97	98 Å²	98	42%	0.422	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	125	178.7	-172.1	173.3	-177.5	176.7	0	111	I745 C759 R760 L821 L822	K743-I745 PolarHBondContact O-N 2.87Å; K743-C759 CarbonylContact O-C 3.54Å; K743-C759 WeakPolarHBondContact O-CA 3.45Å; K743-R760 PolarHBondContact N-O 3.39Å; K743-R760 PolarHBondContact O-N 3.29Å; K743-L821 WeakPolarHBondContact CA-O 3.42Å; K743-L822 HydrophobicContact CB-CD1 3.78Å; K743-L822 HydrophobicContact CD-CD1 3.9Å; K743-L822 HydrophobicContact CG-CD1 3.77Å
744	V	87.6	Confident	64.4	Low	2 Å²	2	93 Å²	93	1%	0.012	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	118.7	170.3	177.9	0	0	0	0	109	V757 V807 I818 G820 L821	V744-V757 HydrophobicContact CG1-CG1 3.75Å; V744-V757 HydrophobicContact CG2-CG1 4.26Å; V744-V807 HydrophobicContact CG2-CG1 4.04Å; V744-V807 HydrophobicContact CG2-CG2 3.94Å; V744-I818 WeakPolarHBondContact CB-O 3.47Å; V744-I818 HydrophobicContact CG1-CB 4.49Å; V744-I818 VanDerWaalsContact CG1-O 3.27Å; V744-I818 WeakPolarHBondContact CG1-O 3.39Å; V744-G820 WeakPolarHBondContact O-CA 3.34Å; V744-G820 PolarHBondContact O-N 2.68Å; V744-L821 HydrophobicContact CB-CB 4.1Å; V744-L821 HydrophobicContact CG2-CB 3.97Å; V744-L821 HydrophobicContact CG2-CD2 4.37Å; V744-L821 PolarHBondContact N-O 2.78Å
745	I	84.5	Confident	66.6	Low	67 Å²	67	85.1 Å²	85.1	34%	0.344	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-51.4	177.4	-58.4	171.4	0	0	0	110	K743 S758 R760 T769 S819	K743-I745 PolarHBondContact O-N 2.87Å; I745-S758 WeakPolarHBondContact CB-O 3.44Å; I745-S758 PolarHBondContact N-O 3.39Å; I745-R760 HydrophobicContact CD1-CB 4.04Å; I745-R760 HydrophobicContact CG1-CB 4.24Å; I745-T769 HydrophobicContact CD1-CG2 3.6Å; I745-S819 PolarHBondContact O-OG 3.25Å
746	R	84.8	Confident	69.3	Low	125 Å²	125	79.3 Å²	79.3	47%	0.472	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	156.4	-177.8	65.2	178	-171.9	144.2	6.8	112.8	I748 S758	R746-I748 HydrophobicContact CG-CG1 4.23Å; R746-I748 VanDerWaalsContact NH2-CD1 3.25Å; R746-S758 PolarHBondContact N-O 2.9Å; R746-S758 PolarHBondContact O-N 3.15Å
747	L	82.4	Confident	71.9	Confident	37 Å²	37	70.5 Å²	70.5	19%	0.194	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	151.9	158.4	-164.3	66.8	0	0	0	110.6	S749 P755 V757 V811 P815 I818	L747-S749 WeakPolarHBondContact CD2-OG 3.39Å; L747-P755 HydrophobicContact CD1-CB 3.93Å; L747-P755 HydrophobicContact CG-CB 4.47Å; L747-V757 HydrophobicContact CD1-CG2 3.68Å; L747-V811 HydrophobicContact CD1-CG1 4.42Å; L747-P815 HydrophobicContact CD2-CB 4.07Å; L747-P815 WeakPolarHBondContact CD2-O 3Å; L747-I818 HydrophobicContact CD1-CD1 4.02Å; L747-I818 HydrophobicContact CD2-CD1 4.49Å
748	I	75.1	Confident	74.3	Confident	48 Å²	48	66 Å²	66	25%	0.246	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	84.7	173	-47.4	168.6	0	0	0	107.5	R746 V756 Q771	R746-I748 HydrophobicContact CG-CG1 4.23Å; R746-I748 VanDerWaalsContact NH2-CD1 3.25Å; I748-V756 WeakPolarHBondContact CA-O 3.28Å; I748-V756 HydrophobicContact CB-CB 4.23Å; I748-V756 VanDerWaalsContact CB-O 3.3Å; I748-V756 WeakPolarHBondContact CB-O 3.28Å; I748-V756 HydrophobicContact CD1-CG1 4.48Å; I748-V756 WeakPolarHBondContact CG1-O 3.32Å; I748-V756 PolarHBondContact N-O 3.43Å; I748-V756 PolarHBondContact O-N 3.21Å; I748-Q771 HydrophobicContact CD1-CG 4.42Å
749	S	67.2	Low	76	Confident	83 Å²	83	63.2 Å²	63.2	58%	0.58	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	140.3	171.8	-66.8	0	0	0	0	110.7	L747	L747-S749 WeakPolarHBondContact CD2-OG 3.39Å
750	G	54.5	Low	77.2	Confident	35 Å²	35	63.6 Å²	63.6	36%	0.361	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.9	174.9	0	0	0	0	0	110.5	K752 S753	G750-K752 PolarHBondContact O-N 2.93Å; G750-S753 PolarHBondContact O-N 2.9Å; G750-S753 VanDerWaalsContact O-N 3.1Å
751	R	47.6	Very low	77.7	Confident	264 Å²	264	63.6 Å²	63.6	100%	0.996	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-4.8	-173.7	-65.7	-170.6	-177.7	-176.3	1.9	115.8
752	K	54.9	Low	77.6	Confident	215 Å²	215	60.9 Å²	60.9	94%	0.935	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.7	21.7	178.8	-63	-169.3	176.8	-174.7	0	113.4	G750	G750-K752 PolarHBondContact O-N 2.93Å
753	S	58.2	Low	77.3	Confident	68 Å²	68	61.9 Å²	61.9	48%	0.476	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	146.5	-176.1	59.1	0	0	0	0	111.7	G750	G750-S753 PolarHBondContact O-N 2.9Å; G750-S753 VanDerWaalsContact O-N 3.1Å
754	P	68.4	Low	76.3	Confident	64 Å²	64	64.2 Å²	64.2	42%	0.416	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	151.1	174.4	26.1	-34.7	0	0	0	111.2	V756	P754-V756 PolarHBondContact O-N 2.67Å
755	P	75.2	Confident	75.1	Confident	23 Å²	23	73 Å²	73	15%	0.149	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	131.8	177.3	25.8	-33.3	0	0	0	110.6	L747 A773 P774 L775 V811	L747-P755 HydrophobicContact CD1-CB 3.93Å; L747-P755 HydrophobicContact CG-CB 4.47Å; P755-A773 WeakPolarHBondContact O-CA 3.13Å; P755-P774 WeakPolarHBondContact O-CD 3.43Å; P755-L775 HydrophobicContact CG-CD1 3.82Å; P755-L775 HydrophobicContact CG-CG 4.19Å; P755-V811 HydrophobicContact CG-CG1 4.35Å
756	V	84.4	Confident	74.6	Confident	40 Å²	40	73 Å²	73	24%	0.242	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	123.1	173.4	-177.6	0	0	0	0	109	I748 P754 Q771 F772 A773	I748-V756 WeakPolarHBondContact CA-O 3.28Å; I748-V756 HydrophobicContact CB-CB 4.23Å; I748-V756 VanDerWaalsContact CB-O 3.3Å; I748-V756 WeakPolarHBondContact CB-O 3.28Å; I748-V756 HydrophobicContact CD1-CG1 4.48Å; I748-V756 WeakPolarHBondContact CG1-O 3.32Å; I748-V756 PolarHBondContact N-O 3.43Å; I748-V756 PolarHBondContact O-N 3.21Å; P754-V756 PolarHBondContact O-N 2.67Å; V756-Q771 HydrophobicContact CG1-CB 3.8Å; V756-Q771 HydrophobicContact CG1-CG 4.18Å; V756-F772 CarbonylContact C-O 3.55Å; V756-F772 WeakPolarHBondContact CA-O 3.29Å; V756-A773 HydrophobicContact CG2-CB 4.26Å
757	V	86.3	Confident	74.4	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	134.7	174.9	-177.8	0	0	0	0	109.2	V744 L747 Q771 F772 P774 V807 V811	V744-V757 HydrophobicContact CG1-CG1 3.75Å; V744-V757 HydrophobicContact CG2-CG1 4.26Å; L747-V757 HydrophobicContact CD1-CG2 3.68Å; V757-Q771 VanDerWaalsContact O-CA 3.26Å; V757-Q771 WeakPolarHBondContact O-CA 3.49Å; V757-F772 HydrophobicContact CB-CD1 4.24Å; V757-F772 HydrophobicContact CB-CE1 3.91Å; V757-F772 HydrophobicContact CG1-CE1 4.2Å; V757-F772 PolarHBondContact N-O 3.43Å; V757-F772 PolarHBondContact O-N 3.48Å; V757-P774 HydrophobicContact CG2-CG 3.71Å; V757-V807 HydrophobicContact CG1-CG1 4.05Å; V757-V807 HydrophobicContact CG2-CG1 4.4Å; V757-V811 HydrophobicContact CG2-CG2 3.66Å
758	S	88.1	Confident	74.4	Confident	6 Å²	6	67.7 Å²	67.7	4%	0.042	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122.3	170.2	-156.6	0	0	0	0	109.5	I745 R746 F770 Q771	I745-S758 WeakPolarHBondContact CB-O 3.44Å; I745-S758 PolarHBondContact N-O 3.39Å; R746-S758 PolarHBondContact N-O 2.9Å; R746-S758 PolarHBondContact O-N 3.15Å; S758-F770 CarbonylContact C-O 3.58Å; S758-F770 WeakPolarHBondContact CA-O 3.41Å; S758-Q771 WeakPolarHBondContact OG-CG 3.46Å; S758-Q771 PolarHBondContact OG-NE2 3.33Å
759	C	89.9	Confident	74.9	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	155.3	-178.2	-73.5	0	0	0	0	111.9	L742 K743 T769 F770	L742-C759 HydrophobicContact CD1-CB 3.94Å; K743-C759 CarbonylContact O-C 3.54Å; K743-C759 WeakPolarHBondContact O-CA 3.45Å; C759-T769 WeakPolarHBondContact O-CA 3.41Å; C759-F770 HydrophobicContact CB-CD1 4.06Å; C759-F770 HydrophobicContact CB-CE1 3.52Å; C759-F770 HydrophobicContact CB-CE2 4.05Å; C759-F770 HydrophobicContact CB-CZ 3.53Å; C759-F770 PolarHBondContact N-O 3.31Å; C759-F770 PolarHBondContact O-N 3.49Å
760	R	89.9	Confident	75.9	Confident	42 Å²	42	65.2 Å²	65.2	16%	0.158	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.4	166.7	168.7	161	154.6	-178.5	-11.9	108.8	K743 I745 E762 T767 I768 D847	K743-R760 PolarHBondContact N-O 3.39Å; K743-R760 PolarHBondContact O-N 3.29Å; I745-R760 HydrophobicContact CD1-CB 4.04Å; I745-R760 HydrophobicContact CG1-CB 4.24Å; R760-E762 HydrophobicContact CG-CG 4.2Å; R760-E762 IonicContact CZ-OE1 2.83Å; R760-E762 IonicContact NE-OE1 3.75Å; R760-E762 PolarHBondContact NE-OE1 3.24Å; R760-E762 IonicContact NH2-OE1 2.85Å; R760-E762 PolarHBondContact NH2-OE1 3.23Å; R760-T767 HydrophobicContact CG-CG2 3.78Å; R760-I768 CarbonylContact C-O 3.57Å; R760-I768 WeakPolarHBondContact CA-O 3.39Å; R760-D847 IonicContact CZ-OD2 3.19Å; R760-D847 VanDerWaalsContact CZ-OD2 3.26Å; R760-D847 IonicContact NH1-OD2 2.81Å; R760-D847 PolarHBondContact NH1-OD2 2.74Å; R760-D847 IonicContact NH2-OD2 2.75Å; R760-D847 PolarHBondContact NH2-OD2 2.75Å
761	L	89.2	Confident	77.6	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	123.5	173.1	-177.3	68.1	0	0	0	108.4	M740 K741 L742 T763 T767 I768 F770 F786 I792	M740-L761 HydrophobicContact CE-CD1 4.27Å; M740-L761 HydrophobicContact CG-CD1 3.69Å; M740-L761 HydrophobicContact CG-CG 4.46Å; M740-L761 HydrophobicContact SD-CD1 3.88Å; K741-L761 WeakPolarHBondContact O-CA 3.35Å; L742-L761 HydrophobicContact CB-CD1 4.48Å; L742-L761 HydrophobicContact CD1-CB 4.27Å; L742-L761 HydrophobicContact CD1-CD1 4.15Å; L761-T763 HydrophobicContact CG-CG2 4.37Å; L761-T767 CarbonylContact O-C 3.57Å; L761-T767 WeakPolarHBondContact O-CA 3.46Å; L761-I768 HydrophobicContact CB-CB 4.47Å; L761-I768 HydrophobicContact CD2-CD1 4.49Å; L761-I768 PolarHBondContact N-O 2.81Å; L761-I768 PolarHBondContact O-N 3.17Å; L761-F770 HydrophobicContact CB-CE1 4.09Å; L761-F786 HydrophobicContact CD2-CD2 4.01Å; L761-F786 HydrophobicContact CD2-CE2 4.04Å; L761-I792 HydrophobicContact CD2-CG2 3.86Å
762	E	83.1	Confident	79.7	Confident	61 Å²	61	56 Å²	56	29%	0.285	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	122	174.4	-68.7	176.3	173.5	0	0	108.8	M740 K741 R760 T767	M740-E762 CarbonylContact C-O 3.38Å; M740-E762 VanDerWaalsContact CA-O 3.3Å; M740-E762 WeakPolarHBondContact CA-O 3.32Å; K741-E762 HydrophobicContact CB-CB 4.45Å; K741-E762 PolarHBondContact N-O 2.72Å; K741-E762 PolarHBondContact O-N 3.23Å; R760-E762 HydrophobicContact CG-CG 4.2Å; R760-E762 IonicContact CZ-OE1 2.83Å; R760-E762 IonicContact NE-OE1 3.75Å; R760-E762 PolarHBondContact NE-OE1 3.24Å; R760-E762 IonicContact NH2-OE1 2.85Å; R760-E762 PolarHBondContact NH2-OE1 3.23Å; E762-T767 HydrophobicContact CG-CG2 4.04Å
763	T	82.5	Confident	81.2	Confident	23 Å²	23	46.2 Å²	46.2	14%	0.141	24%	0.237	C	C	.	.			trans	-113.3	170.8	171.1	77.8	0	0	0	0	109.7	M740 L761 K765 R766 I792	M740-T763 HydrophobicContact CG-CG2 4.22Å; M740-T763 HydrophobicContact SD-CG2 4.4Å; L761-T763 HydrophobicContact CG-CG2 4.37Å; T763-K765 PolarHBondContact O-N 2.72Å; T763-K765 PolarHBondContact OG1-N 2.66Å; T763-R766 PolarHBondContact N-O 2.79Å; T763-R766 PolarHBondContact OG1-N 2.96Å; T763-R766 VanDerWaalsContact OG1-N 3.1Å; T763-R766 PolarHBondContact OG1-O 2.9Å; T763-I792 HydrophobicContact CG2-CG2 4.01Å
764	Q	69	Low	82.5	Confident	146 Å²	146	43.5 Å²	43.5	68%	0.682	22%	0.217	S	C	*	.	S	Bend	trans	-57.3	-13.2	174.7	-61.5	-177.8	2.5	0	0	114.7
765	K	63	Low	82.9	Confident	185 Å²	185	45.3 Å²	45.3	80%	0.804	22%	0.223	S	C	*	.	S	Bend	trans	-124.1	-27.3	-176.4	-64.1	-174.9	179.7	-178	0	114.9	T763	T763-K765 PolarHBondContact O-N 2.72Å; T763-K765 PolarHBondContact OG1-N 2.66Å
766	R	73.8	Confident	83.2	Confident	69 Å²	69	48.9 Å²	48.9	26%	0.26	24%	0.244	S	C	.	.			trans	-145.2	147.2	-169.6	-70.1	-179	168	171.5	-12.9	111.6	T763 I768 S790 E948	T763-R766 PolarHBondContact N-O 2.79Å; T763-R766 PolarHBondContact OG1-N 2.96Å; T763-R766 VanDerWaalsContact OG1-N 3.1Å; T763-R766 PolarHBondContact OG1-O 2.9Å; R766-I768 HydrophobicContact CB-CD1 4.32Å; R766-I768 HydrophobicContact CB-CG1 4.44Å; R766-S790 PolarHBondContact NH1-O 3.18Å; R766-E948 IonicContact NH2-OE1 2.68Å
767	T	79.3	Confident	83.3	Confident	48 Å²	48	48.4 Å²	48.4	29%	0.294	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130	166.9	-61.7	0	0	0	0	108.4	R760 L761 E762	R760-T767 HydrophobicContact CG-CG2 3.78Å; L761-T767 CarbonylContact O-C 3.57Å; L761-T767 WeakPolarHBondContact O-CA 3.46Å; E762-T767 HydrophobicContact CG-CG2 4.04Å
768	I	82.3	Confident	83.3	Confident	1 Å²	1	52 Å²	52	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	117.6	-170.9	-62.7	145.3	0	0	0	109.5	R760 L761 R766 F786 F791 V944	R760-I768 CarbonylContact C-O 3.57Å; R760-I768 WeakPolarHBondContact CA-O 3.39Å; L761-I768 HydrophobicContact CB-CB 4.47Å; L761-I768 HydrophobicContact CD2-CD1 4.49Å; L761-I768 PolarHBondContact N-O 2.81Å; L761-I768 PolarHBondContact O-N 3.17Å; R766-I768 HydrophobicContact CB-CD1 4.32Å; R766-I768 HydrophobicContact CB-CG1 4.44Å; I768-F786 HydrophobicContact CG2-CE1 4.45Å; I768-F791 HydrophobicContact CD1-CB 3.5Å; I768-F791 VanDerWaalsContact CD1-CB 3.5Å; I768-F791 HydrophobicContact CD1-CD1 3.75Å; I768-F791 HydrophobicContact CD1-CD2 4.4Å; I768-F791 HydrophobicContact CD1-CG 3.62Å; I768-F791 HydrophobicContact CG1-CD1 4.13Å; I768-F791 HydrophobicContact CG1-CG 4.3Å; I768-V944 HydrophobicContact CG2-CG1 4.12Å
769	T	85.3	Confident	83.3	Confident	54 Å²	54	52.5 Å²	52.5	33%	0.331	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	125.1	175.1	-51.8	0	0	0	0	109.9	I745 C759	I745-T769 HydrophobicContact CD1-CG2 3.6Å; C759-T769 WeakPolarHBondContact O-CA 3.41Å
770	F	89.2	Confident	83.1	Confident	25 Å²	25	59.6 Å²	59.6	11%	0.11	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	171.1	-175.8	69.5	-80.1	0	0	0	112.3	L742 S758 C759 L761 F772 I782 F786 L804	L742-F770 HydrophobicContact CD1-CE1 3.87Å; L742-F770 HydrophobicContact CD1-CZ 3.84Å; S758-F770 CarbonylContact C-O 3.58Å; S758-F770 WeakPolarHBondContact CA-O 3.41Å; C759-F770 HydrophobicContact CB-CD1 4.06Å; C759-F770 HydrophobicContact CB-CE1 3.52Å; C759-F770 HydrophobicContact CB-CE2 4.05Å; C759-F770 HydrophobicContact CB-CZ 3.53Å; C759-F770 PolarHBondContact N-O 3.31Å; C759-F770 PolarHBondContact O-N 3.49Å; L761-F770 HydrophobicContact CB-CE1 4.09Å; F770-F772 HydrophobicContact CE2-CD1 4.05Å; F770-I782 HydrophobicContact CE2-CG2 4.14Å; F770-F786 HydrophobicContact CB-CZ 4.35Å; F770-F786 HydrophobicContact CD1-CE2 4.39Å; F770-F786 AromaticContact CD1-CZ 3.72Å; F770-F786 HydrophobicContact CD1-CZ 3.72Å; F770-F786 AromaticContact CD2-CZ 3.86Å; F770-F786 HydrophobicContact CD2-CZ 3.86Å; F770-F786 HydrophobicContact CE1-CE2 4.05Å; F770-F786 AromaticContact CE1-CZ 3.83Å; F770-F786 HydrophobicContact CE1-CZ 3.83Å; F770-F786 HydrophobicContact CE2-CE2 4.31Å; F770-F786 AromaticContact CE2-CZ 3.96Å; F770-F786 HydrophobicContact CE2-CZ 3.96Å; F770-F786 AromaticContact CG-CZ 3.73Å; F770-F786 HydrophobicContact CG-CZ 3.73Å; F770-F786 AromaticContact CZ-CE2 3.99Å; F770-F786 HydrophobicContact CZ-CE2 3.99Å; F770-F786 AromaticContact CZ-CZ 3.93Å; F770-F786 HydrophobicContact CZ-CZ 3.93Å; F770-L804 HydrophobicContact CE2-CD2 3.92Å; F770-L804 HydrophobicContact CZ-CD2 3.93Å
771	Q	89.9	Confident	82.9	Confident	105 Å²	105	63.7 Å²	63.7	49%	0.491	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	140.9	176.8	-81.6	167.6	29.3	0	0	110.2	I748 V756 V757 S758	I748-Q771 HydrophobicContact CD1-CG 4.42Å; V756-Q771 HydrophobicContact CG1-CB 3.8Å; V756-Q771 HydrophobicContact CG1-CG 4.18Å; V757-Q771 VanDerWaalsContact O-CA 3.26Å; V757-Q771 WeakPolarHBondContact O-CA 3.49Å; S758-Q771 WeakPolarHBondContact OG-CG 3.46Å; S758-Q771 PolarHBondContact OG-NE2 3.33Å
772	F	92.1	Very high	82.9	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.009	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	152.8	173.2	80.4	-68.6	0	0	0	110.6	V756 V757 F770 P774 D777 I782 L804 V807 F939	V756-F772 CarbonylContact C-O 3.55Å; V756-F772 WeakPolarHBondContact CA-O 3.29Å; V757-F772 HydrophobicContact CB-CD1 4.24Å; V757-F772 HydrophobicContact CB-CE1 3.91Å; V757-F772 HydrophobicContact CG1-CE1 4.2Å; V757-F772 PolarHBondContact N-O 3.43Å; V757-F772 PolarHBondContact O-N 3.48Å; F770-F772 HydrophobicContact CE2-CD1 4.05Å; F772-P774 HydrophobicContact CD2-CB 4.42Å; F772-P774 HydrophobicContact CE2-CB 3.78Å; F772-P774 HydrophobicContact CZ-CB 4.23Å; F772-P774 WeakPolarHBondContact O-CD 3.2Å; F772-D777 WeakPolarHBondContact CA-OD2 3.48Å; F772-D777 HydrophobicContact CB-CB 4.28Å; F772-D777 HydrophobicContact CD2-CB 4.18Å; F772-I782 HydrophobicContact CB-CD1 3.82Å; F772-I782 HydrophobicContact CD2-CD1 3.66Å; F772-I782 HydrophobicContact CE2-CD1 4.39Å; F772-I782 HydrophobicContact CG-CD1 3.84Å; F772-L804 HydrophobicContact CD1-CD2 4.11Å; F772-L804 HydrophobicContact CE1-CD2 3.65Å; F772-L804 HydrophobicContact CE2-CD2 4.11Å; F772-L804 HydrophobicContact CZ-CD2 3.64Å; F772-V807 HydrophobicContact CE1-CG1 4.05Å; F772-V807 HydrophobicContact CZ-CB 4.08Å; F772-V807 HydrophobicContact CZ-CG1 3.74Å; F772-F939 HydrophobicContact CB-CE1 4.19Å; F772-F939 HydrophobicContact CB-CZ 3.92Å
773	A	87.2	Confident	83.1	Confident	9 Å²	9	61.4 Å²	61.4	7%	0.074	30%	0.299	C	S	.	.			trans	-100.4	92.1	178.5	0	0	0	0	0	110.3	P755 V756 L775 T776 D777	P755-A773 WeakPolarHBondContact O-CA 3.13Å; V756-A773 HydrophobicContact CG2-CB 4.26Å; A773-L775 PolarHBondContact O-N 2.87Å; A773-T776 VanDerWaalsContact CB-OG1 3.25Å; A773-T776 WeakPolarHBondContact CB-OG1 2.97Å; A773-T776 PolarHBondContact O-N 2.85Å; A773-T776 PolarHBondContact O-OG1 3.19Å; A773-D777 PolarHBondContact N-OD2 3.45Å; A773-D777 VanDerWaalsContact O-CB 3.23Å; A773-D777 WeakPolarHBondContact O-CB 3.38Å; A773-D777 PolarHBondContact O-N 3.49Å
774	P	84.3	Confident	83.2	Confident	11 Å²	11	64.5 Å²	64.5	7%	0.071	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-5	-170.3	22.9	-38.6	0	0	0	117.4	P755 V757 F772 A808 V811	P755-P774 WeakPolarHBondContact O-CD 3.43Å; V757-P774 HydrophobicContact CG2-CG 3.71Å; F772-P774 HydrophobicContact CD2-CB 4.42Å; F772-P774 HydrophobicContact CE2-CB 3.78Å; F772-P774 HydrophobicContact CZ-CB 4.23Å; F772-P774 WeakPolarHBondContact O-CD 3.2Å; P774-A808 HydrophobicContact CB-CB 3.76Å; P774-V811 HydrophobicContact CB-CB 4.34Å; P774-V811 HydrophobicContact CB-CG2 4.14Å; P774-V811 HydrophobicContact CG-CB 3.93Å; P774-V811 HydrophobicContact CG-CG1 3.72Å; P774-V811 HydrophobicContact CG-CG2 3.66Å
775	L	78.2	Confident	84	Confident	102 Å²	102	59 Å²	59	53%	0.534	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-12.1	173.9	-58.7	-176.8	0	0	0	113.7	P755 A773 K812	P755-L775 HydrophobicContact CG-CD1 3.82Å; P755-L775 HydrophobicContact CG-CG 4.19Å; A773-L775 PolarHBondContact O-N 2.87Å; L775-K812 HydrophobicContact CD2-CG 4.15Å
776	T	81.5	Confident	85.2	Confident	97 Å²	97	50.8 Å²	50.8	60%	0.595	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.3	-23	178.3	54.7	0	0	0	0	113.3	A773	A773-T776 VanDerWaalsContact CB-OG1 3.25Å; A773-T776 WeakPolarHBondContact CB-OG1 2.97Å; A773-T776 PolarHBondContact O-N 2.85Å; A773-T776 PolarHBondContact O-OG1 3.19Å
777	D	85	Confident	85.8	Confident	31 Å²	31	51.3 Å²	51.3	17%	0.166	26%	0.262	C	S	.	.			trans	-104.8	120.3	-164.4	-70	13.3	0	0	0	110.8	F772 A773 P779 F939	F772-D777 WeakPolarHBondContact CA-OD2 3.48Å; F772-D777 HydrophobicContact CB-CB 4.28Å; F772-D777 HydrophobicContact CD2-CB 4.18Å; A773-D777 PolarHBondContact N-OD2 3.45Å; A773-D777 VanDerWaalsContact O-CB 3.23Å; A773-D777 WeakPolarHBondContact O-CB 3.38Å; A773-D777 PolarHBondContact O-N 3.49Å; D777-P779 WeakPolarHBondContact O-CD 3.49Å; D777-F939 HydrophobicContact CB-CD2 4.39Å; D777-F939 HydrophobicContact CB-CE1 4.41Å; D777-F939 HydrophobicContact CB-CE2 3.45Å; D777-F939 VanDerWaalsContact CB-CE2 3.45Å; D777-F939 HydrophobicContact CB-CZ 3.46Å; D777-F939 VanDerWaalsContact CB-CZ 3.46Å; D777-F939 VanDerWaalsContact CG-CZ 3.48Å; D777-F939 VanDerWaalsContact OD2-CE1 3.31Å; D777-F939 WeakPolarHBondContact OD2-CE1 3.43Å; D777-F939 WeakPolarHBondContact OD2-CZ 3.4Å
778	N	86.5	Confident	85.9	Confident	76 Å²	76	56.8 Å²	56.8	41%	0.406	28%	0.284	S	S	.	.			trans	-82.2	120.9	-175.6	177.2	-26.5	0	0	0	111.5	R780 F781	N778-R780 VanDerWaalsContact C-N 3.26Å; N778-R780 PolarHBondContact O-N 3.11Å; N778-R780 VanDerWaalsContact O-N 3.12Å; N778-R780 PolarHBondContact OD1-N 3.43Å; N778-F781 HydrophobicContact CB-CD2 3.83Å; N778-F781 HydrophobicContact CB-CE2 4.43Å; N778-F781 PolarHBondContact O-N 3.28Å
779	P	88.4	Confident	85.8	Confident	15 Å²	15	59.6 Å²	59.6	10%	0.097	30%	0.304	C	S	.	.	H	α-helix	trans	-51	-32.2	-179	-35.2	41.3	0	0	0	117	D777 I782 A783 L804 E805	D777-P779 WeakPolarHBondContact O-CD 3.49Å; P779-I782 WeakPolarHBondContact O-CB 3.44Å; P779-I782 PolarHBondContact O-N 2.66Å; P779-A783 PolarHBondContact O-N 3.06Å; P779-L804 HydrophobicContact CB-CB 3.74Å; P779-L804 HydrophobicContact CG-CB 4.18Å; P779-E805 HydrophobicContact CB-CG 3.85Å; P779-E805 HydrophobicContact CG-CG 3.72Å
780	R	85.4	Confident	85.6	Confident	149 Å²	149	61.3 Å²	61.3	56%	0.562	32%	0.318	S	S	*	.	H	α-helix	trans	-71.2	-43.4	-176.1	-64.2	-176.2	-172.7	177.2	1.4	112	N778 I782 A783 E784 E805	N778-R780 VanDerWaalsContact C-N 3.26Å; N778-R780 PolarHBondContact O-N 3.11Å; N778-R780 VanDerWaalsContact O-N 3.12Å; N778-R780 PolarHBondContact OD1-N 3.43Å; R780-I782 PolarHBondContact O-N 3.42Å; R780-A783 PolarHBondContact O-N 3.08Å; R780-A783 VanDerWaalsContact O-N 3.11Å; R780-E784 WeakPolarHBondContact O-CG 3.34Å; R780-E784 PolarHBondContact O-N 2.88Å; R780-E805 IonicContact NE-OE1 3.85Å; R780-E805 IonicContact NH2-OE1 3.92Å
781	F	87	Confident	85.1	Confident	129 Å²	129	61.4 Å²	61.4	57%	0.566	32%	0.318	S	S	*	.	H	α-helix	trans	-64	-26.9	175.6	-69.5	-85.1	0	0	0	112.7	N778 A785	N778-F781 HydrophobicContact CB-CD2 3.83Å; N778-F781 HydrophobicContact CB-CE2 4.43Å; N778-F781 PolarHBondContact O-N 3.28Å; F781-A785 VanDerWaalsContact O-CB 3.26Å; F781-A785 WeakPolarHBondContact O-CB 3.49Å; F781-A785 PolarHBondContact O-N 2.99Å
782	I	87.5	Confident	84.9	Confident	9 Å²	9	56.9 Å²	56.9	5%	0.046	30%	0.297	C	S	.	.	H	α-helix	trans	-68.7	-47.3	173.1	-54.1	174	0	0	0	110.1	F770 F772 P779 R780 A785 F786 L804 F939	F770-I782 HydrophobicContact CE2-CG2 4.14Å; F772-I782 HydrophobicContact CB-CD1 3.82Å; F772-I782 HydrophobicContact CD2-CD1 3.66Å; F772-I782 HydrophobicContact CE2-CD1 4.39Å; F772-I782 HydrophobicContact CG-CD1 3.84Å; P779-I782 WeakPolarHBondContact O-CB 3.44Å; P779-I782 PolarHBondContact O-N 2.66Å; R780-I782 PolarHBondContact O-N 3.42Å; I782-A785 PolarHBondContact O-N 3.49Å; I782-F786 HydrophobicContact CG2-CD2 4.2Å; I782-F786 HydrophobicContact CG2-CE1 4.37Å; I782-F786 HydrophobicContact CG2-CE2 3.63Å; I782-F786 HydrophobicContact CG2-CZ 3.72Å; I782-F786 WeakPolarHBondContact O-CG 3.39Å; I782-F786 PolarHBondContact O-N 2.7Å; I782-L804 HydrophobicContact CB-CD1 3.8Å; I782-L804 HydrophobicContact CD1-CD1 4.11Å; I782-L804 HydrophobicContact CD1-CD2 4.28Å; I782-L804 HydrophobicContact CG2-CD1 3.64Å; I782-F939 HydrophobicContact CD1-CE2 4.12Å; I782-F939 HydrophobicContact CD1-CZ 3.61Å; I782-F939 HydrophobicContact CG1-CE1 4.39Å; I782-F939 HydrophobicContact CG1-CE2 3.63Å; I782-F939 HydrophobicContact CG1-CZ 3.4Å
783	A	89	Confident	84.5	Confident	3 Å²	3	60 Å²	60	3%	0.025	32%	0.315	C	S	.	.	H	α-helix	trans	-65.8	-39.7	177.6	0	0	0	0	0	112.2	P779 R780 F786 M787 I792 A797 C800	P779-A783 PolarHBondContact O-N 3.06Å; R780-A783 PolarHBondContact O-N 3.08Å; R780-A783 VanDerWaalsContact O-N 3.11Å; A783-F786 PolarHBondContact O-N 2.83Å; A783-M787 WeakPolarHBondContact O-CB 3.39Å; A783-M787 PolarHBondContact O-N 3.03Å; A783-I792 HydrophobicContact CB-CD1 4.48Å; A783-A797 HydrophobicContact CB-CB 4.45Å; A783-A797 VanDerWaalsContact CB-O 3.31Å; A783-A797 WeakPolarHBondContact CB-O 3.26Å; A783-C800 HydrophobicContact CB-CB 4.22Å
784	E	84.6	Confident	84.1	Confident	89 Å²	89	61.8 Å²	61.8	42%	0.416	33%	0.333	S	S	.	.	H	α-helix	trans	-61.9	-47.1	173.1	-72.3	170	160	0	0	111.3	R780 F786 M787 E788	R780-E784 WeakPolarHBondContact O-CG 3.34Å; R780-E784 PolarHBondContact O-N 2.88Å; E784-F786 VanDerWaalsContact C-N 3.27Å; E784-F786 PolarHBondContact O-N 3.2Å; E784-M787 HydrophobicContact CG-CE 4.46Å; E784-M787 WeakPolarHBondContact O-CA 3.07Å; E784-M787 WeakPolarHBondContact O-CB 3.48Å; E784-M787 PolarHBondContact O-N 2.75Å; E784-E788 WeakPolarHBondContact O-CG 3.19Å; E784-E788 PolarHBondContact O-N 2.68Å
785	A	84.3	Confident	83.8	Confident	30 Å²	30	66.5 Å²	66.5	25%	0.248	36%	0.358	C	S	.	.	H	α-helix	trans	-61.7	-33.4	175.9	0	0	0	0	0	113	F781 I782 S789	F781-A785 VanDerWaalsContact O-CB 3.26Å; F781-A785 WeakPolarHBondContact O-CB 3.49Å; F781-A785 PolarHBondContact O-N 2.99Å; I782-A785 PolarHBondContact O-N 3.49Å; A785-S789 WeakPolarHBondContact O-CB 3.47Å; A785-S789 PolarHBondContact O-N 2.88Å; A785-S789 VanDerWaalsContact O-N 3.1Å; A785-S789 PolarHBondContact O-OG 3.22Å
786	F	88.1	Confident	84	Confident	12 Å²	12	62.5 Å²	62.5	5%	0.053	34%	0.336	C	S	.	.	H	α-helix	trans	-71.5	-34.7	172.1	-67	-22	0	0	0	112.9	L761 I768 F770 I782 A783 E784 S790 F791 I792	L761-F786 HydrophobicContact CD2-CD2 4.01Å; L761-F786 HydrophobicContact CD2-CE2 4.04Å; I768-F786 HydrophobicContact CG2-CE1 4.45Å; F770-F786 HydrophobicContact CB-CZ 4.35Å; F770-F786 HydrophobicContact CD1-CE2 4.39Å; F770-F786 AromaticContact CD1-CZ 3.72Å; F770-F786 HydrophobicContact CD1-CZ 3.72Å; F770-F786 AromaticContact CD2-CZ 3.86Å; F770-F786 HydrophobicContact CD2-CZ 3.86Å; F770-F786 HydrophobicContact CE1-CE2 4.05Å; F770-F786 AromaticContact CE1-CZ 3.83Å; F770-F786 HydrophobicContact CE1-CZ 3.83Å; F770-F786 HydrophobicContact CE2-CE2 4.31Å; F770-F786 AromaticContact CE2-CZ 3.96Å; F770-F786 HydrophobicContact CE2-CZ 3.96Å; F770-F786 AromaticContact CG-CZ 3.73Å; F770-F786 HydrophobicContact CG-CZ 3.73Å; F770-F786 AromaticContact CZ-CE2 3.99Å; F770-F786 HydrophobicContact CZ-CE2 3.99Å; F770-F786 AromaticContact CZ-CZ 3.93Å; F770-F786 HydrophobicContact CZ-CZ 3.93Å; I782-F786 HydrophobicContact CG2-CD2 4.2Å; I782-F786 HydrophobicContact CG2-CE1 4.37Å; I782-F786 HydrophobicContact CG2-CE2 3.63Å; I782-F786 HydrophobicContact CG2-CZ 3.72Å; I782-F786 WeakPolarHBondContact O-CG 3.39Å; I782-F786 PolarHBondContact O-N 2.7Å; A783-F786 PolarHBondContact O-N 2.83Å; E784-F786 VanDerWaalsContact C-N 3.27Å; E784-F786 PolarHBondContact O-N 3.2Å; F786-S790 PolarHBondContact O-N 3Å; F786-F791 HydrophobicContact CB-CB 4.18Å; F786-F791 HydrophobicContact CD1-CD2 4.08Å; F786-F791 WeakPolarHBondContact O-CB 3.41Å; F786-F791 PolarHBondContact O-N 3.15Å; F786-I792 HydrophobicContact CB-CD1 3.64Å; F786-I792 HydrophobicContact CB-CG1 3.75Å; F786-I792 HydrophobicContact CD2-CD1 4.32Å; F786-I792 PolarHBondContact O-N 3.23Å
787	M	86.1	Confident	84.3	Confident	80 Å²	80	58.4 Å²	58.4	39%	0.394	31%	0.313	S	S	.	.	H	α-helix	trans	-68.4	-49.4	175	-178.6	175.8	60.4	0	0	111.2	A783 E784 S789 S790 I792 A797	A783-M787 WeakPolarHBondContact O-CB 3.39Å; A783-M787 PolarHBondContact O-N 3.03Å; E784-M787 HydrophobicContact CG-CE 4.46Å; E784-M787 WeakPolarHBondContact O-CA 3.07Å; E784-M787 WeakPolarHBondContact O-CB 3.48Å; E784-M787 PolarHBondContact O-N 2.75Å; M787-S789 VanDerWaalsContact C-N 3.27Å; M787-S789 PolarHBondContact O-N 3.48Å; M787-S790 PolarHBondContact O-N 3.45Å; M787-I792 HydrophobicContact CB-CG1 4.44Å; M787-A797 HydrophobicContact SD-CB 4.24Å
788	E	82.7	Confident	84.1	Confident	163 Å²	163	64.5 Å²	64.5	76%	0.762	34%	0.34	S	S	*	.	H	α-helix	trans	-55.9	-41.8	173.9	-71.3	-175.5	154.2	0	0	111.8	E784 S790	E784-E788 WeakPolarHBondContact O-CG 3.19Å; E784-E788 PolarHBondContact O-N 2.68Å; E788-S790 PolarHBondContact O-N 3.46Å
789	S	80.1	Confident	84.1	Confident	61 Å²	61	63.8 Å²	63.8	43%	0.427	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	6.1	179.4	-56.4	0	0	0	0	114.5	A785 M787 F791	A785-S789 WeakPolarHBondContact O-CB 3.47Å; A785-S789 PolarHBondContact O-N 2.88Å; A785-S789 VanDerWaalsContact O-N 3.1Å; A785-S789 PolarHBondContact O-OG 3.22Å; M787-S789 VanDerWaalsContact C-N 3.27Å; M787-S789 PolarHBondContact O-N 3.48Å; S789-F791 VanDerWaalsContact C-N 3.27Å; S789-F791 PolarHBondContact O-N 3.45Å
790	S	81.4	Confident	84.2	Confident	90 Å²	90	63 Å²	63	63%	0.629	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	40.3	-177.3	-55.6	0	0	0	0	113.6	R766 F786 M787 E788	R766-S790 PolarHBondContact NH1-O 3.18Å; F786-S790 PolarHBondContact O-N 3Å; M787-S790 PolarHBondContact O-N 3.45Å; E788-S790 PolarHBondContact O-N 3.46Å
791	F	77.7	Confident	84.5	Confident	26 Å²	26	56.8 Å²	56.8	11%	0.114	31%	0.31	C	S	.	.	S	Bend	trans	-95.5	-32	174.7	-70	-42	0	0	0	113.2	I768 F786 S789 V944 A946	I768-F791 HydrophobicContact CD1-CB 3.5Å; I768-F791 VanDerWaalsContact CD1-CB 3.5Å; I768-F791 HydrophobicContact CD1-CD1 3.75Å; I768-F791 HydrophobicContact CD1-CD2 4.4Å; I768-F791 HydrophobicContact CD1-CG 3.62Å; I768-F791 HydrophobicContact CG1-CD1 4.13Å; I768-F791 HydrophobicContact CG1-CG 4.3Å; F786-F791 HydrophobicContact CB-CB 4.18Å; F786-F791 HydrophobicContact CD1-CD2 4.08Å; F786-F791 WeakPolarHBondContact O-CB 3.41Å; F786-F791 PolarHBondContact O-N 3.15Å; S789-F791 VanDerWaalsContact C-N 3.27Å; S789-F791 PolarHBondContact O-N 3.45Å; F791-V944 HydrophobicContact CE1-CG1 4.11Å; F791-V944 HydrophobicContact CE2-CB 4.24Å; F791-V944 HydrophobicContact CE2-CG1 3.86Å; F791-V944 HydrophobicContact CE2-CG2 3.89Å; F791-V944 HydrophobicContact CZ-CB 4.09Å; F791-V944 HydrophobicContact CZ-CG1 3.51Å; F791-V944 HydrophobicContact CZ-CG2 4.26Å; F791-A946 HydrophobicContact CE1-CB 4.43Å
792	I	86.6	Confident	84.6	Confident	10 Å²	10	51.9 Å²	51.9	5%	0.051	30%	0.296	C	S	.	.	S	Bend	trans	-134.9	155.9	175.4	62.8	-175.6	0	0	0	109.7	M740 L761 T763 A783 F786 M787 Q796 A797 C800	M740-I792 HydrophobicContact SD-CG2 3.99Å; L761-I792 HydrophobicContact CD2-CG2 3.86Å; T763-I792 HydrophobicContact CG2-CG2 4.01Å; A783-I792 HydrophobicContact CB-CD1 4.48Å; F786-I792 HydrophobicContact CB-CD1 3.64Å; F786-I792 HydrophobicContact CB-CG1 3.75Å; F786-I792 HydrophobicContact CD2-CD1 4.32Å; F786-I792 PolarHBondContact O-N 3.23Å; M787-I792 HydrophobicContact CB-CG1 4.44Å; I792-Q796 HydrophobicContact CB-CB 3.77Å; I792-Q796 HydrophobicContact CG2-CB 4.33Å; I792-A797 HydrophobicContact CD1-CB 4.23Å; I792-C800 HydrophobicContact CD1-CB 3.82Å
793	D	83.8	Confident	84.7	Confident	69 Å²	69	51.8 Å²	51.8	37%	0.369	30%	0.295	S	S	.	.			trans	-83.5	172.2	170.6	69.2	52.9	0	0	0	112.7	N795 Q796 A797	D793-N795 VanDerWaalsContact C-N 3.26Å; D793-N795 PolarHBondContact O-N 2.88Å; D793-N795 WeakPolarHBondContact OD1-CA 3.36Å; D793-N795 WeakPolarHBondContact OD1-CB 3.24Å; D793-N795 PolarHBondContact OD1-N 3.4Å; D793-Q796 WeakPolarHBondContact O-CB 3.46Å; D793-Q796 PolarHBondContact O-N 3.24Å; D793-Q796 PolarHBondContact OD1-N 3.41Å; D793-Q796 PolarHBondContact OD2-OE1 3.04Å; D793-A797 PolarHBondContact O-N 2.86Å
794	G	77.9	Confident	84.9	Confident	45 Å²	45	51.6 Å²	51.6	46%	0.464	29%	0.294	S	S	.	.	H	α-helix	trans	-64.8	-23.1	-177.6	0	0	0	0	0	115
795	N	77.5	Confident	85.1	Confident	111 Å²	111	51.5 Å²	51.5	59%	0.594	29%	0.293	S	S	*	.	H	α-helix	trans	-80.6	-41.3	174.2	-62.7	-0.7	0	0	0	109.8	D793 A797 Q798	D793-N795 VanDerWaalsContact C-N 3.26Å; D793-N795 PolarHBondContact O-N 2.88Å; D793-N795 WeakPolarHBondContact OD1-CA 3.36Å; D793-N795 WeakPolarHBondContact OD1-CB 3.24Å; D793-N795 PolarHBondContact OD1-N 3.4Å; N795-A797 PolarHBondContact O-N 2.84Å; N795-Q798 PolarHBondContact O-N 2.9Å
796	Q	83.8	Confident	85.3	Confident	17 Å²	17	55.8 Å²	55.8	8%	0.079	31%	0.306	C	S	.	.	H	α-helix	trans	-63.7	-26.3	173.8	-71.4	173.2	-15.9	0	0	112.9	M740 I792 D793 Q798 L799 C800	M740-Q796 HydrophobicContact SD-CB 4.02Å; M740-Q796 HydrophobicContact SD-CG 4.23Å; I792-Q796 HydrophobicContact CB-CB 3.77Å; I792-Q796 HydrophobicContact CG2-CB 4.33Å; D793-Q796 WeakPolarHBondContact O-CB 3.46Å; D793-Q796 PolarHBondContact O-N 3.24Å; D793-Q796 PolarHBondContact OD1-N 3.41Å; D793-Q796 PolarHBondContact OD2-OE1 3.04Å; Q796-Q798 PolarHBondContact O-N 3.42Å; Q796-L799 PolarHBondContact O-N 2.92Å; Q796-C800 VanDerWaalsContact O-CB 3.28Å; Q796-C800 WeakPolarHBondContact O-CB 3.2Å; Q796-C800 PolarHBondContact O-N 3.3Å
797	A	86	Confident	85.3	Confident	12 Å²	12	55.2 Å²	55.2	10%	0.099	30%	0.304	C	S	.	.	H	α-helix	trans	-58.6	-45.1	176.1	0	0	0	0	0	112.9	A783 M787 I792 D793 N795 C800 S801	A783-A797 HydrophobicContact CB-CB 4.45Å; A783-A797 VanDerWaalsContact CB-O 3.31Å; A783-A797 WeakPolarHBondContact CB-O 3.26Å; M787-A797 HydrophobicContact SD-CB 4.24Å; I792-A797 HydrophobicContact CD1-CB 4.23Å; D793-A797 PolarHBondContact O-N 2.86Å; N795-A797 PolarHBondContact O-N 2.84Å; A797-C800 PolarHBondContact O-N 3.45Å; A797-S801 PolarHBondContact O-N 2.83Å
798	Q	82.5	Confident	85.4	Confident	158 Å²	158	52.1 Å²	52.1	74%	0.738	29%	0.291	S	S	*	.	H	α-helix	trans	-63.7	-48.5	175.7	-71.8	-167.9	-21.9	0	0	111.5	N795 Q796 C800 S801 G802	N795-Q798 PolarHBondContact O-N 2.9Å; Q796-Q798 PolarHBondContact O-N 3.42Å; Q798-C800 VanDerWaalsContact C-N 3.31Å; Q798-C800 PolarHBondContact O-N 2.72Å; Q798-S801 PolarHBondContact O-N 3.5Å; Q798-S801 PolarHBondContact O-OG 2.79Å; Q798-G802 PolarHBondContact O-N 2.88Å
799	L	86.8	Confident	85.5	Confident	61 Å²	61	48.6 Å²	48.6	32%	0.319	27%	0.274	S	S	.	.	H	α-helix	trans	-54.7	-44.2	175.7	-106	163.5	0	0	0	112.4	H738 M740 Q796 G802 Q803	H738-L799 HydrophobicContact CB-CD1 4.26Å; M740-L799 HydrophobicContact CE-CB 3.86Å; Q796-L799 PolarHBondContact O-N 2.92Å; L799-G802 PolarHBondContact O-N 3.42Å; L799-Q803 WeakPolarHBondContact O-CG 3.23Å; L799-Q803 PolarHBondContact O-N 2.84Å
800	C	90	Very high	85.7	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.2	-44	178.9	-168.2	0	0	0	0	111.3	M740 A783 I792 Q796 A797 Q798 G802 Q803 L804	M740-C800 HydrophobicContact CE-CB 3.87Å; A783-C800 HydrophobicContact CB-CB 4.22Å; I792-C800 HydrophobicContact CD1-CB 3.82Å; Q796-C800 VanDerWaalsContact O-CB 3.28Å; Q796-C800 WeakPolarHBondContact O-CB 3.2Å; Q796-C800 PolarHBondContact O-N 3.3Å; A797-C800 PolarHBondContact O-N 3.45Å; Q798-C800 VanDerWaalsContact C-N 3.31Å; Q798-C800 PolarHBondContact O-N 2.72Å; C800-G802 PolarHBondContact O-N 3.42Å; C800-Q803 PolarHBondContact O-N 2.86Å; C800-L804 WeakPolarHBondContact O-CB 3.5Å; C800-L804 WeakPolarHBondContact O-CG 3.31Å; C800-L804 PolarHBondContact O-N 2.76Å
801	S	90.6	Very high	85.9	Confident	18 Å²	18	43.1 Å²	43.1	13%	0.126	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-43	177.3	71.6	0	0	0	0	112.4	A797 Q798 L804 E805	A797-S801 PolarHBondContact O-N 2.83Å; Q798-S801 PolarHBondContact O-N 3.5Å; Q798-S801 PolarHBondContact O-OG 2.79Å; S801-L804 PolarHBondContact O-N 2.87Å; S801-E805 WeakPolarHBondContact O-CG 3.35Å; S801-E805 PolarHBondContact O-N 2.94Å
802	G	89.2	Confident	86.1	Confident	25 Å²	25	48.4 Å²	48.4	26%	0.258	26%	0.261	S	S	.	.	H	α-helix	trans	-67.2	-36.4	175.7	0	0	0	0	0	113.9	Q798 L799 C800 L804 K806	Q798-G802 PolarHBondContact O-N 2.88Å; L799-G802 PolarHBondContact O-N 3.42Å; C800-G802 PolarHBondContact O-N 3.42Å; G802-L804 VanDerWaalsContact C-N 3.35Å; G802-K806 WeakPolarHBondContact O-CG 3.39Å; G802-K806 PolarHBondContact O-N 3.27Å; G802-K806 VanDerWaalsContact O-N 3.08Å
803	Q	90.9	Very high	85.8	Confident	7 Å²	7	53.3 Å²	53.3	3%	0.033	29%	0.287	C	S	.	.	H	α-helix	trans	-65.4	-38.6	171.6	-71.7	175.4	0	0	0	111.2	L742 L799 C800 K806 V807 M823	L742-Q803 HydrophobicContact CB-CB 4.3Å; L742-Q803 HydrophobicContact CD2-CB 3.81Å; L799-Q803 WeakPolarHBondContact O-CG 3.23Å; L799-Q803 PolarHBondContact O-N 2.84Å; C800-Q803 PolarHBondContact O-N 2.86Å; Q803-K806 PolarHBondContact O-N 3.17Å; Q803-V807 WeakPolarHBondContact O-CG2 3.26Å; Q803-V807 PolarHBondContact O-N 2.68Å; Q803-M823 HydrophobicContact CG-CB 4.38Å; Q803-M823 WeakPolarHBondContact O-CE 3.48Å
804	L	91.3	Very high	85.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-70.4	-37.7	176.5	-78.5	163.1	0	0	0	113.3	L742 F770 F772 P779 I782 C800 S801 G802 V807 A808	L742-L804 HydrophobicContact CD2-CD2 4.31Å; L742-L804 HydrophobicContact CD2-CG 4.33Å; F770-L804 HydrophobicContact CE2-CD2 3.92Å; F770-L804 HydrophobicContact CZ-CD2 3.93Å; F772-L804 HydrophobicContact CD1-CD2 4.11Å; F772-L804 HydrophobicContact CE1-CD2 3.65Å; F772-L804 HydrophobicContact CE2-CD2 4.11Å; F772-L804 HydrophobicContact CZ-CD2 3.64Å; P779-L804 HydrophobicContact CB-CB 3.74Å; P779-L804 HydrophobicContact CG-CB 4.18Å; I782-L804 HydrophobicContact CB-CD1 3.8Å; I782-L804 HydrophobicContact CD1-CD1 4.11Å; I782-L804 HydrophobicContact CD1-CD2 4.28Å; I782-L804 HydrophobicContact CG2-CD1 3.64Å; C800-L804 WeakPolarHBondContact O-CB 3.5Å; C800-L804 WeakPolarHBondContact O-CG 3.31Å; C800-L804 PolarHBondContact O-N 2.76Å; S801-L804 PolarHBondContact O-N 2.87Å; G802-L804 VanDerWaalsContact C-N 3.35Å; L804-V807 PolarHBondContact O-N 3.27Å; L804-A808 PolarHBondContact O-N 3.45Å
805	E	90.3	Very high	85.1	Confident	86 Å²	86	54.5 Å²	54.5	40%	0.402	29%	0.286	S	S	.	.	H	α-helix	trans	-60.4	-43.3	170.8	-75.4	175.9	-179.4	0	0	111	P779 R780 S801 V807 A808 Q809	P779-E805 HydrophobicContact CB-CG 3.85Å; P779-E805 HydrophobicContact CG-CG 3.72Å; R780-E805 IonicContact NE-OE1 3.85Å; R780-E805 IonicContact NH2-OE1 3.92Å; S801-E805 WeakPolarHBondContact O-CG 3.35Å; S801-E805 PolarHBondContact O-N 2.94Å; E805-V807 PolarHBondContact O-N 3.48Å; E805-A808 PolarHBondContact O-N 3.27Å; E805-Q809 PolarHBondContact O-N 3.25Å
806	K	88.9	Confident	84.5	Confident	120 Å²	120	56.4 Å²	56.4	52%	0.522	30%	0.296	S	S	.	.	H	α-helix	trans	-61.6	-38.6	173.5	-72.4	174.4	-176.7	-179.7	0	112.8	G802 Q803 A810 M823	G802-K806 WeakPolarHBondContact O-CG 3.39Å; G802-K806 PolarHBondContact O-N 3.27Å; G802-K806 VanDerWaalsContact O-N 3.08Å; Q803-K806 PolarHBondContact O-N 3.17Å; K806-A810 WeakPolarHBondContact O-CB 3.28Å; K806-A810 PolarHBondContact O-N 3.18Å; K806-M823 HydrophobicContact CB-CE 3.71Å; K806-M823 HydrophobicContact CB-SD 3.47Å; K806-M823 WeakPolarHBondContact CB-SD 3.44Å; K806-M823 HydrophobicContact CD-SD 3.68Å; K806-M823 HydrophobicContact CG-SD 4.19Å
807	V	87.7	Confident	83.7	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-64.7	-46.6	172.4	176.4	0	0	0	0	110.8	L742 V744 V757 F772 Q803 L804 E805 Q809 A810 V811 L821 M823	L742-V807 HydrophobicContact CD2-CG2 3.83Å; V744-V807 HydrophobicContact CG2-CG1 4.04Å; V744-V807 HydrophobicContact CG2-CG2 3.94Å; V757-V807 HydrophobicContact CG1-CG1 4.05Å; V757-V807 HydrophobicContact CG2-CG1 4.4Å; F772-V807 HydrophobicContact CE1-CG1 4.05Å; F772-V807 HydrophobicContact CZ-CB 4.08Å; F772-V807 HydrophobicContact CZ-CG1 3.74Å; Q803-V807 WeakPolarHBondContact O-CG2 3.26Å; Q803-V807 PolarHBondContact O-N 2.68Å; L804-V807 PolarHBondContact O-N 3.27Å; E805-V807 PolarHBondContact O-N 3.48Å; V807-Q809 VanDerWaalsContact C-N 3.27Å; V807-Q809 PolarHBondContact O-N 2.91Å; V807-A810 PolarHBondContact O-N 2.89Å; V807-V811 HydrophobicContact CG1-CG2 4.23Å; V807-V811 WeakPolarHBondContact O-CG2 3.39Å; V807-V811 PolarHBondContact O-N 2.84Å; V807-L821 HydrophobicContact CG2-CD2 4.49Å; V807-M823 HydrophobicContact CG2-CE 3.45Å; V807-M823 VanDerWaalsContact CG2-CE 3.45Å
808	A	87.6	Confident	83.1	Confident	14 Å²	14	58.5 Å²	58.5	12%	0.116	32%	0.315	C	S	.	.	H	α-helix	trans	-62.4	-34.7	-179.1	0	0	0	0	0	112.7	P774 L804 E805 K812	P774-A808 HydrophobicContact CB-CB 3.76Å; L804-A808 PolarHBondContact O-N 3.45Å; E805-A808 PolarHBondContact O-N 3.27Å; A808-K812 PolarHBondContact O-N 3.23Å
809	Q	85.5	Confident	82.6	Confident	89 Å²	89	54.9 Å²	54.9	42%	0.416	31%	0.307	S	S	.	.	H	α-helix	trans	-68.2	-47.8	173.1	-173	53.9	37.6	0	0	111.7	E805 V807 V811 K812 D813	E805-Q809 PolarHBondContact O-N 3.25Å; V807-Q809 VanDerWaalsContact C-N 3.27Å; V807-Q809 PolarHBondContact O-N 2.91Å; Q809-V811 PolarHBondContact O-N 3.49Å; Q809-V811 VanDerWaalsContact O-N 3.16Å; Q809-K812 WeakPolarHBondContact O-CB 3.3Å; Q809-K812 PolarHBondContact O-N 2.78Å; Q809-D813 WeakPolarHBondContact CG-OD2 3.28Å; Q809-D813 PolarHBondContact NE2-OD1 3.32Å; Q809-D813 PolarHBondContact NE2-OD2 3.13Å; Q809-D813 PolarHBondContact O-N 2.9Å
810	A	84.8	Confident	81.9	Confident	27 Å²	27	54 Å²	54	22%	0.223	31%	0.313	C	S	.	.	H	α-helix	trans	-58.5	-30.4	176.5	0	0	0	0	0	113.5	K806 V807 D813 N814 I818 L821	K806-A810 WeakPolarHBondContact O-CB 3.28Å; K806-A810 PolarHBondContact O-N 3.18Å; V807-A810 PolarHBondContact O-N 2.89Å; A810-D813 PolarHBondContact O-N 2.71Å; A810-N814 CarbonylContact O-C 3.56Å; A810-N814 PolarHBondContact O-N 2.8Å; A810-I818 HydrophobicContact CB-CG2 3.82Å; A810-L821 HydrophobicContact CB-CD2 4.26Å
811	V	83.7	Confident	81.4	Confident	10 Å²	10	56.9 Å²	56.9	6%	0.061	33%	0.328	C	S	.	.	H	α-helix	trans	-71.1	-29.9	175.2	-176.4	0	0	0	0	112.7	L747 P755 V757 P774 V807 Q809 I818	L747-V811 HydrophobicContact CD1-CG1 4.42Å; P755-V811 HydrophobicContact CG-CG1 4.35Å; V757-V811 HydrophobicContact CG2-CG2 3.66Å; P774-V811 HydrophobicContact CB-CB 4.34Å; P774-V811 HydrophobicContact CB-CG2 4.14Å; P774-V811 HydrophobicContact CG-CB 3.93Å; P774-V811 HydrophobicContact CG-CG1 3.72Å; P774-V811 HydrophobicContact CG-CG2 3.66Å; V807-V811 HydrophobicContact CG1-CG2 4.23Å; V807-V811 WeakPolarHBondContact O-CG2 3.39Å; V807-V811 PolarHBondContact O-N 2.84Å; Q809-V811 PolarHBondContact O-N 3.49Å; Q809-V811 VanDerWaalsContact O-N 3.16Å; V811-I818 HydrophobicContact CB-CD1 3.89Å; V811-I818 HydrophobicContact CG1-CD1 4.1Å; V811-I818 HydrophobicContact CG2-CD1 3.35Å
812	K	82.1	Confident	80.7	Confident	137 Å²	137	61.5 Å²	61.5	60%	0.596	35%	0.351	S	S	*	.	H	α-helix	trans	-74.3	-41.1	171.6	-69.2	177.1	-180	173.6	0	111.6	L775 A808 Q809	L775-K812 HydrophobicContact CD2-CG 4.15Å; A808-K812 PolarHBondContact O-N 3.23Å; Q809-K812 WeakPolarHBondContact O-CB 3.3Å; Q809-K812 PolarHBondContact O-N 2.78Å
813	D	80.6	Confident	79.8	Confident	112 Å²	112	61.8 Å²	61.8	60%	0.599	35%	0.346	S	S	*	.	H	α-helix	trans	-79.2	-39.8	-170.1	-63.2	-27.3	0	0	0	112.9	Q809 A810	Q809-D813 WeakPolarHBondContact CG-OD2 3.28Å; Q809-D813 PolarHBondContact NE2-OD1 3.32Å; Q809-D813 PolarHBondContact NE2-OD2 3.13Å; Q809-D813 PolarHBondContact O-N 2.9Å; A810-D813 PolarHBondContact O-N 2.71Å
814	N	75.6	Confident	78.3	Confident	82 Å²	82	63.2 Å²	63.2	44%	0.439	36%	0.363	S	S	.	.			trans	-156.3	95.8	173.1	-170.3	-21.5	0	0	0	112.1	A810 D816 A817	A810-N814 CarbonylContact O-C 3.56Å; A810-N814 PolarHBondContact O-N 2.8Å; N814-D816 VanDerWaalsContact C-N 3.26Å; N814-D816 PolarHBondContact O-N 3.46Å; N814-D816 PolarHBondContact OD1-N 3.11Å; N814-A817 HydrophobicContact CB-CB 4.03Å; N814-A817 PolarHBondContact O-N 3.2Å; N814-A817 PolarHBondContact OD1-N 3.03Å
815	P	71.7	Confident	76.1	Confident	58 Å²	58	66.4 Å²	66.4	38%	0.377	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-23.6	-174.9	26.4	-35.1	0	0	0	114.2	L747 I818	L747-P815 HydrophobicContact CD2-CB 4.07Å; L747-P815 WeakPolarHBondContact CD2-O 3Å; P815-I818 VanDerWaalsContact O-CG1 3.23Å; P815-I818 WeakPolarHBondContact O-CG1 3.17Å
816	D	65.6	Low	73.7	Confident	150 Å²	150	71.4 Å²	71.4	80%	0.802	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-15.1	-177.8	-63.7	-44.9	0	0	0	112.9	N814	N814-D816 VanDerWaalsContact C-N 3.26Å; N814-D816 PolarHBondContact O-N 3.46Å; N814-D816 PolarHBondContact OD1-N 3.11Å
817	A	65.7	Low	70.9	Confident	68 Å²	68	74.7 Å²	74.7	56%	0.562	42%	0.42	S	S	*	.	S	Bend	trans	-95.6	-4.2	-173.3	0	0	0	0	0	115.6	N814	N814-A817 HydrophobicContact CB-CB 4.03Å; N814-A817 PolarHBondContact O-N 3.2Å; N814-A817 PolarHBondContact OD1-N 3.03Å
818	I	74.2	Confident	68.2	Low	5 Å²	5	78.2 Å²	78.2	3%	0.026	46%	0.457	C	S	.	.			trans	-82.6	-15.4	-168.5	4	176.7	0	0	0	115.1	V744 L747 A810 V811 P815 G820 L821	V744-I818 WeakPolarHBondContact CB-O 3.47Å; V744-I818 HydrophobicContact CG1-CB 4.49Å; V744-I818 VanDerWaalsContact CG1-O 3.27Å; V744-I818 WeakPolarHBondContact CG1-O 3.39Å; L747-I818 HydrophobicContact CD1-CD1 4.02Å; L747-I818 HydrophobicContact CD2-CD1 4.49Å; A810-I818 HydrophobicContact CB-CG2 3.82Å; V811-I818 HydrophobicContact CB-CD1 3.89Å; V811-I818 HydrophobicContact CG1-CD1 4.1Å; V811-I818 HydrophobicContact CG2-CD1 3.35Å; P815-I818 VanDerWaalsContact O-CG1 3.23Å; P815-I818 WeakPolarHBondContact O-CG1 3.17Å; I818-G820 PolarHBondContact O-N 3.47Å; I818-G820 VanDerWaalsContact O-N 3.11Å; I818-L821 HydrophobicContact CG2-CB 4.32Å; I818-L821 HydrophobicContact CG2-CD2 4.05Å; I818-L821 VanDerWaalsContact O-CB 3.31Å; I818-L821 WeakPolarHBondContact O-CB 3.46Å; I818-L821 PolarHBondContact O-N 3.07Å
819	S	72.7	Confident	65.3	Low	82 Å²	82	82.3 Å²	82.3	57%	0.573	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	109.7	-170.8	-147	0	0	0	0	110.8	I745	I745-S819 PolarHBondContact O-OG 3.25Å
820	G	71.3	Confident	62.9	Low	43 Å²	43	83.7 Å²	83.7	44%	0.443	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.2	-1.2	-173	0	0	0	0	0	115.1	V744 I818 L822	V744-G820 WeakPolarHBondContact O-CA 3.34Å; V744-G820 PolarHBondContact O-N 2.68Å; I818-G820 PolarHBondContact O-N 3.47Å; I818-G820 VanDerWaalsContact O-N 3.11Å; G820-L822 PolarHBondContact O-N 3.02Å
821	L	78.7	Confident	60.4	Low	61 Å²	61	88.3 Å²	88.3	32%	0.319	54%	0.535	S	S	.	.			trans	-52.8	128.2	174.3	-170.3	79.5	0	0	0	110.4	K743 V744 V807 A810 I818 M823	K743-L821 WeakPolarHBondContact CA-O 3.42Å; V744-L821 HydrophobicContact CB-CB 4.1Å; V744-L821 HydrophobicContact CG2-CB 3.97Å; V744-L821 HydrophobicContact CG2-CD2 4.37Å; V744-L821 PolarHBondContact N-O 2.78Å; V807-L821 HydrophobicContact CG2-CD2 4.49Å; A810-L821 HydrophobicContact CB-CD2 4.26Å; I818-L821 HydrophobicContact CG2-CB 4.32Å; I818-L821 HydrophobicContact CG2-CD2 4.05Å; I818-L821 VanDerWaalsContact O-CB 3.31Å; I818-L821 WeakPolarHBondContact O-CB 3.46Å; I818-L821 PolarHBondContact O-N 3.07Å; L821-M823 HydrophobicContact CD2-CE 4.07Å
822	L	76.7	Confident	57.7	Low	114 Å²	114	96.6 Å²	96.6	60%	0.597	58%	0.578	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-121.1	132.5	-178	-164.4	83.6	0	0	0	109.3	K743 G820	K743-L822 HydrophobicContact CB-CD1 3.78Å; K743-L822 HydrophobicContact CD-CD1 3.9Å; K743-L822 HydrophobicContact CG-CD1 3.77Å; G820-L822 PolarHBondContact O-N 3.02Å
823	M	71	Confident	55.1	Low	32 Å²	32	93.6 Å²	93.6	16%	0.158	59%	0.586	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.3	144.7	175.1	-70.7	-172.5	-72.1	0	0	112	K741 L742 Q803 K806 V807 L821	K741-M823 WeakPolarHBondContact CA-O 3.3Å; L742-M823 PolarHBondContact N-O 3.14Å; L742-M823 PolarHBondContact O-N 3.28Å; Q803-M823 HydrophobicContact CG-CB 4.38Å; Q803-M823 WeakPolarHBondContact O-CE 3.48Å; K806-M823 HydrophobicContact CB-CE 3.71Å; K806-M823 HydrophobicContact CB-SD 3.47Å; K806-M823 WeakPolarHBondContact CB-SD 3.44Å; K806-M823 HydrophobicContact CD-SD 3.68Å; K806-M823 HydrophobicContact CG-SD 4.19Å; V807-M823 HydrophobicContact CG2-CE 3.45Å; V807-M823 VanDerWaalsContact CG2-CE 3.45Å; L821-M823 HydrophobicContact CD2-CE 4.07Å
824	G	58.2	Low	52.4	Low	37 Å²	37	95.1 Å²	95.1	38%	0.381	60%	0.604	S	S	.	*			trans	-156.2	-166.8	178.8	0	0	0	0	0	109.8	E826	G824-E826 VanDerWaalsContact C-N 3.31Å; G824-E826 PolarHBondContact O-N 2.96Å; G824-E826 VanDerWaalsContact O-N 3.12Å
825	D	46.5	Very low	50.1	Low	67 Å²	67	96.1 Å²	96.1	36%	0.358	62%	0.624	S	S	.	*	S	Bend	trans	-84	17.5	-156.3	-49.9	-34.6	0	0	0	116.1
826	E	40	Very low	47.9	Very low	190 Å²	190	98.7 Å²	98.7	89%	0.888	64%	0.643	S	S	*	*			trans	-107.4	123.7	-177.3	-59.8	-157.8	147.6	0	0	112.7	G824	G824-E826 VanDerWaalsContact C-N 3.31Å; G824-E826 PolarHBondContact O-N 2.96Å; G824-E826 VanDerWaalsContact O-N 3.12Å
827	E	30.1	Very low	46.1	Very low	189 Å²	189	97.2 Å²	97.2	88%	0.883	64%	0.644	S	S	*	*			trans	-92.9	123.2	176.5	-64.8	-159.4	123.2	0	0	112
828	G	29.1	Very low	44.2	Very low	75 Å²	75	99 Å²	99	77%	0.773	65%	0.653	S	S	*	*			trans	-165	125.2	171.4	0	0	0	0	0	110.3
829	A	28.4	Very low	41.8	Very low	101 Å²	101	105.3 Å²	105.3	84%	0.835	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-82.3	147.1	-172.3	0	0	0	0	0	113.1
830	P	34	Very low	39.6	Very low	117 Å²	117	107.2 Å²	107.2	76%	0.76	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-90.6	146.7	-177.1	35.3	-34.9	0	0	0	113.6
831	P	31.4	Very low	37.3	Very low	125 Å²	125	110.4 Å²	110.4	81%	0.812	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-87.4	147.1	162.3	34.3	-31.5	0	0	0	111.8
832	L	27.9	Very low	34.8	Very low	183 Å²	183	115.6 Å²	115.6	96%	0.958	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-80.4	147.3	175.8	-60.6	110.5	0	0	0	112
833	G	27.5	Very low	32.3	Very low	75 Å²	75	115.2 Å²	115.2	77%	0.773	75%	0.749	S	S	*	*			trans	179.1	109.2	170.6	0	0	0	0	0	113.3
834	C	24.8	Very low	30.1	Very low	143 Å²	143	118.7 Å²	118.7	97%	0.966	78%	0.776	S	S	*	*			trans	-89.9	120.5	178.8	-67.6	0	0	0	0	111.8
835	A	26	Very low	28.6	Very low	103 Å²	103	123.3 Å²	123.3	85%	0.851	80%	0.797	S	S	*	*			trans	-155	147.4	155.7	0	0	0	0	0	111.1
836	S	26.7	Very low	27.7	Very low	113 Å²	113	127.4 Å²	127.4	79%	0.79	82%	0.819	S	S	*	*			trans	-71.9	155.8	-169.8	46.7	0	0	0	0	116.3
837	S	26.9	Very low	27.2	Very low	118 Å²	118	123.4 Å²	123.4	83%	0.825	80%	0.803	S	S	*	*			trans	64.4	91.4	145	179.6	0	0	0	0	119.5
838	S	25.5	Very low	27.1	Very low	105 Å²	105	125.4 Å²	125.4	73%	0.734	80%	0.803	S	S	*	*				-157.6	134.9	128	52.4	0	0	0	0	111.6
839	V	25.1	Very low	26.9	Very low	139 Å²	139	128 Å²	128	84%	0.842	80%	0.795	S	S	*	*			trans	-95.2	99.5	179.5	-176	0	0	0	0	109.3
840	V	25.4	Very low	26.8	Very low	122 Å²	122	128 Å²	128	74%	0.739	78%	0.784	S	S	*	*			trans	-93.2	100.4	175.1	-177.9	0	0	0	0	109.7	L842	V840-L842 PolarHBondContact O-N 2.9Å
841	S	23.5	Very low	26.4	Very low	110 Å²	110	128.8 Å²	128.8	77%	0.769	79%	0.786	S	S	*	*			trans	-70.5	95.9	178.5	-59.6	0	0	0	0	112
842	L	26.2	Very low	26.1	Very low	170 Å²	170	130.1 Å²	130.1	89%	0.89	78%	0.776	S	S	*	*			trans	-75.6	130.8	170	-93.7	166.1	0	0	0	111.4	V840	V840-L842 PolarHBondContact O-N 2.9Å
843	S	23.8	Very low	26	Very low	105 Å²	105	125 Å²	125	73%	0.734	77%	0.768	S	S	*	*			trans	-95.7	158.9	-168.3	55.6	0	0	0	0	113.7
844	S	25.2	Very low	25.9	Very low	105 Å²	105	126 Å²	126	73%	0.734	75%	0.754	S	S	*	*			trans	62.5	83.2	156.5	-175	0	0	0	0	118.3
845	V	26.7	Very low	25.9	Very low	135 Å²	135	124 Å²	124	82%	0.818	75%	0.748	S	S	*	*			trans	-125.3	126.5	142.7	-177.5	0	0	0	0	108.3
846	N	27.2	Very low	25.9	Very low	153 Å²	153	127.2 Å²	127.2	82%	0.818	74%	0.743	S	S	*	*			trans	-81	128.4	172.6	-73.7	-55.9	0	0	0	109.6
847	D	30.4	Very low	25.8	Very low	105 Å²	105	130 Å²	130	56%	0.561	75%	0.75	S	S	*	*			trans	-144.7	125.6	163.5	-122.7	-19.6	0	0	0	110.3	R760	R760-D847 IonicContact CZ-OD2 3.19Å; R760-D847 VanDerWaalsContact CZ-OD2 3.26Å; R760-D847 IonicContact NH1-OD2 2.81Å; R760-D847 PolarHBondContact NH1-OD2 2.74Å; R760-D847 IonicContact NH2-OD2 2.75Å; R760-D847 PolarHBondContact NH2-OD2 2.75Å
848	R	26.5	Very low	25.8	Very low	231 Å²	231	130.9 Å²	130.9	87%	0.872	74%	0.743	S	S	*	*			trans	-106.5	76	-178.4	-84.6	-176.8	167.5	178	-3.6	110.5	V850	R848-V850 PolarHBondContact O-N 2.81Å
849	E	26	Very low	25.7	Very low	131 Å²	131	131.2 Å²	131.2	61%	0.612	75%	0.746	S	S	*	*			trans	-76.2	106.4	170.6	-75.6	-164.2	165.9	0	0	111.7	V851	E849-V851 PolarHBondContact O-N 2.9Å
850	V	26.3	Very low	25.8	Very low	101 Å²	101	133.7 Å²	133.7	61%	0.612	75%	0.745	S	S	*	*			trans	-85.5	104.8	170.8	179	0	0	0	0	109.3	R848 Y852	R848-V850 PolarHBondContact O-N 2.81Å; V850-Y852 HydrophobicContact CB-CD2 4.49Å; V850-Y852 HydrophobicContact CB-CE2 4.49Å; V850-Y852 HydrophobicContact CG1-CD2 3.96Å; V850-Y852 HydrophobicContact CG1-CE2 3.82Å; V850-Y852 PolarHBondContact O-N 2.75Å
851	V	25.2	Very low	25.9	Very low	132 Å²	132	133.8 Å²	133.8	80%	0.8	74%	0.742	S	S	*	*			trans	-66.5	95.6	-177.6	-177.2	0	0	0	0	111.8	E849 G853	E849-V851 PolarHBondContact O-N 2.9Å; V851-G853 PolarHBondContact O-N 3.3Å; V851-G853 VanDerWaalsContact O-N 3.13Å
852	Y	24.8	Very low	26	Very low	153 Å²	153	134.3 Å²	134.3	60%	0.6	74%	0.743	S	S	*	*			trans	-80.2	84.9	172.2	-93	-94.1	0	0	0	111.5	K305 V850 I854	K305-Y852 PolarHBondContact NZ-OH 3.1Å; K305-Y852 VanDerWaalsContact NZ-OH 3.12Å; V850-Y852 HydrophobicContact CB-CD2 4.49Å; V850-Y852 HydrophobicContact CB-CE2 4.49Å; V850-Y852 HydrophobicContact CG1-CD2 3.96Å; V850-Y852 HydrophobicContact CG1-CE2 3.82Å; V850-Y852 PolarHBondContact O-N 2.75Å; Y852-I854 VanDerWaalsContact C-N 3.27Å; Y852-I854 PolarHBondContact O-N 2.9Å
853	G	26	Very low	26.2	Very low	76 Å²	76	134.3 Å²	134.3	78%	0.784	74%	0.736	S	S	*	*			trans	-67.4	77.6	170.7	0	0	0	0	0	113	V851 A855	V851-G853 PolarHBondContact O-N 3.3Å; V851-G853 VanDerWaalsContact O-N 3.13Å; G853-A855 PolarHBondContact O-N 2.88Å
854	I	24.9	Very low	26.4	Very low	95 Å²	95	141 Å²	141	49%	0.487	75%	0.745	S	S	.	*			trans	-81.6	101.7	167.6	-62.2	170.2	0	0	0	108.2	Y852 K856	Y852-I854 VanDerWaalsContact C-N 3.27Å; Y852-I854 PolarHBondContact O-N 2.9Å; I854-K856 HydrophobicContact CG2-CD 4.5Å; I854-K856 HydrophobicContact CG2-CG 4.01Å; I854-K856 PolarHBondContact O-N 2.85Å
855	A	25.3	Very low	26.5	Very low	102 Å²	102	144.4 Å²	144.4	84%	0.843	75%	0.754	S	S	*	*			trans	-65.6	118	159.6	0	0	0	0	0	108.7	G853	G853-A855 PolarHBondContact O-N 2.88Å
856	K	26.2	Very low	26.6	Very low	170 Å²	170	144.1 Å²	144.1	74%	0.739	76%	0.756	S	S	*	*			trans	-128.3	134.2	164.8	-96	-172.5	174	-171.8	0	107.3	I854 I858	I854-K856 HydrophobicContact CG2-CD 4.5Å; I854-K856 HydrophobicContact CG2-CG 4.01Å; I854-K856 PolarHBondContact O-N 2.85Å; K856-I858 PolarHBondContact O-N 2.8Å
857	N	25.7	Very low	26.7	Very low	173 Å²	173	145.8 Å²	145.8	93%	0.925	76%	0.759	S	S	*	*			trans	-26.9	110.1	-179.5	-51.5	-5.2	0	0	0	113.8
858	I	25.4	Very low	26.6	Very low	136 Å²	136	148.8 Å²	148.8	70%	0.697	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-103.1	121.1	157.3	-65.5	180	0	0	0	105.9	K856 F860	K856-I858 PolarHBondContact O-N 2.8Å; I858-F860 PolarHBondContact O-N 3.1Å
859	S	24.8	Very low	26.7	Very low	112 Å²	112	143.5 Å²	143.5	78%	0.783	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-58.7	126	174.4	-173.5	0	0	0	0	109.6
860	F	26.5	Very low	26.9	Very low	190 Å²	190	142.3 Å²	142.3	83%	0.833	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-101.9	127.3	166	-119.6	-93.3	0	0	0	108.3	I858	I858-F860 PolarHBondContact O-N 3.1Å
861	D	28.2	Very low	27.1	Very low	124 Å²	124	141.8 Å²	141.8	66%	0.663	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-57.9	123.2	-178.8	-171.1	-12.8	0	0	0	110.1	K863	D861-K863 PolarHBondContact O-N 3.44Å
862	P	25.3	Very low	27.5	Very low	122 Å²	122	144.4 Å²	144.4	79%	0.792	80%	0.795	S	S	*	*	S	Bend	trans	-76.6	55.8	-171.5	32.3	-38.2	0	0	0	113.1
863	K	29.3	Very low	27.8	Very low	170 Å²	170	144.7 Å²	144.7	74%	0.739	81%	0.806	S	S	*	*			trans	-154.5	76.3	-176.3	-100.3	153.9	-174.5	172.7	0	113.4	D861	D861-K863 PolarHBondContact O-N 3.44Å
864	R	28.2	Very low	28	Very low	244 Å²	244	148.6 Å²	148.6	92%	0.921	81%	0.808	S	S	*	*	S	Bend	trans	169.8	158.2	140.9	-92.4	151.4	-165.8	-110.6	1.4	111.4
865	L	28.8	Very low	28.3	Very low	177 Å²	177	148.6 Å²	148.6	93%	0.927	82%	0.817	S	S	*	*			trans	66.1	64.2	172.3	-57.3	177.5	0	0	0	116.9
866	C	27.6	Very low	28.5	Very low	129 Å²	129	154 Å²	154	87%	0.872	82%	0.821	S	S	*	*			trans	-141.7	85.6	144.5	-167.4	0	0	0	0	109.5
867	Q	28.9	Very low	28.7	Very low	188 Å²	188	152 Å²	152	88%	0.879	82%	0.823	S	S	*	*			trans	-151.9	92.1	168.8	-82	-162.9	-18.4	0	0	110.1
868	L	29.1	Very low	28.7	Very low	169 Å²	169	153 Å²	153	89%	0.885	82%	0.819	S	S	*	*	S	Bend	trans	-142.2	132.5	148	-82.8	-177.8	0	0	0	107.3
869	S	28.8	Very low	28.7	Very low	119 Å²	119	153.4 Å²	153.4	83%	0.832	82%	0.821	S	S	*	*	S	Bend	trans	69.5	152.4	-172.5	80	0	0	0	0	117.4
870	A	30.7	Very low	28.8	Very low	107 Å²	107	153.1 Å²	153.1	88%	0.884	82%	0.816	S	S	*	*			trans	63.6	128.7	-179	0	0	0	0	0	117.3
871	A	30.2	Very low	28.8	Very low	89 Å²	89	151 Å²	151	74%	0.736	81%	0.814	S	S	*	*			trans	-106.5	179.8	-168.5	0	0	0	0	0	113.9
872	Q	33.9	Very low	28.9	Very low	188 Å²	188	151 Å²	151	88%	0.879	82%	0.821	S	S	*	*			trans	72.8	111.8	161.6	-61.9	165.4	-46.9	0	0	118.7
873	L	30.2	Very low	29	Very low	159 Å²	159	149 Å²	149	83%	0.832	82%	0.822	S	S	*	*				-149.2	108.5	121.4	-106.2	175.9	0	0	0	109.2
874	L	29.9	Very low	28.9	Very low	158 Å²	158	144.6 Å²	144.6	83%	0.827	83%	0.825	S	S	*	*			trans	29	125.8	158	-52.9	174.3	0	0	0	118.6
875	S	31.2	Very low	28.8	Very low	95 Å²	95	144.1 Å²	144.1	66%	0.664	83%	0.825	S	S	*	*			cis	-161.4	140.7	33.1	49.2	0	0	0	0	114.6
876	K	30	Very low	28.7	Very low	215 Å²	215	140.9 Å²	140.9	94%	0.935	82%	0.816	S	S	*	*			trans	-93.6	143.3	134	-86.2	-175.6	175.2	178	0	107.1
877	V	30.1	Very low	28.8	Very low	127 Å²	127	139.7 Å²	139.7	77%	0.77	81%	0.809	S	S	*	*			trans	-112.1	169.4	172.8	176.1	0	0	0	0	107.9
878	K	25.4	Very low	28.8	Very low	194 Å²	194	135.4 Å²	135.4	84%	0.843	80%	0.799	S	S	*	*			trans	82.6	133.5	-174.8	-136.7	174.5	-178	175.4	0	110.8
879	I	26.2	Very low	28.8	Very low	146 Å²	146	134.5 Å²	134.5	75%	0.749	80%	0.795	S	S	*	*			cis	-130.5	146.4	21.3	-62.2	154.2	0	0	0	110.9
880	P	26.1	Very low	28.7	Very low	105 Å²	105	133.4 Å²	133.4	68%	0.682	79%	0.787	S	S	*	*			trans	-93.8	136.4	159.7	35	-28.7	0	0	0	112.2
881	D	25.9	Very low	29.1	Very low	146 Å²	146	135.6 Å²	135.6	78%	0.781	78%	0.784	S	S	*	*			trans	60	167.4	168.5	-73.7	-51.2	0	0	0	117.7
882	P	32	Very low	29.3	Very low	125 Å²	125	135.9 Å²	135.9	81%	0.812	78%	0.778	S	S	*	*			cis	-121.3	160.6	-2.2	39.7	-26.8	0	0	0	115.5
883	G	26.2	Very low	28.8	Very low	79 Å²	79	133.3 Å²	133.3	81%	0.814	77%	0.771	S	S	*	*			trans	100.5	100.5	155.4	0	0	0	0	0	116.2
884	G	27.9	Very low	28.6	Very low	77 Å²	77	131.8 Å²	131.8	79%	0.794	77%	0.768	S	S	*	*			trans	179	74.2	176.4	0	0	0	0	0	112	C886	G884-C886 PolarHBondContact O-N 3Å
885	Y	25.2	Very low	28.4	Very low	235 Å²	235	128.4 Å²	128.4	92%	0.922	76%	0.763	S	S	*	*			trans	-65.4	121.6	-177.3	-92	-99.6	0	0	0	112.6
886	C	27	Very low	28.3	Very low	109 Å²	109	130.4 Å²	130.4	74%	0.736	77%	0.766	S	S	*	*			trans	159.1	100.8	134.7	-83.6	0	0	0	0	107.7	G884	G884-C886 PolarHBondContact O-N 3Å
887	S	30.1	Very low	28.3	Very low	104 Å²	104	126.8 Å²	126.8	73%	0.727	76%	0.756	S	S	*	*				62.3	121.7	87.1	72.2	0	0	0	0	113.2
888	S	29.3	Very low	28.3	Very low	98 Å²	98	124.3 Å²	124.3	69%	0.685	76%	0.755	S	S	*	*			cis	-171.3	164.7	7.4	36.8	0	0	0	0	113.1
889	L	27.6	Very low	28.7	Very low	150 Å²	150	122.4 Å²	122.4	79%	0.785	75%	0.75	S	S	*	*			trans	61.5	102.9	143.2	-75.1	165.7	0	0	0	119.6
890	S	27.5	Very low	29.2	Very low	96 Å²	96	122.4 Å²	122.4	67%	0.671	75%	0.746	S	S	*	*				68.2	112.4	115	75.3	0	0	0	0	120.5
891	N	39.7	Very low	29.5	Very low	152 Å²	152	123.6 Å²	123.6	81%	0.813	75%	0.747	S	S	*	*				-33.1	149.6	128.6	-101.3	-9.6	0	0	0	111.7
892	P	33.9	Very low	29.9	Very low	95 Å²	95	124.2 Å²	124.2	62%	0.617	75%	0.745	S	S	*	*			cis	-153.4	-173.5	48	43.6	-23.9	0	0	0	116.8
893	N	24.4	Very low	30.1	Very low	135 Å²	135	122.7 Å²	122.7	72%	0.722	74%	0.735	S	S	*	*			trans	65.8	144.6	141.8	-70.8	-11.2	0	0	0	122
894	T	25	Very low	30.4	Very low	127 Å²	127	124 Å²	124	78%	0.779	73%	0.732	S	S	*	*			trans	61.2	140.8	142.6	49.1	0	0	0	0	121.2
895	A	26.6	Very low	30.4	Very low	87 Å²	87	129.4 Å²	129.4	72%	0.719	73%	0.734	S	S	*	*			trans	72.4	148.7	151	0	0	0	0	0	116.1
896	D	28.1	Very low	30.8	Very low	137 Å²	137	123.1 Å²	123.1	73%	0.733	72%	0.722	S	S	*	*			cis	-152.3	-178.6	-6.1	-131.4	-28	0	0	0	112.2
897	I	29.6	Very low	30.8	Very low	139 Å²	139	125.6 Å²	125.6	71%	0.713	73%	0.727	S	S	*	*			trans	26.7	123	147.3	-58.5	152.8	0	0	0	116.5	E899	I897-E899 HydrophobicContact CG2-CG 4.45Å
898	G	30.5	Very low	30.6	Very low	74 Å²	74	125.7 Å²	125.7	76%	0.763	73%	0.727	S	S	*	*			cis	165.8	-169.6	21.3	0	0	0	0	0	107.8
899	E	33	Very low	30.5	Very low	155 Å²	155	125.3 Å²	125.3	72%	0.724	73%	0.73	S	S	*	*			cis	-151	163.2	6.1	-80.8	-166	142.8	0	0	110.8	I897	I897-E899 HydrophobicContact CG2-CG 4.45Å
900	H	36.8	Very low	30.7	Very low	145 Å²	145	123.7 Å²	123.7	67%	0.671	73%	0.732	S	S	*	*			trans	42.7	129.9	149	-68.2	-58.5	0	0	0	121.1
901	N	34.2	Very low	31	Very low	130 Å²	130	127 Å²	127	70%	0.695	74%	0.741	S	S	*	*			cis	-151.7	134.5	12	-97.3	-37.1	0	0	0	109.4
902	Q	32.5	Very low	30.8	Very low	160 Å²	160	124.9 Å²	124.9	75%	0.748	74%	0.735	S	S	*	*				93.8	144.1	62.5	-82.8	-94	-28	0	0	113.1
903	P	36.1	Very low	30.8	Very low	93 Å²	93	127.3 Å²	127.3	60%	0.604	74%	0.743	S	S	*	*				-143.5	-131.4	-93.7	42.8	-21	0	0	0	114.7
904	S	33.9	Very low	31.2	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	75%	0.746	S	S	*	*			trans	80.2	118.6	-177.9	69.7	0	0	0	0	115.4
905	F	26.8	Very low	31.8	Very low	190 Å²	190	129 Å²	129	83%	0.833	75%	0.746	S	S	*	*			cis	66.5	153.7	14.1	-73.3	-70.5	0	0	0	116.6
906	P	35.1	Very low	32	Very low	103 Å²	103	129 Å²	129	67%	0.669	75%	0.745	S	S	*	*			cis	-138.3	177.4	-1.9	30.2	-6.2	0	0	0	117.8
907	L	25.9	Very low	32.1	Very low	160 Å²	160	127.2 Å²	127.2	84%	0.838	74%	0.743	S	S	*	*			trans	19.4	145.1	136.7	-49.2	163.8	0	0	0	120.1
908	S	26.5	Very low	32.2	Very low	106 Å²	106	126.7 Å²	126.7	74%	0.741	74%	0.741	S	S	*	*				170.5	170.9	64.1	49.3	0	0	0	0	112.5
909	A	27.8	Very low	32.3	Very low	90 Å²	90	131.1 Å²	131.1	74%	0.744	74%	0.74	S	S	*	*			trans	58.3	142.4	150.9	0	0	0	0	0	120.6
910	S	31.6	Very low	32.5	Very low	117 Å²	117	128.8 Å²	128.8	82%	0.818	73%	0.732	S	S	*	*			cis	-160.6	164.6	-7.3	-91.9	0	0	0	0	111.4
911	L	32.7	Very low	32.2	Very low	165 Å²	165	129.4 Å²	129.4	86%	0.864	73%	0.733	S	S	*	*			trans	-71.5	172.2	159.6	-80.2	164.3	0	0	0	110.8
912	P	35.7	Very low	31.8	Very low	107 Å²	107	128.3 Å²	128.3	70%	0.695	74%	0.735	S	S	*	*			cis	-124.1	-146.5	18	35.2	-11	0	0	0	111.7
913	D	33.5	Very low	31.6	Very low	146 Å²	146	125.8 Å²	125.8	78%	0.781	74%	0.736	S	S	*	*			cis	-158.8	-176.4	7.9	-142.4	-26.5	0	0	0	113.6
914	F	33.7	Very low	31.6	Very low	181 Å²	181	127.1 Å²	127.1	79%	0.794	74%	0.742	S	S	*	*			trans	-118	156.4	175	-103.6	-88.8	0	0	0	111.4
915	P	37.3	Very low	31.4	Very low	118 Å²	118	127 Å²	127	77%	0.766	74%	0.739	S	S	*	*				-128.9	144.7	99.9	5.4	16.6	0	0	0	111.7
916	A	30.3	Very low	31.2	Very low	85 Å²	85	124.9 Å²	124.9	70%	0.702	74%	0.735	S	S	*	*				68.6	134	53.1	0	0	0	0	0	111.8
917	S	30.1	Very low	30.8	Very low	100 Å²	100	125.2 Å²	125.2	70%	0.699	74%	0.74	S	S	*	*			cis	-160.8	158.8	5	-165.5	0	0	0	0	107.8
918	L	31.4	Very low	30.7	Very low	128 Å²	128	122.2 Å²	122.2	67%	0.67	73%	0.733	S	S	*	*				179.4	142.9	76.2	-87.3	169.3	0	0	0	111.7
919	K	34.2	Very low	30.6	Very low	167 Å²	167	124.9 Å²	124.9	73%	0.726	74%	0.738	S	S	*	*			trans	63	130.5	148.1	-63.7	164.4	177.4	165	0	118.2
920	D	36.4	Very low	30.4	Very low	107 Å²	107	126.8 Å²	126.8	57%	0.572	74%	0.735	S	S	*	*			cis	-155	137.9	4.6	-117.6	-5.3	0	0	0	114.4
921	K	31.5	Very low	30	Very low	157 Å²	157	129 Å²	129	68%	0.683	74%	0.737	S	S	*	*			trans	50.6	111.1	141.9	-61.5	171.3	-176.9	85.1	0	118.3
922	S	25.6	Very low	29.5	Very low	107 Å²	107	128.5 Å²	128.5	75%	0.748	73%	0.734	S	S	*	*				57.4	135.2	76.5	79.3	0	0	0	0	113.9
923	S	28.3	Very low	28.9	Very low	108 Å²	108	128.1 Å²	128.1	76%	0.755	73%	0.734	S	S	*	*				-167.5	179.8	56	55.3	0	0	0	0	114.6
924	V	36.3	Very low	28.5	Very low	120 Å²	120	128.3 Å²	128.3	73%	0.727	73%	0.73	S	S	*	*			trans	-88.9	140.7	171.1	-177.8	0	0	0	0	110.7	L926	V924-L926 HydrophobicContact CG1-CB 4.43Å
925	P	28.9	Very low	28.1	Very low	106 Å²	106	127.3 Å²	127.3	69%	0.688	73%	0.725	S	S	*	*			trans	-126.8	143	132	4.9	16.7	0	0	0	110.2
926	L	23.4	Very low	27.5	Very low	144 Å²	144	129.5 Å²	129.5	75%	0.754	73%	0.731	S	S	*	*			cis	59.7	88.2	22.4	-95.3	170.7	0	0	0	115	V924	V924-L926 HydrophobicContact CG1-CB 4.43Å
927	S	26.7	Very low	27.2	Very low	110 Å²	110	129.5 Å²	129.5	77%	0.769	74%	0.739	S	S	*	*			trans	34.3	96.5	146.4	58.9	0	0	0	0	118.4
928	S	23.8	Very low	27	Very low	98 Å²	98	136.3 Å²	136.3	69%	0.685	75%	0.749	S	S	*	*			trans	-120.3	99.3	159.2	43.8	0	0	0	0	110.7	I930	S928-I930 PolarHBondContact O-N 3.04Å; S928-I930 VanDerWaalsContact O-N 3.1Å
929	N	24	Very low	26.8	Very low	162 Å²	162	133.6 Å²	133.6	87%	0.866	73%	0.732	S	S	*	*			trans	-64.1	106.2	160.1	-75.1	-34.3	0	0	0	107.8
930	I	22.7	Very low	26.4	Very low	130 Å²	130	130.7 Å²	130.7	67%	0.667	73%	0.728	S	S	*	*			trans	-97.1	106.4	158.5	-65.2	-178	0	0	0	106.7	S928 L932	S928-I930 PolarHBondContact O-N 3.04Å; S928-I930 VanDerWaalsContact O-N 3.1Å; I930-L932 VanDerWaalsContact C-N 3.27Å; I930-L932 HydrophobicContact CG2-CB 4.34Å; I930-L932 HydrophobicContact CG2-CD1 4.02Å; I930-L932 HydrophobicContact CG2-CG 3.81Å; I930-L932 PolarHBondContact O-N 2.86Å
931	L	23	Very low	26	Very low	164 Å²	164	130.3 Å²	130.3	86%	0.859	73%	0.729	S	S	*	*			trans	-65.6	94.3	159.7	-83	77.4	0	0	0	107.3
932	L	23.9	Very low	25.8	Very low	154 Å²	154	128.9 Å²	128.9	81%	0.806	73%	0.729	S	S	*	*			trans	-102.8	103.3	156.3	-91.6	168.8	0	0	0	108	I930	I930-L932 VanDerWaalsContact C-N 3.27Å; I930-L932 HydrophobicContact CG2-CB 4.34Å; I930-L932 HydrophobicContact CG2-CD1 4.02Å; I930-L932 HydrophobicContact CG2-CG 3.81Å; I930-L932 PolarHBondContact O-N 2.86Å
933	S	22.9	Very low	26	Very low	98 Å²	98	129.3 Å²	129.3	69%	0.685	72%	0.718	S	S	*	*			trans	16.7	126.2	166.8	-168.1	0	0	0	0	118
934	E	25.4	Very low	26	Very low	150 Å²	150	126.3 Å²	126.3	70%	0.701	70%	0.695	S	S	*	*			trans	-33.9	151.5	148.9	-48.4	172.4	144.7	0	0	113.8
935	K	24.4	Very low	25.6	Very low	160 Å²	160	125.6 Å²	125.6	70%	0.696	69%	0.69	S	S	*	*			trans	102.9	133.5	164.5	-59.9	138.8	-171.1	150.6	0	116.3
936	N	24.2	Very low	25.6	Very low	165 Å²	165	122.5 Å²	122.5	88%	0.882	67%	0.674	S	S	*	*			trans	84.1	140.3	166.4	-51.5	-23.4	0	0	0	117
937	G	25.1	Very low	25.8	Very low	85 Å²	85	119.4 Å²	119.4	88%	0.876	66%	0.664	S	S	*	*			trans	-80.2	152.8	-160.4	0	0	0	0	0	114.7
938	R	24.9	Very low	26	Very low	243 Å²	243	121.4 Å²	121.4	92%	0.917	66%	0.662	S	S	*	*			trans	-116.1	118.5	-176.9	-156.4	172.7	-163.2	157.4	6	112
939	F	27.5	Very low	26.2	Very low	70 Å²	70	121.4 Å²	121.4	31%	0.307	66%	0.661	S	S	.	*			trans	-52.8	144.5	171.3	-119.7	-74.8	0	0	0	112.4	F772 D777 I782	F772-F939 HydrophobicContact CB-CE1 4.19Å; F772-F939 HydrophobicContact CB-CZ 3.92Å; D777-F939 HydrophobicContact CB-CD2 4.39Å; D777-F939 HydrophobicContact CB-CE1 4.41Å; D777-F939 HydrophobicContact CB-CE2 3.45Å; D777-F939 VanDerWaalsContact CB-CE2 3.45Å; D777-F939 HydrophobicContact CB-CZ 3.46Å; D777-F939 VanDerWaalsContact CB-CZ 3.46Å; D777-F939 VanDerWaalsContact CG-CZ 3.48Å; D777-F939 VanDerWaalsContact OD2-CE1 3.31Å; D777-F939 WeakPolarHBondContact OD2-CE1 3.43Å; D777-F939 WeakPolarHBondContact OD2-CZ 3.4Å; I782-F939 HydrophobicContact CD1-CE2 4.12Å; I782-F939 HydrophobicContact CD1-CZ 3.61Å; I782-F939 HydrophobicContact CG1-CE1 4.39Å; I782-F939 HydrophobicContact CG1-CE2 3.63Å; I782-F939 HydrophobicContact CG1-CZ 3.4Å
940	V	26	Very low	26.4	Very low	107 Å²	107	118.4 Å²	118.4	65%	0.648	65%	0.651	S	S	*	*			trans	-121.2	97	168.5	-177	0	0	0	0	109.3	N942	V940-N942 VanDerWaalsContact C-N 3.28Å; V940-N942 PolarHBondContact O-N 3.36Å
941	V	28.1	Very low	26.6	Very low	98 Å²	98	120.5 Å²	120.5	59%	0.594	66%	0.658	S	S	*	*			trans	-72.1	84.6	175.4	-176.7	0	0	0	0	109.3	K943 V944	V941-K943 VanDerWaalsContact C-N 3.27Å; V941-K943 PolarHBondContact O-N 3.21Å; V941-V944 HydrophobicContact CG1-CG2 4.15Å
942	N	27.4	Very low	26.8	Very low	128 Å²	128	118.9 Å²	118.9	68%	0.684	66%	0.655	S	S	*	*			trans	-72.5	81.7	177.9	-93.9	-48.2	0	0	0	111.3	V940	V940-N942 VanDerWaalsContact C-N 3.28Å; V940-N942 PolarHBondContact O-N 3.36Å
943	K	28.6	Very low	26.9	Very low	115 Å²	115	117.4 Å²	117.4	50%	0.5	65%	0.652	S	S	.	*			trans	63.2	90.9	158.6	-170	-173.7	-175.9	-177.6	0	115.3	V941 V945	V941-K943 VanDerWaalsContact C-N 3.27Å; V941-K943 PolarHBondContact O-N 3.21Å; K943-V945 PolarHBondContact O-N 3.04Å
944	V	29.3	Very low	27.2	Very low	45 Å²	45	118.1 Å²	118.1	27%	0.273	65%	0.651	S	S	.	*			trans	-60.7	132.6	165.8	-175.9	0	0	0	0	110.2	I768 F791 V941	I768-V944 HydrophobicContact CG2-CG1 4.12Å; F791-V944 HydrophobicContact CE1-CG1 4.11Å; F791-V944 HydrophobicContact CE2-CB 4.24Å; F791-V944 HydrophobicContact CE2-CG1 3.86Å; F791-V944 HydrophobicContact CE2-CG2 3.89Å; F791-V944 HydrophobicContact CZ-CB 4.09Å; F791-V944 HydrophobicContact CZ-CG1 3.51Å; F791-V944 HydrophobicContact CZ-CG2 4.26Å; V941-V944 HydrophobicContact CG1-CG2 4.15Å
945	V	28.3	Very low	27.5	Very low	105 Å²	105	115.6 Å²	115.6	64%	0.636	65%	0.648	S	S	*	*			trans	-105.5	92.5	170	-179.4	0	0	0	0	107.4	K943	K943-V945 PolarHBondContact O-N 3.04Å
946	A	28.3	Very low	27.7	Very low	41 Å²	41	113.3 Å²	113.3	34%	0.339	65%	0.65	S	S	.	*			trans	-80.2	123	170.2	0	0	0	0	0	109.4	F791 E948	F791-A946 HydrophobicContact CE1-CB 4.43Å; A946-E948 PolarHBondContact O-N 3.47Å
947	S	28.2	Very low	28	Very low	80 Å²	80	111.5 Å²	111.5	56%	0.559	64%	0.644	S	S	*	*			trans	-82.3	101.2	163.5	57	0	0	0	0	108.6
948	E	29.4	Very low	28.2	Very low	152 Å²	152	114.5 Å²	114.5	71%	0.71	64%	0.64	S	S	*	*			trans	-78.9	126.4	173	-65.5	-171.1	136.6	0	0	110.4	R766 A946	R766-E948 IonicContact NH2-OE1 2.68Å; A946-E948 PolarHBondContact O-N 3.47Å
949	S	27.8	Very low	28.3	Very low	97 Å²	97	109.3 Å²	109.3	68%	0.678	64%	0.636	S	S	*	*			trans	-59.8	140.5	157.6	-58.3	0	0	0	0	108.6	E951	S949-E951 VanDerWaalsContact C-N 3.26Å; S949-E951 PolarHBondContact O-N 2.75Å
950	P	28.5	Very low	28.7	Very low	100 Å²	100	111.7 Å²	111.7	65%	0.649	66%	0.661	S	S	*	*			trans	-74.5	79.4	179.6	31.4	-36.1	0	0	0	111
951	E	26.5	Very low	29	Very low	173 Å²	173	112.2 Å²	112.2	81%	0.808	67%	0.67	S	S	*	*			trans	-82.5	131.3	169.8	-167.5	161.5	-129.4	0	0	109.3	S949 V953	S949-E951 VanDerWaalsContact C-N 3.26Å; S949-E951 PolarHBondContact O-N 2.75Å; E951-V953 VanDerWaalsContact C-N 3.35Å; E951-V953 PolarHBondContact O-N 3.3Å
952	V	27.7	Very low	29.3	Very low	131 Å²	131	111.2 Å²	111.2	79%	0.794	68%	0.679	S	S	*	*			trans	-81.1	81.7	-171.2	-176.7	0	0	0	0	110.2	V954	V952-V954 HydrophobicContact CG1-CG2 4.49Å; V952-V954 PolarHBondContact O-N 3.3Å
953	V	26.3	Very low	29.4	Very low	123 Å²	123	112.7 Å²	112.7	75%	0.745	69%	0.687	S	S	*	*			trans	-76.8	102.4	174	-177.1	0	0	0	0	109.7	E951	E951-V953 VanDerWaalsContact C-N 3.35Å; E951-V953 PolarHBondContact O-N 3.3Å
954	V	28.9	Very low	29.5	Very low	112 Å²	112	113.2 Å²	113.2	68%	0.679	71%	0.705	S	S	*	*			trans	-74.2	127.9	171.2	-175.5	0	0	0	0	109	V952	V952-V954 HydrophobicContact CG1-CG2 4.49Å; V952-V954 PolarHBondContact O-N 3.3Å
955	P	32.4	Very low	29.4	Very low	97 Å²	97	116 Å²	116	63%	0.63	73%	0.733	S	S	*	*			trans	-70.6	136	176.6	28.7	-34	0	0	0	110.8	V957	P955-V957 PolarHBondContact O-N 3.02Å
956	P	27.6	Very low	29.6	Very low	113 Å²	113	116 Å²	116	73%	0.734	74%	0.744	S	S	*	*			trans	-71.9	111.9	176.1	28.7	-33.1	0	0	0	110.4	N958	P956-N958 PolarHBondContact O-N 3.1Å
957	V	30.4	Very low	29.5	Very low	126 Å²	126	119.5 Å²	119.5	76%	0.764	77%	0.766	S	S	*	*			trans	-77.9	99.7	169.5	179.7	0	0	0	0	108.3	P955 T959	P955-V957 PolarHBondContact O-N 3.02Å; V957-T959 PolarHBondContact O-N 3.4Å; V957-T959 VanDerWaalsContact O-N 3.09Å
958	N	29.4	Very low	29.6	Very low	148 Å²	148	121.5 Å²	121.5	79%	0.791	77%	0.774	S	S	*	*			trans	-65.6	106.9	177	-76.7	-19.6	0	0	0	111	P956 S960	P956-N958 PolarHBondContact O-N 3.1Å; N958-S960 PolarHBondContact O-N 2.97Å
959	T	27.9	Very low	29.6	Very low	134 Å²	134	122.6 Å²	122.6	82%	0.822	78%	0.779	S	S	*	*			trans	-84.7	107.3	171.3	52.2	0	0	0	0	110.9	V957	V957-T959 PolarHBondContact O-N 3.4Å; V957-T959 VanDerWaalsContact O-N 3.09Å
960	S	36.4	Very low	29.9	Very low	121 Å²	121	124 Å²	124	85%	0.846	78%	0.784	S	S	*	*			trans	-111.2	90.1	166.2	59.4	0	0	0	0	110.3	N958	N958-S960 PolarHBondContact O-N 2.97Å
961	S	31.4	Very low	30.3	Very low	118 Å²	118	125.4 Å²	125.4	83%	0.825	79%	0.793	S	S	*	*			trans	-77.2	125	174.8	54.3	0	0	0	0	111.4
962	G	33.7	Very low	30.3	Very low	76 Å²	76	123.5 Å²	123.5	78%	0.784	78%	0.784	S	S	*	*			trans	-126.1	108.5	170.9	0	0	0	0	0	110.8
963	N	30.1	Very low	30.5	Very low	159 Å²	159	124.2 Å²	124.2	85%	0.85	79%	0.788	S	S	*	*			trans	-76.2	143.1	177.1	-67.6	-27.8	0	0	0	111.4
964	S	31.4	Very low	30.5	Very low	127 Å²	127	124.8 Å²	124.8	89%	0.888	78%	0.783	S	S	*	*				-172.1	153.3	122.2	35.9	0	0	0	0	110.5
965	A	27.6	Very low	30.5	Very low	104 Å²	104	128.3 Å²	128.3	86%	0.86	79%	0.792	S	S	*	*			trans	-108.1	141.8	177.4	0	0	0	0	0	110.1
966	A	31.9	Very low	30.6	Very low	104 Å²	104	128.6 Å²	128.6	86%	0.86	80%	0.803	S	S	*	*			trans	-142.4	126.8	158.9	0	0	0	0	0	108.3
967	S	26.1	Very low	30.6	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	81%	0.805	S	S	*	*			trans	-86.3	147.7	164.1	178.1	0	0	0	0	108.5
968	V	30.5	Very low	31.2	Very low	121 Å²	121	127.3 Å²	127.3	73%	0.733	80%	0.799	S	S	*	*			trans	-168.3	115.2	143.4	135.3	0	0	0	0	110.3
969	Q	29.9	Very low	31.3	Very low	175 Å²	175	128.1 Å²	128.1	82%	0.818	80%	0.799	S	S	*	*			trans	39.2	144	140.9	-64.7	159.8	-36	0	0	122.7
970	T	32.4	Very low	31.7	Very low	127 Å²	127	128 Å²	128	78%	0.779	79%	0.793	S	S	*	*			trans	-71.2	175	165.7	48.6	0	0	0	0	112
971	P	36.8	Very low	31.6	Very low	130 Å²	130	128.6 Å²	128.6	84%	0.844	79%	0.785	S	S	*	*				-132	149.7	99.2	38	-30.8	0	0	0	115.8
972	E	26.5	Very low	31.9	Very low	133 Å²	133	128.2 Å²	128.2	62%	0.621	77%	0.774	S	S	*	*			trans	-69	148	167.3	162	-176.6	-157.1	0	0	112.9	Q974	E972-Q974 HydrophobicContact CG-CG 4.1Å; E972-Q974 PolarHBondContact OE1-NE2 3.04Å
973	V	33.6	Very low	32	Very low	145 Å²	145	132.4 Å²	132.4	88%	0.879	77%	0.771	S	S	*	*			trans	-138.9	133.9	150.4	-179.5	0	0	0	0	107.6
974	Q	25.8	Very low	32.3	Very low	136 Å²	136	129.6 Å²	129.6	64%	0.636	77%	0.77	S	S	*	*			trans	-99.9	162.3	-179.9	-55	174.9	2.4	0	0	110.7	E972	E972-Q974 HydrophobicContact CG-CG 4.1Å; E972-Q974 PolarHBondContact OE1-NE2 3.04Å
975	E	29	Very low	32.4	Very low	185 Å²	185	128.1 Å²	128.1	86%	0.864	76%	0.759	S	S	*	*				166.1	159.8	112.2	-89.2	-163.1	146.2	0	0	114.8
976	A	33.6	Very low	32.8	Very low	103 Å²	103	130.7 Å²	130.7	85%	0.851	76%	0.757	S	S	*	*			trans	76.9	144	156.2	0	0	0	0	0	121.9
977	S	28.1	Very low	32.9	Very low	113 Å²	113	130.6 Å²	130.6	79%	0.79	75%	0.745	S	S	*	*			trans	178.5	174.3	-171.1	-153.6	0	0	0	0	106.7
978	P	42.6	Very low	33.3	Very low	99 Å²	99	133.3 Å²	133.3	64%	0.643	75%	0.745	S	S	*	*			cis	-129.3	-157.6	-22.7	30.3	-6.8	0	0	0	112.6
979	Q	32.9	Very low	33.6	Very low	166 Å²	166	132.8 Å²	132.8	78%	0.776	75%	0.747	S	S	*	*			trans	105.8	153	135.3	-101.4	167.2	-22.1	0	0	123.2
980	D	35.1	Very low	33.8	Very low	130 Å²	130	129.3 Å²	129.3	70%	0.695	75%	0.748	S	S	*	*			trans	74.6	142.6	164.1	-65.3	0	0	0	0	122.8
981	I	34.5	Very low	33.8	Very low	134 Å²	134	128.3 Å²	128.3	69%	0.687	75%	0.753	S	S	*	*			cis	-168.1	162.2	-32.1	-126.6	172	0	0	0	111.4
982	D	37.6	Very low	33.7	Very low	111 Å²	111	126.7 Å²	126.7	59%	0.594	75%	0.75	S	S	*	*			trans	67.7	149.4	160.2	-83.7	13.5	0	0	0	122.8
983	K	35.8	Very low	34	Very low	164 Å²	164	126.1 Å²	126.1	71%	0.713	76%	0.756	S	S	*	*			cis	-167.7	149.7	-18.3	-124.9	-179.7	-163	85.8	0	113.1
984	A	35.9	Very low	34.1	Very low	100 Å²	100	127 Å²	127	83%	0.826	75%	0.753	S	S	*	*			trans	70.1	151.5	154.6	0	0	0	0	0	119.4
985	S	34.8	Very low	34.8	Very low	95 Å²	95	125.9 Å²	125.9	66%	0.664	76%	0.757	S	S	*	*			cis	-158	142.6	11.3	64.8	0	0	0	0	116.4
986	I	34.9	Very low	35.2	Very low	158 Å²	158	122 Å²	122	81%	0.81	75%	0.748	S	S	*	*			trans	66.2	132.2	132.2	-70.6	172.2	0	0	0	119.6
987	V	34.7	Very low	35	Very low	103 Å²	103	125.3 Å²	125.3	62%	0.624	75%	0.751	S	S	*	*			cis	-168	145.4	-7.3	100.7	0	0	0	0	113.3
988	Q	34	Very low	35.3	Very low	172 Å²	172	123.7 Å²	123.7	80%	0.804	74%	0.744	S	S	*	*			trans	51.2	159.4	151.4	-68.9	162.2	3.3	0	0	121.4
989	S	37.2	Very low	34.7	Very low	110 Å²	110	124.2 Å²	124.2	77%	0.769	75%	0.75	S	S	*	*			cis	-164.8	160.6	-8.2	37.6	0	0	0	0	108.5
990	A	33.6	Very low	34.7	Very low	102 Å²	102	124.4 Å²	124.4	84%	0.843	75%	0.751	S	S	*	*			cis	-157	165.2	-14.8	0	0	0	0	0	109.7
991	A	31.7	Very low	34.4	Very low	106 Å²	106	125.2 Å²	125.2	88%	0.876	76%	0.755	S	S	*	*			trans	-146.3	149.5	168.3	0	0	0	0	0	110.1
992	A	36.1	Very low	34.4	Very low	96 Å²	96	125.9 Å²	125.9	79%	0.793	77%	0.765	S	S	*	*			trans	-160	150.7	-177.6	0	0	0	0	0	110.4
993	T	33.1	Very low	34	Very low	121 Å²	121	127.9 Å²	127.9	74%	0.742	77%	0.768	S	S	*	*			cis	-157.7	149.4	-18.6	-85.6	0	0	0	0	107.8
994	M	35.3	Very low	33.9	Very low	163 Å²	163	124.3 Å²	124.3	80%	0.803	77%	0.77	S	S	*	*			trans	-123.3	143.2	164.9	-81.9	-77.3	-66.9	0	0	109
995	P	39.4	Very low	33.5	Very low	113 Å²	113	126.4 Å²	126.4	73%	0.734	76%	0.762	S	S	*	*			trans	-138.5	136.3	138.5	35.4	-22.2	0	0	0	113.3
996	P	37.2	Very low	33.4	Very low	104 Å²	104	128.3 Å²	128.3	68%	0.675	77%	0.77	S	S	*	*			trans	-100.2	159.1	167.3	37.7	-31.9	0	0	0	112.1
997	L	30.8	Very low	33.2	Very low	172 Å²	172	126.2 Å²	126.2	90%	0.901	77%	0.769	S	S	*	*			trans	172.4	154.9	130.3	-95.7	163.3	0	0	0	114.4
998	A	33.1	Very low	33.4	Very low	78 Å²	78	127.3 Å²	127.3	65%	0.645	78%	0.778	S	S	*	*			trans	65.1	98.6	148	0	0	0	0	0	122.5
999	S	30.4	Very low	33.1	Very low	110 Å²	110	123.4 Å²	123.4	77%	0.769	78%	0.775	S	S	*	*				94.1	132.8	112.8	-61	0	0	0	0	123.2
1000	Q	33.5	Very low	32.7	Very low	171 Å²	171	127.2 Å²	127.2	80%	0.799	78%	0.781	S	S	*	*			trans	77.1	99.8	150	-70.4	174.1	4.1	0	0	120.9
1001	D	29.8	Very low	32.8	Very low	147 Å²	147	127.6 Å²	127.6	79%	0.786	78%	0.775	S	S	*	*				39.3	127.1	119.7	-50.4	-61.9	0	0	0	118.8
1002	V	32.6	Very low	32.4	Very low	147 Å²	147	127.8 Å²	127.8	89%	0.891	77%	0.769	S	S	*	*				-161.7	156.2	67.2	157.4	0	0	0	0	112.3
1003	K	29.8	Very low	32	Very low	153 Å²	153	128.7 Å²	128.7	67%	0.665	76%	0.764	S	S	*	*			trans	-91.9	133.3	-170.4	-175.3	-168.1	-174	-148.1	0	115.7	E1005	K1003-E1005 VanDerWaalsContact CE-OE1 3.24Å; K1003-E1005 WeakPolarHBondContact CE-OE1 3.39Å; K1003-E1005 IonicContact NZ-OE1 3.8Å; K1003-E1005 PolarHBondContact NZ-OE1 2.84Å; K1003-E1005 IonicContact NZ-OE2 3.15Å
1004	A	33.8	Very low	31.8	Very low	90 Å²	90	130.9 Å²	130.9	74%	0.744	77%	0.77	S	S	*	*			trans	-171.4	121.4	144.4	0	0	0	0	0	108.2
1005	E	27.5	Very low	31.6	Very low	144 Å²	144	126.5 Å²	126.5	67%	0.673	77%	0.767	S	S	*	*				65.6	105.6	61	-69.8	177.8	163.2	0	0	114.5	K1003	K1003-E1005 VanDerWaalsContact CE-OE1 3.24Å; K1003-E1005 WeakPolarHBondContact CE-OE1 3.39Å; K1003-E1005 IonicContact NZ-OE1 3.8Å; K1003-E1005 PolarHBondContact NZ-OE1 2.84Å; K1003-E1005 IonicContact NZ-OE2 3.15Å
1006	V	32.6	Very low	31.1	Very low	135 Å²	135	125.8 Å²	125.8	82%	0.818	77%	0.765	S	S	*	*				171.4	114	115.1	158.5	0	0	0	0	112.4
1007	S	30.6	Very low	31	Very low	113 Å²	113	127.7 Å²	127.7	79%	0.79	77%	0.77	S	S	*	*			trans	55.3	154.8	145	-56.3	0	0	0	0	124.7
1008	P	38.9	Very low	31	Very low	126 Å²	126	124.1 Å²	124.1	82%	0.818	76%	0.759	S	S	*	*			trans	-113.5	164	-176.1	42.2	-33.1	0	0	0	115.3
1009	A	27.9	Very low	30.9	Very low	90 Å²	90	129 Å²	129	74%	0.744	77%	0.768	S	S	*	*			trans	-162.4	138.4	157.1	0	0	0	0	0	114
1010	E	28.7	Very low	30.8	Very low	191 Å²	191	128.3 Å²	128.3	89%	0.893	77%	0.77	S	S	*	*			trans	68.2	160.5	142.7	-70.7	-172	176.6	0	0	122.7
1011	P	35.1	Very low	30.7	Very low	110 Å²	110	126.7 Å²	126.7	71%	0.714	77%	0.771	S	S	*	*			trans	-123.3	-150.2	-153.3	44	-28.2	0	0	0	113.8
1012	C	25	Very low	30.8	Very low	110 Å²	110	124.6 Å²	124.6	74%	0.743	77%	0.768	S	S	*	*			trans	74.8	150	177.6	-60.1	0	0	0	0	114
1013	T	28	Very low	30.9	Very low	115 Å²	115	122.9 Å²	122.9	71%	0.706	77%	0.769	S	S	*	*			cis	-165.4	158.5	-5.8	10.9	0	0	0	0	110.5
1014	L	27.5	Very low	31	Very low	166 Å²	166	119 Å²	119	87%	0.869	77%	0.772	S	S	*	*			trans	65.4	145.2	147.9	-68.6	163	0	0	0	121
1015	G	31.3	Very low	31	Very low	71 Å²	71	125.6 Å²	125.6	73%	0.732	78%	0.778	S	S	*	*			trans	86.9	136.5	152.8	0	0	0	0	0	117.2
1016	S	29.5	Very low	31.2	Very low	98 Å²	98	124.7 Å²	124.7	69%	0.685	78%	0.778	S	S	*	*			cis	-175.4	171.4	-36.6	42.6	0	0	0	0	107.1
1017	D	33.8	Very low	31.1	Very low	145 Å²	145	122.2 Å²	122.2	78%	0.775	77%	0.766	S	S	*	*			trans	69.6	144.7	159.7	-46	-51.8	0	0	0	117.9
1018	S	30.7	Very low	30.9	Very low	96 Å²	96	121.6 Å²	121.6	67%	0.671	75%	0.753	S	S	*	*			cis	-164.3	-174.5	-20.9	52.3	0	0	0	0	109
1019	E	31	Very low	30.3	Very low	180 Å²	180	121 Å²	121	84%	0.841	74%	0.735	S	S	*	*			trans	62.5	95.8	172.4	-51.9	-166	149.7	0	0	115.7
1020	A	29.3	Very low	30.3	Very low	97 Å²	97	121.4 Å²	121.4	80%	0.802	74%	0.738	S	S	*	*			cis	74.3	120.7	34.4	0	0	0	0	0	116.1
1021	V	31	Very low	30.3	Very low	136 Å²	136	117.8 Å²	117.8	82%	0.824	73%	0.729	S	S	*	*			trans	-167.4	131.8	134.1	138.2	0	0	0	0	111.8
1022	S	32.2	Very low	30	Very low	104 Å²	104	116.4 Å²	116.4	73%	0.727	73%	0.727	S	S	*	*			trans	48.1	114.5	161.6	68.2	0	0	0	0	123.5
1023	A	35.1	Very low	30.2	Very low	110 Å²	110	114 Å²	114	91%	0.909	71%	0.711	S	S	*	*			trans	64.5	142.7	133.4	0	0	0	0	0	122.2
1024	G	31.4	Very low	30.5	Very low	71 Å²	71	113.6 Å²	113.6	73%	0.732	72%	0.719	S	S	*	*			cis	152.7	119.4	-12.5	0	0	0	0	0	116.7
1025	R	33.1	Very low	30.8	Very low	229 Å²	229	112.4 Å²	112.4	86%	0.864	71%	0.707	S	S	*	*			trans	70.8	115.6	152.5	-71.7	-166.2	163.1	126.5	0.6	122.6
1026	D	32.1	Very low	30.6	Very low	126 Å²	126	116.3 Å²	116.3	67%	0.674	71%	0.706	S	S	*	*				78.7	113.7	115.8	-51.6	-15.7	0	0	0	124
1027	S	30.2	Very low	30.7	Very low	83 Å²	83	118.8 Å²	118.8	58%	0.58	72%	0.717	S	S	*	*				75.2	99.4	123.6	-63.5	0	0	0	0	122.9	K1268	S1027-K1268 PolarHBondContact O-NZ 3.29Å
1028	L	28	Very low	30.6	Very low	99 Å²	99	114.8 Å²	114.8	52%	0.518	71%	0.71	S	S	.	*				56.3	131	125.1	-71.6	162.7	0	0	0	121.3	K1268	L1028-K1268 PolarHBondContact O-NZ 2.89Å
1029	R	25.7	Very low	30.3	Very low	115 Å²	115	118.6 Å²	118.6	43%	0.434	72%	0.722	S	S	.	*			trans	55.9	112.9	168.9	-95.1	-161.4	-156.2	173.6	4.6	120.3	V1031 D1264 S1265 S1266 A1267	R1029-V1031 HydrophobicContact CG-CG2 4.25Å; R1029-D1264 IonicContact NH2-OD1 3.49Å; R1029-S1265 WeakPolarHBondContact CG-O 3.26Å; R1029-S1265 PolarHBondContact NE-O 3.33Å; R1029-S1266 WeakPolarHBondContact CB-O 3.5Å; R1029-S1266 VanDerWaalsContact CD-C 3.46Å; R1029-S1266 WeakPolarHBondContact CD-O 3.16Å; R1029-S1266 WeakPolarHBondContact CG-O 3.39Å; R1029-S1266 VanDerWaalsContact CZ-C 3.45Å; R1029-S1266 PolarHBondContact NE-O 2.79Å; R1029-A1267 WeakPolarHBondContact CB-O 3.42Å; R1029-A1267 VanDerWaalsContact CD-O 3.25Å; R1029-A1267 WeakPolarHBondContact CD-O 3.31Å
1030	A	28.4	Very low	30.1	Very low	97 Å²	97	114.6 Å²	114.6	80%	0.802	72%	0.72	S	S	*	*				-157.2	134.3	113	0	0	0	0	0	106.9
1031	V	28.2	Very low	30.1	Very low	116 Å²	116	118.4 Å²	118.4	70%	0.703	72%	0.721	S	S	*	*			cis	82.4	114.1	34.9	-176.5	0	0	0	0	114.2	R1029	R1029-V1031 HydrophobicContact CG-CG2 4.25Å
1032	A	28.3	Very low	30	Very low	81 Å²	81	123.1 Å²	123.1	67%	0.669	72%	0.724	S	S	*	*			trans	70	108.5	157.8	0	0	0	0	0	121.1
1033	S	29.3	Very low	29.7	Very low	60 Å²	60	125.1 Å²	125.1	42%	0.42	73%	0.732	S	S	.	*				144.5	103	92.9	-163	0	0	0	0	115.2
1034	A	34.5	Very low	29.3	Very low	106 Å²	106	123.1 Å²	123.1	88%	0.876	72%	0.716	S	S	*	*			trans	-162.8	82.8	149.2	0	0	0	0	0	105.9
1035	K	33.2	Very low	29.2	Very low	141 Å²	141	130 Å²	130	61%	0.613	73%	0.729	S	S	*	*			cis	92.3	97.1	37.7	-161.3	177.6	-170.8	-76.8	0	112.6
1036	E	27.6	Very low	29	Very low	152 Å²	152	122.7 Å²	122.7	71%	0.71	72%	0.717	S	S	*	*			trans	65.1	81.2	149.7	-64.4	169	164.5	0	0	119.5
1037	V	32.4	Very low	29	Very low	150 Å²	150	123.5 Å²	123.5	91%	0.909	72%	0.722	S	S	*	*				-121.2	120	116.7	-179.9	0	0	0	0	105.1
1038	G	30.1	Very low	29	Very low	62 Å²	62	126 Å²	126	64%	0.639	73%	0.733	S	S	*	*				77.9	76.9	88.7	0	0	0	0	0	109.1
1039	L	25.9	Very low	29.1	Very low	175 Å²	175	128.1 Å²	128.1	92%	0.916	74%	0.744	S	S	*	*				62	120.4	74.5	-166.4	72.6	0	0	0	112.8
1040	A	25.9	Very low	29.2	Very low	96 Å²	96	128.8 Å²	128.8	79%	0.793	76%	0.762	S	S	*	*			trans	77.6	96.2	177.8	0	0	0	0	0	117.6
1041	E	29.1	Very low	29.2	Very low	178 Å²	178	132.8 Å²	132.8	83%	0.832	76%	0.764	S	S	*	*			trans	-146.9	87.7	133.5	-150.5	165.3	-133.9	0	0	111.4
1042	R	29.3	Very low	29.3	Very low	234 Å²	234	132.8 Å²	132.8	88%	0.883	77%	0.769	S	S	*	*	S	Bend	trans	-124.5	145.2	149.8	-82.4	-176.3	170.5	-177.3	-4.2	105.4
1043	T	26.7	Very low	29.2	Very low	147 Å²	147	138.2 Å²	138.2	90%	0.902	78%	0.777	S	S	*	*	S	Bend	trans	60	81.1	-177.7	63.4	0	0	0	0	116.1
1044	A	26.8	Very low	29.3	Very low	68 Å²	68	144.3 Å²	144.3	56%	0.562	80%	0.799	S	S	*	*			trans	-169.8	96.9	143.7	0	0	0	0	0	112.8
1045	E	28	Very low	29.1	Very low	214 Å²	214	147.8 Å²	147.8	100%	1	80%	0.797	S	S	*	*	S	Bend	trans	-122.1	65.1	139	-89.6	-159.8	149.8	0	0	106.7
1046	A	29.8	Very low	28.8	Very low	76 Å²	76	149.5 Å²	149.5	63%	0.628	81%	0.812	S	S	*	*	S	Bend	trans	-152.3	135.6	173.3	0	0	0	0	0	108.2
1047	D	31.2	Very low	29	Very low	143 Å²	143	145.5 Å²	145.5	77%	0.765	81%	0.812	S	S	*	*			trans	57.6	73.7	167.9	-57.9	-22.2	0	0	0	119.1
1048	V	30.2	Very low	28.9	Very low	136 Å²	136	144.5 Å²	144.5	82%	0.824	81%	0.808	S	S	*	*			trans	-139.2	122	150.3	-179.4	0	0	0	0	107.5
1049	L	31	Very low	28.9	Very low	143 Å²	143	147.5 Å²	147.5	75%	0.749	81%	0.814	S	S	*	*			cis	-112	150.3	-4.3	-65.1	92.4	0	0	0	111.6
1050	T	26.7	Very low	28.9	Very low	130 Å²	130	144.8 Å²	144.8	80%	0.798	81%	0.805	S	S	*	*			trans	-114.1	65.7	160.2	38.1	0	0	0	0	110.9
1051	E	29	Very low	29.1	Very low	181 Å²	181	152 Å²	152	85%	0.846	81%	0.812	S	S	*	*			trans	-140.7	67.8	178.4	-144	160.9	-124.9	0	0	114.1
1052	S	30.4	Very low	29.1	Very low	116 Å²	116	148.8 Å²	148.8	81%	0.811	81%	0.809	S	S	*	*			trans	-159	78.8	152.3	57.1	0	0	0	0	109.5
1053	K	26	Very low	29	Very low	195 Å²	195	144.8 Å²	144.8	85%	0.848	80%	0.802	S	S	*	*			trans	-75.2	168.6	150.6	-77.4	176.6	175.5	171.5	0	108.2
1054	E	30.6	Very low	29.4	Very low	188 Å²	188	143.6 Å²	143.6	88%	0.879	80%	0.797	S	S	*	*			trans	73	125.6	-173.5	-50.1	174.4	174.4	0	0	111.2
1055	E	30.4	Very low	29.4	Very low	178 Å²	178	146.4 Å²	146.4	83%	0.832	80%	0.803	S	S	*	*			cis	-130.6	155.3	-7.4	-61.6	-170.6	112.5	0	0	108.2
1056	L	28.4	Very low	29.6	Very low	178 Å²	178	142.3 Å²	142.3	93%	0.932	79%	0.792	S	S	*	*				58	59.7	55.6	-88.3	170	0	0	0	115.4
1057	G	30.1	Very low	29.6	Very low	68 Å²	68	144.3 Å²	144.3	70%	0.701	79%	0.791	S	S	*	*			trans	-169.2	121.5	169.8	0	0	0	0	0	116.6
1058	P	31.6	Very low	29.6	Very low	128 Å²	128	143.8 Å²	143.8	83%	0.831	78%	0.784	S	S	*	*			trans	-108.5	114.6	177.2	35.8	-28	0	0	0	114.7
1059	T	30.2	Very low	29.7	Very low	125 Å²	125	146.7 Å²	146.7	77%	0.767	78%	0.78	S	S	*	*			trans	-164	127.3	164.5	35.7	0	0	0	0	108.4
1060	T	26.2	Very low	29.8	Very low	119 Å²	119	145.8 Å²	145.8	73%	0.73	78%	0.781	S	S	*	*				61.7	125.8	67.9	71.3	0	0	0	0	116.8
1061	R	28.5	Very low	30.2	Very low	246 Å²	246	143.5 Å²	143.5	93%	0.928	78%	0.775	S	S	*	*			trans	69.9	148.8	177.1	-57.4	175.4	167	174.1	-5.1	114
1062	S	29.9	Very low	30.4	Very low	111 Å²	111	143.7 Å²	143.7	78%	0.776	78%	0.776	S	S	*	*			cis	-150.5	158.4	11.4	-165.3	0	0	0	0	112.2
1063	M	27.6	Very low	30.5	Very low	150 Å²	150	147.4 Å²	147.4	74%	0.739	78%	0.781	S	S	*	*			trans	-80.8	165.3	154.5	-66	-170.2	74.3	0	0	110.9
1064	P	34.4	Very low	30.8	Very low	123 Å²	123	142.1 Å²	142.1	80%	0.799	78%	0.781	S	S	*	*			trans	-106	133.9	140.2	-8.9	28.1	0	0	0	111.8
1065	N	27.6	Very low	30.7	Very low	127 Å²	127	143 Å²	143	68%	0.679	78%	0.776	S	S	*	*			trans	-85	159.7	166.5	-71.9	-49.7	0	0	0	111	I1067	N1065-I1067 HydrophobicContact CB-CD1 4.27Å
1066	T	31.9	Very low	30.8	Very low	127 Å²	127	139.6 Å²	139.6	78%	0.779	77%	0.77	S	S	*	*			trans	176.1	98.3	132.9	-73.7	0	0	0	0	108.1
1067	I	28.8	Very low	31	Very low	118 Å²	118	137 Å²	137	61%	0.605	76%	0.764	S	S	*	*				74.5	114.9	73.6	-65.7	166.1	0	0	0	110.2	N1065	N1065-I1067 HydrophobicContact CB-CD1 4.27Å
1068	H	32.2	Very low	30.9	Very low	133 Å²	133	139.2 Å²	139.2	62%	0.616	76%	0.763	S	S	*	*				-168.6	152.4	53.8	-109.8	-38.5	0	0	0	114.6
1069	R	32.7	Very low	30.9	Very low	196 Å²	196	137 Å²	137	74%	0.74	76%	0.756	S	S	*	*			trans	59.8	144.9	142.3	-67.1	175.5	-179.6	119.9	6.5	120.1
1070	T	33.6	Very low	31.1	Very low	124 Å²	124	136.1 Å²	136.1	76%	0.761	75%	0.746	S	S	*	*			cis	-155.4	136.1	2.5	10.4	0	0	0	0	108.5
1071	A	35	Very low	31.6	Very low	82 Å²	82	135.3 Å²	135.3	68%	0.678	74%	0.737	S	S	*	*				59.8	134	93.5	0	0	0	0	0	115.2
1072	E	31.7	Very low	31.9	Very low	185 Å²	185	125.5 Å²	125.5	86%	0.864	71%	0.712	S	S	*	*			cis	-149.7	173.1	1.7	-105.5	159.5	171.8	0	0	108
1073	E	32.9	Very low	32.3	Very low	195 Å²	195	126.7 Å²	126.7	91%	0.911	71%	0.705	S	S	*	*			cis	-145.6	166.8	35.5	-56	174.4	126.6	0	0	112.9
1074	G	32.2	Very low	32.8	Very low	83 Å²	83	124 Å²	124	86%	0.856	69%	0.694	S	S	*	*			trans	92.5	79	148.7	0	0	0	0	0	120.2
1075	R	28	Very low	32.8	Very low	207 Å²	207	121.1 Å²	121.1	78%	0.781	68%	0.679	S	S	*	*			trans	-146.6	134.6	170.2	163.9	-178.7	-90.7	-126.2	3.9	112.8
1076	P	33	Very low	33.3	Very low	107 Å²	107	120.8 Å²	120.8	70%	0.695	68%	0.675	S	S	*	*			trans	-81.1	153	161.8	33.6	-32.9	0	0	0	111.9
1077	P	32.5	Very low	33.6	Very low	124 Å²	124	120.2 Å²	120.2	81%	0.805	66%	0.664	S	S	*	*			trans	-76.7	151	-158.2	29.3	-36.7	0	0	0	115.6
1078	V	27.6	Very low	34.1	Very low	114 Å²	114	120.4 Å²	120.4	69%	0.691	67%	0.665	S	S	*	*			trans	-126.6	109.4	165.9	177.9	0	0	0	0	107.9
1079	A	33.1	Very low	34.4	Very low	81 Å²	81	118.7 Å²	118.7	67%	0.669	67%	0.669	S	S	*	*			trans	-159.3	136.2	177.5	0	0	0	0	0	107.2
1080	D	33.4	Very low	34.9	Very low	107 Å²	107	117.1 Å²	117.1	57%	0.572	67%	0.667	S	S	*	*			cis	-130.9	128.2	-9.4	-97.6	-63.7	0	0	0	110.5	E1083	D1080-E1083 HydrophobicContact CB-CB 4.4Å
1081	I	36.2	Very low	35.1	Very low	102 Å²	102	118.1 Å²	118.1	52%	0.523	67%	0.667	S	S	.	*	S	Bend	trans	-110	-17.6	173.6	-70.5	178.9	0	0	0	111.1	A1085	I1081-A1085 WeakPolarHBondContact O-CB 3.21Å; I1081-A1085 PolarHBondContact O-N 2.83Å
1082	G	36.6	Very low	35.3	Very low	40 Å²	40	120.4 Å²	120.4	41%	0.412	67%	0.667	S	S	.	*	H	α-helix	trans	-65.9	-35.7	171.9	0	0	0	0	0	113.2	M1086	G1082-M1086 WeakPolarHBondContact O-CE 3.42Å; G1082-M1086 PolarHBondContact O-N 2.81Å; G1082-M1086 VanDerWaalsContact O-N 3.17Å
1083	E	37.4	Very low	35.5	Very low	136 Å²	136	118.8 Å²	118.8	64%	0.636	66%	0.664	S	S	*	*	H	α-helix	trans	-73.7	-45.4	-177.2	-160.9	157	-127.1	0	0	112.1	D1080 A1085 M1086 E1087	D1080-E1083 HydrophobicContact CB-CB 4.4Å; E1083-A1085 VanDerWaalsContact C-N 3.29Å; E1083-A1085 PolarHBondContact O-N 2.86Å; E1083-M1086 CarbonylContact O-C 3.47Å; E1083-M1086 WeakPolarHBondContact O-CA 3.26Å; E1083-M1086 PolarHBondContact O-N 3.11Å; E1083-E1087 PolarHBondContact O-N 3.39Å
1084	L	37.2	Very low	35.5	Very low	94 Å²	94	117.9 Å²	117.9	49%	0.492	66%	0.664	S	S	.	*	H	α-helix	trans	-64	-30.6	172.9	-81.4	168.3	0	0	0	113.4	M1086 L1088	L1084-M1086 VanDerWaalsContact C-N 3.3Å; L1084-L1088 WeakPolarHBondContact O-CB 3.5Å; L1084-L1088 WeakPolarHBondContact O-CG 3.48Å; L1084-L1088 PolarHBondContact O-N 2.81Å
1085	A	35.8	Very low	35.5	Very low	61 Å²	61	124.2 Å²	124.2	50%	0.504	67%	0.668	S	S	.	*	H	α-helix	trans	-68.4	-29.8	171.8	0	0	0	0	0	112.4	I1081 E1083 S1089	I1081-A1085 WeakPolarHBondContact O-CB 3.21Å; I1081-A1085 PolarHBondContact O-N 2.83Å; E1083-A1085 VanDerWaalsContact C-N 3.29Å; E1083-A1085 PolarHBondContact O-N 2.86Å; A1085-S1089 WeakPolarHBondContact O-CB 2.83Å; A1085-S1089 PolarHBondContact O-N 2.84Å
1086	M	37.7	Very low	35.7	Very low	120 Å²	120	124.4 Å²	124.4	59%	0.591	67%	0.669	S	S	*	*	H	α-helix	trans	-87.4	-21.2	175.1	-74.2	-172.7	-76.9	0	0	114.2	G1082 E1083 L1084 K1090	G1082-M1086 WeakPolarHBondContact O-CE 3.42Å; G1082-M1086 PolarHBondContact O-N 2.81Å; G1082-M1086 VanDerWaalsContact O-N 3.17Å; E1083-M1086 CarbonylContact O-C 3.47Å; E1083-M1086 WeakPolarHBondContact O-CA 3.26Å; E1083-M1086 PolarHBondContact O-N 3.11Å; L1084-M1086 VanDerWaalsContact C-N 3.3Å; M1086-K1090 VanDerWaalsContact O-CD 3.32Å; M1086-K1090 WeakPolarHBondContact O-CD 3.23Å; M1086-K1090 VanDerWaalsContact O-CG 3.26Å; M1086-K1090 WeakPolarHBondContact O-CG 3.38Å
1087	E	39.1	Very low	35.6	Very low	116 Å²	116	125.8 Å²	125.8	54%	0.542	67%	0.666	S	S	.	*	H	α-helix	trans	-76	-44.9	167.9	-75.7	-154.5	124.3	0	0	112.2	E1083 S1089 K1090 L1091	E1083-E1087 PolarHBondContact O-N 3.39Å; E1087-S1089 PolarHBondContact O-N 2.85Å; E1087-K1090 WeakPolarHBondContact O-CA 3.49Å; E1087-K1090 PolarHBondContact O-N 3.35Å; E1087-L1091 PolarHBondContact O-N 3.38Å
1088	L	38.6	Very low	35.8	Very low	121 Å²	121	124.5 Å²	124.5	63%	0.634	66%	0.658	S	S	*	*	H	α-helix	trans	-64.8	-25.6	177.7	-74.8	168.5	0	0	0	112.5	L1084 K1090	L1084-L1088 WeakPolarHBondContact O-CB 3.5Å; L1084-L1088 WeakPolarHBondContact O-CG 3.48Å; L1084-L1088 PolarHBondContact O-N 2.81Å; L1088-K1090 VanDerWaalsContact C-N 3.29Å; L1088-K1090 PolarHBondContact O-N 2.84Å
1089	S	38.7	Very low	35.7	Very low	98 Å²	98	124 Å²	124	69%	0.685	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	9.5	170.5	-166	0	0	0	0	114.5	A1085 E1087	A1085-S1089 WeakPolarHBondContact O-CB 2.83Å; A1085-S1089 PolarHBondContact O-N 2.84Å; E1087-S1089 PolarHBondContact O-N 2.85Å
1090	K	42.7	Very low	35.6	Very low	162 Å²	162	125.8 Å²	125.8	70%	0.704	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.8	-0.2	173.7	-73.3	173.7	-173.5	169.9	0	113.7	M1086 E1087 L1088	M1086-K1090 VanDerWaalsContact O-CD 3.32Å; M1086-K1090 WeakPolarHBondContact O-CD 3.23Å; M1086-K1090 VanDerWaalsContact O-CG 3.26Å; M1086-K1090 WeakPolarHBondContact O-CG 3.38Å; E1087-K1090 WeakPolarHBondContact O-CA 3.49Å; E1087-K1090 PolarHBondContact O-N 3.35Å; L1088-K1090 VanDerWaalsContact C-N 3.29Å; L1088-K1090 PolarHBondContact O-N 2.84Å
1091	L	38.4	Very low	35.6	Very low	145 Å²	145	125.3 Å²	125.3	76%	0.759	67%	0.672	S	S	*	*	S	Bend	trans	-102	7.1	176.5	-84.5	165.5	0	0	0	113.5	E1087	E1087-L1091 PolarHBondContact O-N 3.38Å
1092	I	39.5	Very low	35.5	Very low	131 Å²	131	127.2 Å²	127.2	67%	0.672	69%	0.688	S	S	*	*	S	Bend	trans	-115.1	143.2	163.5	-58.3	178	0	0	0	106.1
1093	D	34.9	Very low	35.4	Very low	151 Å²	151	131 Å²	131	81%	0.807	71%	0.708	S	S	*	*	S	Bend	trans	61.6	67.9	-174.7	-62.8	-23.5	0	0	0	117.2
1094	L	32	Very low	35.3	Very low	175 Å²	175	128 Å²	128	92%	0.916	71%	0.714	S	S	*	*			trans	-165.4	68.1	138.2	-111	173.8	0	0	0	114.8
1095	K	32.4	Very low	35.1	Very low	216 Å²	216	133.7 Å²	133.7	94%	0.939	73%	0.734	S	S	*	*			trans	-150.4	89.2	150	-148.3	172.8	-171.5	179.7	0	112.7
1096	R	32.8	Very low	35	Very low	211 Å²	211	136.7 Å²	136.7	80%	0.796	75%	0.749	S	S	*	*			trans	-128.7	151.2	177.1	-161.7	-170.9	163.4	146.3	1.2	108.5
1097	E	31.4	Very low	35	Very low	136 Å²	136	137.7 Å²	137.7	64%	0.636	76%	0.761	S	S	*	*			trans	69.5	157	172	-53.1	-47.3	150.9	0	0	117.4
1098	P	35.5	Very low	34.8	Very low	98 Å²	98	140.2 Å²	140.2	64%	0.636	77%	0.773	S	S	*	*			cis	-140.5	155.1	-29.3	31.9	-13.3	0	0	0	116.7
1099	S	26.6	Very low	34.7	Very low	104 Å²	104	142.6 Å²	142.6	73%	0.727	78%	0.781	S	S	*	*			trans	71.2	155.9	137.1	74.5	0	0	0	0	123.6
1100	S	30.8	Very low	34.7	Very low	117 Å²	117	143 Å²	143	82%	0.818	78%	0.781	S	S	*	*			trans	74	147.4	168.8	84.2	0	0	0	0	116.3
1101	S	33.3	Very low	34.3	Very low	98 Å²	98	139.4 Å²	139.4	69%	0.685	78%	0.782	S	S	*	*			cis	-156.4	144.3	8.4	60.4	0	0	0	0	113.7
1102	V	34.9	Very low	34.3	Very low	142 Å²	142	139 Å²	139	86%	0.861	79%	0.786	S	S	*	*			trans	62.8	135.9	139.9	175.3	0	0	0	0	118.2
1103	S	33.3	Very low	34.4	Very low	118 Å²	118	138.1 Å²	138.1	83%	0.825	79%	0.788	S	S	*	*			cis	-151.2	158.9	5.9	47.7	0	0	0	0	111.5
1104	G	34.8	Very low	34.4	Very low	73 Å²	73	136.3 Å²	136.3	75%	0.753	79%	0.787	S	S	*	*			trans	-170	7.9	-177.7	0	0	0	0	0	122.8
1105	K	33.3	Very low	34.5	Very low	214 Å²	214	133.9 Å²	133.9	93%	0.93	78%	0.78	S	S	*	*			trans	71.3	134.1	-176.6	-58.6	-175.6	175.9	-177.8	0	117.3
1106	P	34	Very low	34.7	Very low	125 Å²	125	126.4 Å²	126.4	81%	0.812	76%	0.758	S	S	*	*			trans	-118.9	172.1	176.6	42.4	-33.1	0	0	0	114.9
1107	V	38	Very low	34.8	Very low	140 Å²	140	124 Å²	124	85%	0.848	75%	0.754	S	S	*	*			trans	-142.1	152.1	156.4	-178.9	0	0	0	0	110.2
1108	E	34	Very low	34.8	Very low	169 Å²	169	123.1 Å²	123.1	79%	0.79	76%	0.757	S	S	*	*			trans	-60.6	171	-178.3	-78	162	126.2	0	0	118.2
1109	Q	38	Very low	34.7	Very low	172 Å²	172	126.1 Å²	126.1	80%	0.804	76%	0.763	S	S	*	*			cis	-165.2	-156.3	-29	-138.5	-167.1	39.8	0	0	109.9
1110	P	38	Very low	35.1	Very low	105 Å²	105	129.6 Å²	129.6	68%	0.682	77%	0.768	S	S	*	*			trans	-131.4	-152.8	-136.3	46.7	-25.3	0	0	0	117.5
1111	A	35.3	Very low	36.1	Very low	87 Å²	87	128.3 Å²	128.3	72%	0.719	76%	0.757	S	S	*	*			trans	88	150.1	166.3	0	0	0	0	0	117.2
1112	T	37	Very low	36.8	Very low	137 Å²	137	128.6 Å²	128.6	84%	0.84	76%	0.756	S	S	*	*			cis	-160.6	172.8	-7.3	11.6	0	0	0	0	110.9
1113	P	41.7	Very low	36.9	Very low	112 Å²	112	129 Å²	129	73%	0.727	75%	0.754	S	S	*	*			trans	-115.5	-165.2	-161.2	44.6	-38.3	0	0	0	118.1
1114	S	35.3	Very low	37.2	Very low	113 Å²	113	127.1 Å²	127.1	79%	0.79	75%	0.745	S	S	*	*			trans	98	157	161.3	89.9	0	0	0	0	117.5
1115	V	34.5	Very low	37.3	Very low	124 Å²	124	130.7 Å²	130.7	75%	0.752	75%	0.747	S	S	*	*			cis	-169.5	167.8	-14.5	123.1	0	0	0	0	111.9
1116	A	36.3	Very low	37.5	Very low	60 Å²	60	126.5 Å²	126.5	50%	0.496	74%	0.735	S	S	.	*			trans	92.8	125.7	151.9	0	0	0	0	0	125.6
1117	K	34.8	Very low	37.6	Very low	161 Å²	161	127.8 Å²	127.8	70%	0.7	73%	0.734	S	S	*	*			trans	73.8	171.8	130.5	-68.4	-173	175.2	-163.9	0	124.1	M1	M1-K1117 PolarHBondContact N-O 3.23Å; M1-K1117 VanDerWaalsContact N-O 3.12Å
1118	T	30.9	Very low	37.5	Very low	116 Å²	116	125.4 Å²	125.4	71%	0.712	73%	0.729	S	S	*	*				-168.9	175.4	-76.5	-69.4	0	0	0	0	109.1
1119	E	33.8	Very low	37.4	Very low	161 Å²	161	126.8 Å²	126.8	75%	0.752	73%	0.732	S	S	*	*			trans	93.2	146.7	161.5	-56.2	171	-156.1	0	0	118.4
1120	Q	34.8	Very low	37.3	Very low	178 Å²	178	123.6 Å²	123.6	83%	0.832	73%	0.726	S	S	*	*			cis	-164.3	-179.6	-45.5	-115.2	-157.3	-90.5	0	0	110.6
1121	P	51.7	Low	36.9	Very low	90 Å²	90	123.2 Å²	123.2	58%	0.584	73%	0.726	S	S	*	*			trans	-106.1	-158.3	-161.8	45.1	-39.9	0	0	0	115.5
1122	P	49.3	Very low	36.7	Very low	103 Å²	103	126.7 Å²	126.7	67%	0.669	73%	0.732	S	S	*	*				-130.9	139.4	114.8	34.8	-23.4	0	0	0	112.9
1123	D	36.8	Very low	36.4	Very low	151 Å²	151	124.3 Å²	124.3	81%	0.807	73%	0.726	S	S	*	*				79.4	142.2	86.1	-47.4	-30.3	0	0	0	113.1
1124	A	38.9	Very low	35.9	Very low	78 Å²	78	124.9 Å²	124.9	65%	0.645	73%	0.727	S	S	*	*			cis	-154	158.1	12.1	0	0	0	0	0	113.1
1125	D	37	Very low	35.7	Very low	148 Å²	148	127.5 Å²	127.5	79%	0.791	73%	0.727	S	S	*	*				44.9	148	127.8	-52	-10.2	0	0	0	121.8
1126	D	37.3	Very low	35.6	Very low	127 Å²	127	126.8 Å²	126.8	68%	0.679	73%	0.728	S	S	*	*			cis	-164.9	167.8	-3.6	-137.4	-14.7	0	0	0	112.7
1127	L	37.3	Very low	35.8	Very low	152 Å²	152	128.7 Å²	128.7	80%	0.796	74%	0.735	S	S	*	*			trans	49.5	156.3	149.3	-63.4	166.4	0	0	0	121.8
1128	A	34.9	Very low	35.6	Very low	89 Å²	89	129 Å²	129	74%	0.736	74%	0.737	S	S	*	*			cis	-164.7	173.5	-19.5	0	0	0	0	0	112.8
1129	K	31.3	Very low	35.7	Very low	199 Å²	199	132.4 Å²	132.4	87%	0.865	74%	0.741	S	S	*	*			trans	-66	179.3	169.3	-84.9	172.2	-176.9	171.6	0	114.1
1130	P	37	Very low	35.7	Very low	104 Å²	104	128.6 Å²	128.6	68%	0.675	74%	0.737	S	S	*	*			cis	-142.2	174.7	-23.4	35.5	-15.1	0	0	0	116.6
1131	S	28.9	Very low	35.6	Very low	97 Å²	97	127.1 Å²	127.1	68%	0.678	74%	0.735	S	S	*	*			trans	48.2	149.1	136.3	72.5	0	0	0	0	125.6
1132	L	31.7	Very low	35.1	Very low	160 Å²	160	127.6 Å²	127.6	84%	0.838	74%	0.738	S	S	*	*			trans	88.3	88.3	156.5	-59.3	-179.5	0	0	0	120.5
1133	A	29.5	Very low	34.4	Very low	88 Å²	88	131.6 Å²	131.6	73%	0.727	75%	0.745	S	S	*	*				68.8	165.2	113.9	0	0	0	0	0	123
1134	V	31.6	Very low	34.2	Very low	123 Å²	123	129.2 Å²	129.2	75%	0.745	74%	0.741	S	S	*	*			trans	85.6	105.5	162.1	-170	0	0	0	0	118.7
1135	E	32	Very low	34	Very low	168 Å²	168	130.4 Å²	130.4	79%	0.785	74%	0.744	S	S	*	*			trans	59.9	106.6	139.7	-64.9	174.3	-171.7	0	0	124.8
1136	S	32.4	Very low	33.7	Very low	110 Å²	110	132.1 Å²	132.1	77%	0.769	75%	0.747	S	S	*	*				79.7	174.6	112.5	100.1	0	0	0	0	118.9
1137	P	40.8	Very low	33.5	Very low	99 Å²	99	129.7 Å²	129.7	64%	0.643	75%	0.745	S	S	*	*				-135.7	-178.2	-127.3	36.9	-13.8	0	0	0	117.6
1138	F	29.9	Very low	33.1	Very low	169 Å²	169	131.1 Å²	131.1	74%	0.741	75%	0.748	S	S	*	*			trans	131.9	131.8	143	-83.7	-72.5	0	0	0	117.2
1139	K	32.2	Very low	33	Very low	186 Å²	186	131.8 Å²	131.8	81%	0.809	75%	0.747	S	S	*	*			trans	62.5	149	143.8	-74.9	164.2	-179	172.7	0	118.9
1140	A	34.2	Very low	32.9	Very low	81 Å²	81	130.4 Å²	130.4	67%	0.669	74%	0.741	S	S	*	*			cis	-155.1	152.1	8.1	0	0	0	0	0	113.1
1141	D	34	Very low	32.5	Very low	148 Å²	148	132.5 Å²	132.5	79%	0.791	74%	0.742	S	S	*	*				22.9	159.3	119.7	-63.9	-34.1	0	0	0	122.2
1142	P	41.2	Very low	32.7	Very low	99 Å²	99	136.6 Å²	136.6	64%	0.643	76%	0.755	S	S	*	*			cis	-150.6	-167.4	-32.1	42.3	-23.4	0	0	0	115.8
1143	K	34.2	Very low	32.8	Very low	187 Å²	187	133.8 Å²	133.8	81%	0.813	75%	0.748	S	S	*	*			trans	93.6	130.2	141.8	-83.1	173.2	-169.7	175.5	0	124
1144	S	32.6	Very low	32.8	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	75%	0.752	S	S	*	*				92.7	139.6	125.6	61.5	0	0	0	0	123.3
1145	S	34.1	Very low	33	Very low	103 Å²	103	140.2 Å²	140.2	72%	0.72	76%	0.758	S	S	*	*			trans	62.2	154.8	156.2	51.6	0	0	0	0	119.4
1146	E	30	Very low	33.2	Very low	184 Å²	184	140 Å²	140	86%	0.86	76%	0.761	S	S	*	*			cis	-175.7	174.3	-39.8	-123.1	179.3	134.1	0	0	107.7
1147	A	32.8	Very low	33.1	Very low	76 Å²	76	141.2 Å²	141.2	63%	0.628	75%	0.754	S	S	*	*			trans	63.9	109.5	152	0	0	0	0	0	122.1
1148	Q	29.6	Very low	32.6	Very low	182 Å²	182	142.7 Å²	142.7	85%	0.85	75%	0.75	S	S	*	*				87.1	145.4	120.4	-67.2	174.3	11.1	0	0	122.7
1149	S	32	Very low	32.9	Very low	103 Å²	103	142.8 Å²	142.8	72%	0.72	76%	0.758	S	S	*	*			trans	65.4	113.7	161.2	-58.7	0	0	0	0	118
1150	K	30.6	Very low	32.9	Very low	169 Å²	169	138.5 Å²	138.5	74%	0.735	76%	0.758	S	S	*	*				79.3	126.2	57.3	-80.5	176.1	136.2	-99.8	0	114.4
1151	E	28.1	Very low	32.6	Very low	149 Å²	149	141 Å²	141	70%	0.696	77%	0.765	S	S	*	*			trans	56.9	107.6	147	-68.1	159.9	118.4	0	0	119
1152	L	33.1	Very low	32.4	Very low	183 Å²	183	143.5 Å²	143.5	96%	0.958	77%	0.769	S	S	*	*				-144.4	163	117.4	-138.6	70.9	0	0	0	111.9
1153	S	34.6	Very low	32	Very low	100 Å²	100	148.3 Å²	148.3	70%	0.699	78%	0.782	S	S	*	*			trans	-87.8	163.8	-169.3	179.8	0	0	0	0	113.7
1154	K	29.7	Very low	32	Very low	184 Å²	184	143.9 Å²	143.9	80%	0.8	78%	0.781	S	S	*	*			trans	-36.5	146.8	157.2	-47.4	152.9	-176.7	168.9	0	112.3
1155	D	35.1	Very low	31.8	Very low	162 Å²	162	148.6 Å²	148.6	87%	0.866	79%	0.788	S	S	*	*				-162.9	-177.4	124.5	-108.5	-27.6	0	0	0	111.9
1156	I	35.6	Very low	31.8	Very low	165 Å²	165	153.3 Å²	153.3	85%	0.846	80%	0.796	S	S	*	*			trans	78.2	110.6	179.1	-51.2	175.1	0	0	0	114.8
1157	Q	31.6	Very low	32.1	Very low	135 Å²	135	151.9 Å²	151.9	63%	0.631	79%	0.789	S	S	*	*			trans	-109.7	156.3	166.1	-66.6	-172.5	9.4	0	0	110.4
1158	K	30.1	Very low	32.1	Very low	129 Å²	129	156.4 Å²	156.4	56%	0.561	80%	0.797	S	S	*	*			trans	48.4	106	149.6	-64.2	157.8	-176	154.7	0	117.7
1159	D	35.6	Very low	32.3	Very low	171 Å²	171	151 Å²	151	91%	0.914	79%	0.791	S	S	*	*				-165.2	118.2	127.7	-103.9	-26.7	0	0	0	111.2
1160	A	32.2	Very low	32.5	Very low	97 Å²	97	151.2 Å²	151.2	80%	0.802	79%	0.792	S	S	*	*			trans	169.9	100.2	161.5	0	0	0	0	0	111.5
1161	V	27	Very low	32.7	Very low	134 Å²	134	149.9 Å²	149.9	81%	0.812	79%	0.786	S	S	*	*			trans	-145.4	134	159.9	-175.1	0	0	0	0	108.2
1162	K	30.3	Very low	33	Very low	200 Å²	200	149.4 Å²	149.4	87%	0.87	78%	0.784	S	S	*	*			trans	90.2	69.6	-178.8	-52.6	172.8	-176.8	171.9	0	117.1
1163	E	32.3	Very low	33	Very low	200 Å²	200	143.3 Å²	143.3	94%	0.935	76%	0.76	S	S	*	*			trans	-168.3	148.1	138.4	-108.5	163.4	-170.2	0	0	107.9
1164	A	34.5	Very low	32.9	Very low	94 Å²	94	147.1 Å²	147.1	78%	0.777	77%	0.767	S	S	*	*			cis	-131.8	160.3	-3.4	0	0	0	0	0	111.5
1165	K	29.4	Very low	33	Very low	201 Å²	201	142.3 Å²	142.3	87%	0.874	76%	0.761	S	S	*	*			trans	-104.2	158.9	166.6	-72.4	-178.6	176.5	-179.3	0	109.5
1166	K	34.2	Very low	32.9	Very low	201 Å²	201	141.2 Å²	141.2	87%	0.874	76%	0.76	S	S	*	*			trans	115.8	137.6	177.6	-73.2	170.8	-179.3	-177.8	0	109.6
1167	E	35.4	Very low	32.8	Very low	154 Å²	154	141.3 Å²	141.3	72%	0.72	76%	0.755	S	S	*	*			cis	-126.2	150.4	16.3	-76	-160.9	101	0	0	116.2
1168	Q	33.7	Very low	32.7	Very low	171 Å²	171	140.7 Å²	140.7	80%	0.799	76%	0.762	S	S	*	*			trans	37.2	126.8	143.2	-53.2	-178.2	53.4	0	0	120.8
1169	G	33.1	Very low	32.8	Very low	70 Å²	70	140.6 Å²	140.6	72%	0.722	77%	0.767	S	S	*	*			cis	157.5	162.2	-8.6	0	0	0	0	0	114.3
1170	S	35.5	Very low	33	Very low	106 Å²	106	139.1 Å²	139.1	74%	0.741	76%	0.755	S	S	*	*			trans	64.5	134.4	166.8	170.9	0	0	0	0	116.9
1171	K	34.8	Very low	33.4	Very low	141 Å²	141	141.6 Å²	141.6	61%	0.613	75%	0.748	S	S	*	*			cis	-163.7	-179.6	-1.8	-100.1	170.1	171.7	-133.8	0	105.5	R5	R5-K1171 PolarHBondContact NH1-O 2.88Å
1172	H	35.3	Very low	34.3	Very low	139 Å²	139	140 Å²	140	64%	0.644	73%	0.734	S	S	*	*			cis	-158.3	174.7	-14.6	-107.6	-40.2	0	0	0	106.1
1173	A	33.9	Very low	35.1	Very low	55 Å²	55	133.6 Å²	133.6	46%	0.455	72%	0.715	S	S	.	*				-168.1	104.9	-56	0	0	0	0	0	115.1	E8	E8-A1173 WeakPolarHBondContact OE1-CA 3.31Å; E8-A1173 PolarHBondContact OE1-N 3.42Å; E8-A1173 PolarHBondContact OE2-N 2.79Å
1174	E	30.6	Very low	36.4	Very low	181 Å²	181	131.3 Å²	131.3	85%	0.846	70%	0.702	S	S	*	*				80.3	100.3	128.6	-170.9	172.6	-162.4	0	0	119.5	E8	E8-E1174 PolarHBondContact OE1-N 2.72Å
1175	A	32.8	Very low	37.6	Very low	82 Å²	82	132.5 Å²	132.5	68%	0.678	69%	0.691	S	S	*	*			trans	-158.3	151.9	149.1	0	0	0	0	0	114.2
1176	T	33.7	Very low	39.2	Very low	140 Å²	140	125.2 Å²	125.2	86%	0.859	67%	0.669	S	S	*	*			trans	60.3	92.4	158.4	57.2	0	0	0	0	122.3
1177	K	32.3	Very low	40.7	Very low	166 Å²	166	120.6 Å²	120.6	72%	0.722	65%	0.653	S	S	*	*				-111.8	152	124.6	-76.7	-165.7	-177.1	-166.1	0	107.4
1178	P	30.9	Very low	42.6	Very low	122 Å²	122	118.9 Å²	118.9	79%	0.792	65%	0.646	S	S	*	*			cis	-132.4	134.9	31.9	37.2	-19.5	0	0	0	116.3
1179	L	31.5	Very low	44.4	Very low	128 Å²	128	113.4 Å²	113.4	67%	0.67	63%	0.631	S	S	*	*			trans	-138.5	12.9	172.9	-101.8	167.1	0	0	0	114.2	S1183	L1179-S1183 PolarHBondContact O-OG 3.1Å
1180	Q	38.7	Very low	46.3	Very low	140 Å²	140	114.8 Å²	114.8	65%	0.654	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	0.7	-170.7	-64.3	-170.4	-69.5	0	0	115.3
1181	K	41.7	Very low	48.1	Very low	149 Å²	149	114.1 Å²	114.1	65%	0.648	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-54.3	172.6	-166	-179	177.8	-168.9	0	110.2	S1183 K1184 E1185	K1181-S1183 VanDerWaalsContact C-N 3.25Å; K1181-S1183 PolarHBondContact O-N 3.38Å; K1181-K1184 WeakPolarHBondContact O-CB 3.16Å; K1181-K1184 PolarHBondContact O-N 3.33Å; K1181-E1185 WeakPolarHBondContact CE-OE1 3.43Å; K1181-E1185 PolarHBondContact O-N 2.91Å
1182	D	44.9	Very low	50	Low	99 Å²	99	110.2 Å²	110.2	53%	0.529	60%	0.599	S	S	.	*	H	α-helix	trans	-56.3	-38	179.6	-51.1	11.6	0	0	0	111.8	K1184 E1185 A1186	D1182-K1184 VanDerWaalsContact C-N 3.3Å; D1182-K1184 PolarHBondContact O-N 3Å; D1182-E1185 PolarHBondContact O-N 3.15Å; D1182-A1186 WeakPolarHBondContact O-CB 3.39Å; D1182-A1186 PolarHBondContact O-N 3.46Å
1183	S	47.4	Very low	51.9	Low	66 Å²	66	111.5 Å²	111.5	46%	0.462	60%	0.598	S	S	.	*	H	α-helix	trans	-66	-28.5	176.6	59.2	0	0	0	0	113.5	L1179 K1181 L1187	L1179-S1183 PolarHBondContact O-OG 3.1Å; K1181-S1183 VanDerWaalsContact C-N 3.25Å; K1181-S1183 PolarHBondContact O-N 3.38Å; S1183-L1187 VanDerWaalsContact O-CB 3.26Å; S1183-L1187 WeakPolarHBondContact O-CB 3.39Å; S1183-L1187 PolarHBondContact O-N 2.87Å; S1183-L1187 VanDerWaalsContact O-N 3.11Å
1184	K	59.4	Low	54	Low	153 Å²	153	114.5 Å²	114.5	67%	0.665	60%	0.602	S	S	*	*	H	α-helix	trans	-77.1	-40.3	173.5	-171.6	-177.9	178.4	-173.9	0	111.1	K1181 D1182 L1187 M1188	K1181-K1184 WeakPolarHBondContact O-CB 3.16Å; K1181-K1184 PolarHBondContact O-N 3.33Å; D1182-K1184 VanDerWaalsContact C-N 3.3Å; D1182-K1184 PolarHBondContact O-N 3Å; K1184-L1187 PolarHBondContact O-N 2.99Å; K1184-M1188 WeakPolarHBondContact O-CB 3.25Å; K1184-M1188 VanDerWaalsContact O-CG 3.23Å; K1184-M1188 WeakPolarHBondContact O-CG 3.43Å; K1184-M1188 PolarHBondContact O-N 2.86Å
1185	E	61.2	Low	56.2	Low	118 Å²	118	112.1 Å²	112.1	55%	0.551	59%	0.589	S	S	*	*	H	α-helix	trans	-69.2	-39.5	177.1	-70.8	176	-163.3	0	0	111.3	K1181 D1182 M1188 A1189	K1181-E1185 WeakPolarHBondContact CE-OE1 3.43Å; K1181-E1185 PolarHBondContact O-N 2.91Å; D1182-E1185 PolarHBondContact O-N 3.15Å; E1185-M1188 PolarHBondContact O-N 2.9Å; E1185-A1189 WeakPolarHBondContact O-CB 3.24Å; E1185-A1189 PolarHBondContact O-N 3.48Å
1186	A	62.4	Low	58.1	Low	49 Å²	49	112.8 Å²	112.8	41%	0.405	58%	0.581	S	S	.	*	H	α-helix	trans	-62	-43.3	171.3	0	0	0	0	0	112.4	D1182 A1189 I1190	D1182-A1186 WeakPolarHBondContact O-CB 3.39Å; D1182-A1186 PolarHBondContact O-N 3.46Å; A1186-A1189 PolarHBondContact O-N 2.81Å; A1186-I1190 VanDerWaalsContact O-CG1 3.28Å; A1186-I1190 WeakPolarHBondContact O-CG1 3.36Å; A1186-I1190 PolarHBondContact O-N 2.86Å
1187	L	65.9	Low	60.2	Low	103 Å²	103	111 Å²	111	54%	0.539	56%	0.564	S	S	.	*	H	α-helix	trans	-67.7	-37.8	177.5	-168.6	146.3	0	0	0	111.8	S1183 K1184 I1190 L1191	S1183-L1187 VanDerWaalsContact O-CB 3.26Å; S1183-L1187 WeakPolarHBondContact O-CB 3.39Å; S1183-L1187 PolarHBondContact O-N 2.87Å; S1183-L1187 VanDerWaalsContact O-N 3.11Å; K1184-L1187 PolarHBondContact O-N 2.99Å; L1187-I1190 PolarHBondContact O-N 2.84Å; L1187-L1191 HydrophobicContact CD2-CD1 3.7Å; L1187-L1191 HydrophobicContact CD2-CG 4.32Å; L1187-L1191 WeakPolarHBondContact O-CB 3.41Å; L1187-L1191 WeakPolarHBondContact O-CG 3.3Å; L1187-L1191 PolarHBondContact O-N 2.83Å
1188	M	74.1	Confident	62.2	Low	118 Å²	118	108.1 Å²	108.1	58%	0.581	55%	0.554	S	S	*	*	H	α-helix	trans	-66	-36.1	171	-69.5	-70.3	-71.2	0	0	112.3	K1184 E1185 L1191 S1192	K1184-M1188 WeakPolarHBondContact O-CB 3.25Å; K1184-M1188 VanDerWaalsContact O-CG 3.23Å; K1184-M1188 WeakPolarHBondContact O-CG 3.43Å; K1184-M1188 PolarHBondContact O-N 2.86Å; E1185-M1188 PolarHBondContact O-N 2.9Å; M1188-L1191 PolarHBondContact O-N 3.28Å; M1188-S1192 WeakPolarHBondContact O-CB 3.32Å; M1188-S1192 PolarHBondContact O-N 2.76Å
1189	A	72.1	Confident	64.2	Low	57 Å²	57	106 Å²	106	47%	0.471	54%	0.539	S	S	.	.	H	α-helix	trans	-69.1	-39	175.2	0	0	0	0	0	112.3	E1185 A1186 S1192 R1193	E1185-A1189 WeakPolarHBondContact O-CB 3.24Å; E1185-A1189 PolarHBondContact O-N 3.48Å; A1186-A1189 PolarHBondContact O-N 2.81Å; A1189-S1192 PolarHBondContact O-N 2.9Å; A1189-R1193 VanDerWaalsContact O-CB 3.24Å; A1189-R1193 WeakPolarHBondContact O-CB 3.33Å; A1189-R1193 PolarHBondContact O-N 3.27Å
1190	I	73.9	Confident	66.3	Low	99 Å²	99	102.8 Å²	102.8	51%	0.508	53%	0.531	S	S	.	.	H	α-helix	trans	-62.6	-46.3	172.2	-70.1	162.8	0	0	0	110.3	A1186 L1187 R1193 Q1194	A1186-I1190 VanDerWaalsContact O-CG1 3.28Å; A1186-I1190 WeakPolarHBondContact O-CG1 3.36Å; A1186-I1190 PolarHBondContact O-N 2.86Å; L1187-I1190 PolarHBondContact O-N 2.84Å; I1190-R1193 PolarHBondContact O-N 2.95Å; I1190-Q1194 WeakPolarHBondContact O-CG 3.32Å; I1190-Q1194 PolarHBondContact O-N 2.88Å
1191	L	73.5	Confident	67.9	Low	92 Å²	92	101.5 Å²	101.5	48%	0.482	53%	0.527	S	S	.	.	H	α-helix	trans	-64.2	-39.9	176.8	-72.7	173.7	0	0	0	112.6	L1187 M1188 K1195	L1187-L1191 HydrophobicContact CD2-CD1 3.7Å; L1187-L1191 HydrophobicContact CD2-CG 4.32Å; L1187-L1191 WeakPolarHBondContact O-CB 3.41Å; L1187-L1191 WeakPolarHBondContact O-CG 3.3Å; L1187-L1191 PolarHBondContact O-N 2.83Å; M1188-L1191 PolarHBondContact O-N 3.28Å; L1191-K1195 WeakPolarHBondContact O-CB 3.46Å; L1191-K1195 PolarHBondContact O-N 3.38Å
1192	S	74.4	Confident	69.2	Low	59 Å²	59	98 Å²	98	41%	0.413	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-47.6	173.2	-164.8	0	0	0	0	110.7	M1188 A1189 Q1194 K1195 D1196	M1188-S1192 WeakPolarHBondContact O-CB 3.32Å; M1188-S1192 PolarHBondContact O-N 2.76Å; A1189-S1192 PolarHBondContact O-N 2.9Å; S1192-Q1194 PolarHBondContact O-N 2.81Å; S1192-K1195 CarbonylContact O-C 3.59Å; S1192-K1195 WeakPolarHBondContact O-CA 3.41Å; S1192-K1195 WeakPolarHBondContact O-CB 3.2Å; S1192-K1195 PolarHBondContact O-N 3.26Å; S1192-K1195 VanDerWaalsContact O-N 3.09Å; S1192-D1196 PolarHBondContact O-N 3.49Å; S1192-D1196 VanDerWaalsContact O-OD2 3.07Å; S1192-D1196 PolarHBondContact OG-OD2 2.79Å
1193	R	75.2	Confident	70.5	Confident	165 Å²	165	95.7 Å²	95.7	62%	0.623	51%	0.51	S	S	*	.	H	α-helix	trans	-61.5	-43.2	-179.8	-176.6	172.9	-178.3	151.5	4.7	112.4	A1189 I1190 K1195 D1196 E1197	A1189-R1193 VanDerWaalsContact O-CB 3.24Å; A1189-R1193 WeakPolarHBondContact O-CB 3.33Å; A1189-R1193 PolarHBondContact O-N 3.27Å; I1190-R1193 PolarHBondContact O-N 2.95Å; R1193-K1195 VanDerWaalsContact C-N 3.34Å; R1193-K1195 PolarHBondContact O-N 3.12Å; R1193-D1196 PolarHBondContact O-N 2.91Å; R1193-E1197 HydrophobicContact CG-CG 4.39Å; R1193-E1197 VanDerWaalsContact CG-OE1 3.28Å; R1193-E1197 WeakPolarHBondContact CG-OE1 3.5Å; R1193-E1197 IonicContact CZ-OE1 3.39Å; R1193-E1197 IonicContact NE-OE1 2.99Å; R1193-E1197 PolarHBondContact NE-OE1 2.95Å; R1193-E1197 IonicContact NH2-OE1 3.49Å; R1193-E1197 VanDerWaalsContact O-CB 3.32Å; R1193-E1197 WeakPolarHBondContact O-CB 3.23Å; R1193-E1197 VanDerWaalsContact O-CG 3.28Å; R1193-E1197 WeakPolarHBondContact O-CG 3.42Å; R1193-E1197 PolarHBondContact O-N 2.87Å
1194	Q	77.7	Confident	71.8	Confident	118 Å²	118	98.3 Å²	98.3	55%	0.551	51%	0.513	S	S	*	.	H	α-helix	trans	-64.2	-37.5	173.4	-75.5	-173.5	-20.3	0	0	112.2	I1190 S1192 M1198	I1190-Q1194 WeakPolarHBondContact O-CG 3.32Å; I1190-Q1194 PolarHBondContact O-N 2.88Å; S1192-Q1194 PolarHBondContact O-N 2.81Å; Q1194-M1198 WeakPolarHBondContact O-CB 3.38Å; Q1194-M1198 PolarHBondContact O-N 2.9Å
1195	K	75.8	Confident	72.3	Confident	132 Å²	132	96.6 Å²	96.6	57%	0.574	51%	0.507	S	S	*	.	H	α-helix	trans	-64.3	-40.6	173.7	-179	-176.9	177.2	-177.3	0	112	L1191 S1192 R1193 T1199	L1191-K1195 WeakPolarHBondContact O-CB 3.46Å; L1191-K1195 PolarHBondContact O-N 3.38Å; S1192-K1195 CarbonylContact O-C 3.59Å; S1192-K1195 WeakPolarHBondContact O-CA 3.41Å; S1192-K1195 WeakPolarHBondContact O-CB 3.2Å; S1192-K1195 PolarHBondContact O-N 3.26Å; S1192-K1195 VanDerWaalsContact O-N 3.09Å; R1193-K1195 VanDerWaalsContact C-N 3.34Å; R1193-K1195 PolarHBondContact O-N 3.12Å; K1195-T1199 VanDerWaalsContact O-CB 3.29Å; K1195-T1199 WeakPolarHBondContact O-CB 3.32Å; K1195-T1199 PolarHBondContact O-N 3.31Å; K1195-T1199 PolarHBondContact O-OG1 2.85Å
1196	D	74.5	Confident	72.7	Confident	95 Å²	95	97.8 Å²	97.8	51%	0.508	51%	0.51	S	S	.	.	H	α-helix	trans	-72.5	-42.5	179.9	-64	-36	0	0	0	111.2	S1192 R1193 T1199 A1200	S1192-D1196 PolarHBondContact O-N 3.49Å; S1192-D1196 VanDerWaalsContact O-OD2 3.07Å; S1192-D1196 PolarHBondContact OG-OD2 2.79Å; R1193-D1196 PolarHBondContact O-N 2.91Å; D1196-T1199 PolarHBondContact O-N 3.11Å; D1196-A1200 WeakPolarHBondContact O-CB 3.25Å; D1196-A1200 PolarHBondContact O-N 3.21Å
1197	E	77.6	Confident	72.9	Confident	104 Å²	104	99.7 Å²	99.7	49%	0.486	52%	0.52	S	S	.	.	H	α-helix	trans	-62	-42.9	172.8	-73.5	171.1	-172.8	0	0	111.5	R1193 A1200 L1201	R1193-E1197 HydrophobicContact CG-CG 4.39Å; R1193-E1197 VanDerWaalsContact CG-OE1 3.28Å; R1193-E1197 WeakPolarHBondContact CG-OE1 3.5Å; R1193-E1197 IonicContact CZ-OE1 3.39Å; R1193-E1197 IonicContact NE-OE1 2.99Å; R1193-E1197 PolarHBondContact NE-OE1 2.95Å; R1193-E1197 IonicContact NH2-OE1 3.49Å; R1193-E1197 VanDerWaalsContact O-CB 3.32Å; R1193-E1197 WeakPolarHBondContact O-CB 3.23Å; R1193-E1197 VanDerWaalsContact O-CG 3.28Å; R1193-E1197 WeakPolarHBondContact O-CG 3.42Å; R1193-E1197 PolarHBondContact O-N 2.87Å; E1197-A1200 PolarHBondContact O-N 2.95Å; E1197-L1201 PolarHBondContact O-N 3.26Å
1198	M	72.9	Confident	73.1	Confident	105 Å²	105	98.8 Å²	98.8	52%	0.517	51%	0.513	S	S	.	.	H	α-helix	trans	-65.6	-40	173.4	-179.6	169.8	57.7	0	0	112.3	Q1194 A1200 L1201 I1202	Q1194-M1198 WeakPolarHBondContact O-CB 3.38Å; Q1194-M1198 PolarHBondContact O-N 2.9Å; M1198-A1200 VanDerWaalsContact C-N 3.34Å; M1198-L1201 WeakPolarHBondContact O-CB 3.46Å; M1198-L1201 PolarHBondContact O-N 3.25Å; M1198-I1202 HydrophobicContact CG-CD1 4.03Å; M1198-I1202 VanDerWaalsContact O-CG1 3.32Å; M1198-I1202 WeakPolarHBondContact O-CG1 3.4Å; M1198-I1202 PolarHBondContact O-N 2.97Å
1199	T	74.1	Confident	72.7	Confident	77 Å²	77	97.8 Å²	97.8	47%	0.472	51%	0.509	S	S	.	.	H	α-helix	trans	-64.6	-40	175.8	-59.5	0	0	0	0	111.1	K1195 D1196 I1202 A1203	K1195-T1199 VanDerWaalsContact O-CB 3.29Å; K1195-T1199 WeakPolarHBondContact O-CB 3.32Å; K1195-T1199 PolarHBondContact O-N 3.31Å; K1195-T1199 PolarHBondContact O-OG1 2.85Å; D1196-T1199 PolarHBondContact O-N 3.11Å; T1199-I1202 PolarHBondContact O-N 3.32Å; T1199-A1203 WeakPolarHBondContact O-CB 3.29Å; T1199-A1203 PolarHBondContact O-N 2.8Å
1200	A	75.2	Confident	72.4	Confident	61 Å²	61	98 Å²	98	50%	0.504	51%	0.51	S	S	.	.	H	α-helix	trans	-65.3	-37.5	173	0	0	0	0	0	112.2	D1196 E1197 M1198 A1203 K1204	D1196-A1200 WeakPolarHBondContact O-CB 3.25Å; D1196-A1200 PolarHBondContact O-N 3.21Å; E1197-A1200 PolarHBondContact O-N 2.95Å; M1198-A1200 VanDerWaalsContact C-N 3.34Å; A1200-A1203 PolarHBondContact O-N 3.49Å; A1200-K1204 WeakPolarHBondContact O-CB 3.23Å; A1200-K1204 PolarHBondContact O-N 3.01Å
1201	L	72.6	Confident	72	Confident	112 Å²	112	96.1 Å²	96.1	59%	0.586	51%	0.51	S	S	*	.	H	α-helix	trans	-64.2	-45.2	174.3	-139.8	83.1	0	0	0	111.8	E1197 M1198 K1204 H1205	E1197-L1201 PolarHBondContact O-N 3.26Å; M1198-L1201 WeakPolarHBondContact O-CB 3.46Å; M1198-L1201 PolarHBondContact O-N 3.25Å; L1201-K1204 PolarHBondContact O-N 3.06Å; L1201-H1205 PolarHBondContact O-N 2.89Å
1202	I	69.4	Low	71.2	Confident	76 Å²	76	97 Å²	97	39%	0.39	51%	0.507	S	S	.	.	H	α-helix	trans	-63.4	-41.1	175.9	-69	164.4	0	0	0	110.8	M1198 T1199 K1206	M1198-I1202 HydrophobicContact CG-CD1 4.03Å; M1198-I1202 VanDerWaalsContact O-CG1 3.32Å; M1198-I1202 WeakPolarHBondContact O-CG1 3.4Å; M1198-I1202 PolarHBondContact O-N 2.97Å; T1199-I1202 PolarHBondContact O-N 3.32Å; I1202-K1206 HydrophobicContact CG2-CD 4.16Å; I1202-K1206 WeakPolarHBondContact O-CB 3.44Å; I1202-K1206 VanDerWaalsContact O-CG 3.31Å; I1202-K1206 WeakPolarHBondContact O-CG 3.48Å; I1202-K1206 PolarHBondContact O-N 3.05Å
1203	A	71.7	Confident	70.2	Confident	50 Å²	50	100.5 Å²	100.5	41%	0.413	52%	0.516	S	S	.	.	H	α-helix	trans	-62.8	-44.9	174.5	0	0	0	0	0	111.4	T1199 A1200 K1206 C1207	T1199-A1203 WeakPolarHBondContact O-CB 3.29Å; T1199-A1203 PolarHBondContact O-N 2.8Å; A1200-A1203 PolarHBondContact O-N 3.49Å; A1203-K1206 PolarHBondContact O-N 3.22Å; A1203-C1207 PolarHBondContact O-N 3.31Å; A1203-C1207 PolarHBondContact O-SG 3.11Å
1204	K	74.6	Confident	69.4	Low	122 Å²	122	94.9 Å²	94.9	53%	0.53	51%	0.505	S	S	.	.	H	α-helix	trans	-59.6	-50.5	175.5	179.1	178.2	167.6	-180	0	111.7	A1200 L1201 K1206 C1207 E1208	A1200-K1204 WeakPolarHBondContact O-CB 3.23Å; A1200-K1204 PolarHBondContact O-N 3.01Å; L1201-K1204 PolarHBondContact O-N 3.06Å; K1204-K1206 VanDerWaalsContact C-N 3.31Å; K1204-K1206 PolarHBondContact O-N 2.85Å; K1204-C1207 CarbonylContact O-C 3.54Å; K1204-C1207 WeakPolarHBondContact O-CB 3.45Å; K1204-C1207 PolarHBondContact O-N 2.99Å; K1204-C1207 VanDerWaalsContact O-N 3.11Å; K1204-E1208 WeakPolarHBondContact CE-OE1 3.49Å; K1204-E1208 HydrophobicContact CG-CG 4.37Å; K1204-E1208 IonicContact NZ-OE1 3.69Å; K1204-E1208 WeakPolarHBondContact O-CG 3.27Å; K1204-E1208 PolarHBondContact O-N 2.89Å
1205	H	69.5	Low	68.2	Low	117 Å²	117	91.5 Å²	91.5	54%	0.542	50%	0.497	S	S	.	.	H	α-helix	trans	-63.8	-33	176.8	-91.9	4	0	0	0	113.1	L1201 E1208 L1209	L1201-H1205 PolarHBondContact O-N 2.89Å; H1205-E1208 IonicContact CE1-OE2 3.51Å; H1205-E1208 IonicContact CG-OE2 2.7Å; H1205-E1208 IonicContact ND1-OE2 2.99Å; H1205-E1208 PolarHBondContact ND1-OE2 3.23Å; H1205-E1208 PolarHBondContact O-N 2.92Å; H1205-L1209 VanDerWaalsContact O-CB 3.28Å; H1205-L1209 WeakPolarHBondContact O-CB 3.31Å; H1205-L1209 VanDerWaalsContact O-CG 3.3Å; H1205-L1209 WeakPolarHBondContact O-CG 3.42Å; H1205-L1209 PolarHBondContact O-N 3.26Å
1206	K	69.6	Low	66.9	Low	142 Å²	142	87 Å²	87	62%	0.617	48%	0.482	S	S	*	.	H	α-helix	trans	-65.2	-40.1	170.9	-77.6	175.5	180	178	0	112.1	I1202 A1203 K1204 A1210	I1202-K1206 HydrophobicContact CG2-CD 4.16Å; I1202-K1206 WeakPolarHBondContact O-CB 3.44Å; I1202-K1206 VanDerWaalsContact O-CG 3.31Å; I1202-K1206 WeakPolarHBondContact O-CG 3.48Å; I1202-K1206 PolarHBondContact O-N 3.05Å; A1203-K1206 PolarHBondContact O-N 3.22Å; K1204-K1206 VanDerWaalsContact C-N 3.31Å; K1204-K1206 PolarHBondContact O-N 2.85Å; K1206-A1210 VanDerWaalsContact O-CB 3.26Å; K1206-A1210 WeakPolarHBondContact O-CB 3.46Å; K1206-A1210 PolarHBondContact O-N 3.04Å
1207	C	66.4	Low	65.5	Low	89 Å²	89	88.5 Å²	88.5	60%	0.601	49%	0.488	S	S	*	.	H	α-helix	trans	-68	-40.5	173.4	-71.7	0	0	0	0	112.5	A1203 K1204 A1210 A1211	A1203-C1207 PolarHBondContact O-N 3.31Å; A1203-C1207 PolarHBondContact O-SG 3.11Å; K1204-C1207 CarbonylContact O-C 3.54Å; K1204-C1207 WeakPolarHBondContact O-CB 3.45Å; K1204-C1207 PolarHBondContact O-N 2.99Å; K1204-C1207 VanDerWaalsContact O-N 3.11Å; C1207-A1210 PolarHBondContact O-N 3.22Å; C1207-A1211 VanDerWaalsContact O-CB 3.31Å; C1207-A1211 WeakPolarHBondContact O-CB 3.43Å; C1207-A1211 PolarHBondContact O-N 3.34Å
1208	E	69.8	Low	63.7	Low	85 Å²	85	90.3 Å²	90.3	40%	0.397	50%	0.497	S	S	.	.	H	α-helix	trans	-66	-40.7	176.3	-71.6	169.1	149.7	0	0	111.3	K1204 H1205 Y1212	K1204-E1208 WeakPolarHBondContact CE-OE1 3.49Å; K1204-E1208 HydrophobicContact CG-CG 4.37Å; K1204-E1208 IonicContact NZ-OE1 3.69Å; K1204-E1208 WeakPolarHBondContact O-CG 3.27Å; K1204-E1208 PolarHBondContact O-N 2.89Å; H1205-E1208 IonicContact CE1-OE2 3.51Å; H1205-E1208 IonicContact CG-OE2 2.7Å; H1205-E1208 IonicContact ND1-OE2 2.99Å; H1205-E1208 PolarHBondContact ND1-OE2 3.23Å; H1205-E1208 PolarHBondContact O-N 2.92Å; E1208-Y1212 VanDerWaalsContact O-CB 3.23Å; E1208-Y1212 WeakPolarHBondContact O-CB 3.23Å; E1208-Y1212 PolarHBondContact O-N 2.92Å
1209	L	65.6	Low	62	Low	97 Å²	97	92.8 Å²	92.8	51%	0.508	51%	0.507	S	S	.	.	H	α-helix	trans	-65.2	-43.2	171.4	-77.6	165.9	0	0	0	112.1	H1205 Y1212 F1213	H1205-L1209 VanDerWaalsContact O-CB 3.28Å; H1205-L1209 WeakPolarHBondContact O-CB 3.31Å; H1205-L1209 VanDerWaalsContact O-CG 3.3Å; H1205-L1209 WeakPolarHBondContact O-CG 3.42Å; H1205-L1209 PolarHBondContact O-N 3.26Å; L1209-Y1212 PolarHBondContact O-N 3.26Å; L1209-F1213 HydrophobicContact CD2-CE2 4.39Å; L1209-F1213 WeakPolarHBondContact O-CD2 3.5Å; L1209-F1213 PolarHBondContact O-N 3.23Å
1210	A	67.1	Low	60.2	Low	60 Å²	60	98 Å²	98	50%	0.496	52%	0.524	S	S	.	.	H	α-helix	trans	-62.8	-43.9	177	0	0	0	0	0	111.7	K1206 C1207 Y1212 F1213 A1214	K1206-A1210 VanDerWaalsContact O-CB 3.26Å; K1206-A1210 WeakPolarHBondContact O-CB 3.46Å; K1206-A1210 PolarHBondContact O-N 3.04Å; C1207-A1210 PolarHBondContact O-N 3.22Å; A1210-Y1212 VanDerWaalsContact C-N 3.34Å; A1210-F1213 PolarHBondContact O-N 3.07Å; A1210-A1214 WeakPolarHBondContact O-CB 3.37Å; A1210-A1214 PolarHBondContact O-N 3.49Å
1211	A	65.7	Low	57.9	Low	60 Å²	60	102.9 Å²	102.9	50%	0.496	54%	0.536	S	S	.	.	H	α-helix	trans	-63.3	-39.3	172.9	0	0	0	0	0	111.7	C1207 A1214 A1215	C1207-A1211 VanDerWaalsContact O-CB 3.31Å; C1207-A1211 WeakPolarHBondContact O-CB 3.43Å; C1207-A1211 PolarHBondContact O-N 3.34Å; A1211-A1214 PolarHBondContact O-N 3.19Å; A1211-A1215 VanDerWaalsContact O-CB 3.29Å; A1211-A1215 WeakPolarHBondContact O-CB 3.43Å; A1211-A1215 PolarHBondContact O-N 3.22Å
1212	Y	56.8	Low	56	Low	110 Å²	110	104 Å²	104	43%	0.431	55%	0.547	S	S	.	.	H	α-helix	trans	-66.6	-38.3	176.7	-166.6	-86.9	0	0	0	112.6	K372 E1208 L1209 A1210 S1216	K372-Y1212 WeakPolarHBondContact CE-OH 3.39Å; K372-Y1212 VanDerWaalsContact NZ-CE1 3.33Å; K372-Y1212 PolarHBondContact NZ-OH 2.93Å; E1208-Y1212 VanDerWaalsContact O-CB 3.23Å; E1208-Y1212 WeakPolarHBondContact O-CB 3.23Å; E1208-Y1212 PolarHBondContact O-N 2.92Å; L1209-Y1212 PolarHBondContact O-N 3.26Å; A1210-Y1212 VanDerWaalsContact C-N 3.34Å; Y1212-S1216 WeakPolarHBondContact CE1-OG 3.08Å; Y1212-S1216 VanDerWaalsContact O-CB 3.24Å; Y1212-S1216 WeakPolarHBondContact O-CB 3.31Å; Y1212-S1216 PolarHBondContact O-N 2.86Å; Y1212-S1216 PolarHBondContact O-OG 3.41Å
1213	F	51.8	Low	54.1	Low	134 Å²	134	106 Å²	106	59%	0.588	57%	0.565	S	S	*	*	H	α-helix	trans	-72.4	-37.3	174.4	-80	-64	0	0	0	112.4	L1209 A1210 S1216 I1217	L1209-F1213 HydrophobicContact CD2-CE2 4.39Å; L1209-F1213 WeakPolarHBondContact O-CD2 3.5Å; L1209-F1213 PolarHBondContact O-N 3.23Å; A1210-F1213 PolarHBondContact O-N 3.07Å; F1213-S1216 PolarHBondContact O-N 3.42Å; F1213-I1217 WeakPolarHBondContact O-CD1 3.28Å; F1213-I1217 VanDerWaalsContact O-CG1 3.25Å; F1213-I1217 WeakPolarHBondContact O-CG1 3.41Å; F1213-I1217 PolarHBondContact O-N 3.34Å; F1213-I1217 VanDerWaalsContact O-N 3.1Å
1214	A	59.3	Low	52	Low	47 Å²	47	108.6 Å²	108.6	39%	0.388	58%	0.58	S	S	.	*	H	α-helix	trans	-60.3	-52.7	171.2	0	0	0	0	0	110.9	A1210 A1211 S1216 I1217 E1218	A1210-A1214 WeakPolarHBondContact O-CB 3.37Å; A1210-A1214 PolarHBondContact O-N 3.49Å; A1211-A1214 PolarHBondContact O-N 3.19Å; A1214-S1216 VanDerWaalsContact C-N 3.31Å; A1214-S1216 PolarHBondContact O-N 3.35Å; A1214-I1217 WeakPolarHBondContact O-CA 3.36Å; A1214-I1217 WeakPolarHBondContact O-CB 3.26Å; A1214-I1217 PolarHBondContact O-N 2.81Å; A1214-E1218 PolarHBondContact O-N 2.93Å
1215	A	52.5	Low	50	Low	47 Å²	47	109.5 Å²	109.5	39%	0.388	60%	0.596	S	S	.	*	H	α-helix	trans	-58.7	-39.8	175.3	0	0	0	0	0	112.3	A1211 I1217 E1218 E1219	A1211-A1215 VanDerWaalsContact O-CB 3.29Å; A1211-A1215 WeakPolarHBondContact O-CB 3.43Å; A1211-A1215 PolarHBondContact O-N 3.22Å; A1215-I1217 PolarHBondContact O-N 3.35Å; A1215-E1218 PolarHBondContact O-N 3.48Å; A1215-E1219 VanDerWaalsContact O-CB 3.23Å; A1215-E1219 WeakPolarHBondContact O-CB 3.44Å; A1215-E1219 PolarHBondContact O-N 3.02Å
1216	S	47.3	Very low	48.1	Very low	37 Å²	37	113.6 Å²	113.6	26%	0.259	62%	0.615	S	S	.	*	H	α-helix	trans	-69.2	-13.4	175.8	-61.3	0	0	0	0	114.4	Y1212 F1213 A1214	Y1212-S1216 WeakPolarHBondContact CE1-OG 3.08Å; Y1212-S1216 VanDerWaalsContact O-CB 3.24Å; Y1212-S1216 WeakPolarHBondContact O-CB 3.31Å; Y1212-S1216 PolarHBondContact O-N 2.86Å; Y1212-S1216 PolarHBondContact O-OG 3.41Å; F1213-S1216 PolarHBondContact O-N 3.42Å; A1214-S1216 VanDerWaalsContact C-N 3.31Å; A1214-S1216 PolarHBondContact O-N 3.35Å
1217	I	45.2	Very low	46.1	Very low	126 Å²	126	110.4 Å²	110.4	65%	0.646	62%	0.623	S	S	*	*	H	α-helix	trans	-92.3	-38.6	172.8	-71.3	164.9	0	0	0	109.8	F1213 A1214 A1215 K1220	F1213-I1217 WeakPolarHBondContact O-CD1 3.28Å; F1213-I1217 VanDerWaalsContact O-CG1 3.25Å; F1213-I1217 WeakPolarHBondContact O-CG1 3.41Å; F1213-I1217 PolarHBondContact O-N 3.34Å; F1213-I1217 VanDerWaalsContact O-N 3.1Å; A1214-I1217 WeakPolarHBondContact O-CA 3.36Å; A1214-I1217 WeakPolarHBondContact O-CB 3.26Å; A1214-I1217 PolarHBondContact O-N 2.81Å; A1215-I1217 PolarHBondContact O-N 3.35Å; I1217-K1220 PolarHBondContact O-N 3.34Å
1218	E	40.3	Very low	44.4	Very low	142 Å²	142	112.2 Å²	112.2	66%	0.664	64%	0.636	S	S	*	*	H	α-helix	trans	-70.8	-36.1	175.3	-67.9	177.4	152.1	0	0	112.6	A1214 A1215 K1220 Q1221	A1214-E1218 PolarHBondContact O-N 2.93Å; A1215-E1218 PolarHBondContact O-N 3.48Å; E1218-K1220 PolarHBondContact O-N 3.2Å; E1218-Q1221 PolarHBondContact O-N 2.87Å
1219	E	37.2	Very low	42.5	Very low	158 Å²	158	114 Å²	114	74%	0.738	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	1.9	177.3	-158.8	174.6	-133.7	0	0	113.3	A1215	A1215-E1219 VanDerWaalsContact O-CB 3.23Å; A1215-E1219 WeakPolarHBondContact O-CB 3.44Å; A1215-E1219 PolarHBondContact O-N 3.02Å
1220	K	36	Very low	40.7	Very low	187 Å²	187	116.5 Å²	116.5	81%	0.813	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.2	8.2	167	-75	-166.8	172.9	-173.5	0	114.7	I1217 E1218	I1217-K1220 PolarHBondContact O-N 3.34Å; E1218-K1220 PolarHBondContact O-N 3.2Å
1221	Q	28	Very low	38.9	Very low	163 Å²	163	120.6 Å²	120.6	76%	0.762	67%	0.669	S	S	*	*			trans	-117.3	84.3	165.7	-66.3	-168.8	-0.1	0	0	109.7	E1218 P1223	E1218-Q1221 PolarHBondContact O-N 2.87Å; Q1221-P1223 VanDerWaalsContact O-CD 3.26Å; Q1221-P1223 WeakPolarHBondContact O-CD 3.5Å
1222	V	31.4	Very low	37.1	Very low	135 Å²	135	126.8 Å²	126.8	82%	0.818	69%	0.685	S	S	*	*			trans	-84.4	112	166.3	177.2	0	0	0	0	108.2
1223	P	29.3	Very low	35.7	Very low	118 Å²	118	131.8 Å²	131.8	77%	0.766	71%	0.709	S	S	*	*			trans	-80.7	135	174.9	33.2	-33.2	0	0	0	110.3	Q1221	Q1221-P1223 VanDerWaalsContact O-CD 3.26Å; Q1221-P1223 WeakPolarHBondContact O-CD 3.5Å
1224	S	29.1	Very low	34.5	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	72%	0.715	S	S	*	*			trans	-87.1	137.5	172.9	57.4	0	0	0	0	111.9
1225	T	32	Very low	33.2	Very low	141 Å²	141	134.4 Å²	134.4	87%	0.865	74%	0.738	S	S	*	*			trans	87.9	106.1	168.1	71.6	0	0	0	0	118.2
1226	E	28.8	Very low	32	Very low	204 Å²	204	139 Å²	139	95%	0.953	76%	0.761	S	S	*	*			trans	-78.5	155.3	153.3	-59.5	-175.9	130.4	0	0	110
1227	G	29.2	Very low	31.2	Very low	75 Å²	75	140.3 Å²	140.3	77%	0.773	78%	0.78	S	S	*	*			trans	-170.9	87.6	-177.2	0	0	0	0	0	117.2
1228	S	30.4	Very low	30.6	Very low	127 Å²	127	141.7 Å²	141.7	89%	0.888	79%	0.788	S	S	*	*			trans	74.1	151.1	163.9	-161.5	0	0	0	0	118.9
1229	T	30.6	Very low	30.1	Very low	123 Å²	123	141.4 Å²	141.4	76%	0.755	79%	0.79	S	S	*	*			trans	-109.6	172	-172	48.9	0	0	0	0	113.6
1230	E	27.6	Very low	29.7	Very low	148 Å²	148	138.2 Å²	138.2	69%	0.692	79%	0.79	S	S	*	*			trans	103.5	147.1	135.4	-131.6	-154.5	144.8	0	0	121.1
1231	K	28.3	Very low	29.5	Very low	146 Å²	146	138 Å²	138	64%	0.635	79%	0.792	S	S	*	*			trans	83.9	115.5	160.2	-65.2	-179.4	169.1	66.2	0	120.9
1232	K	29.2	Very low	29.9	Very low	191 Å²	191	139.4 Å²	139.4	83%	0.83	80%	0.796	S	S	*	*			trans	72.9	119.2	156.4	-57.5	169.9	-177.4	178.5	0	115.6
1233	K	26.3	Very low	29.9	Very low	215 Å²	215	138.4 Å²	138.4	94%	0.935	79%	0.792	S	S	*	*				64	107.6	59.1	-71.3	-168.8	172.8	-175.9	0	114
1234	G	26.8	Very low	30.2	Very low	70 Å²	70	137.5 Å²	137.5	72%	0.722	79%	0.786	S	S	*	*			trans	152.6	130	159.9	0	0	0	0	0	114
1235	L	31.9	Very low	30.1	Very low	166 Å²	166	139 Å²	139	87%	0.869	79%	0.785	S	S	*	*			trans	54.9	120.9	172.7	-83.8	54.7	0	0	0	116.4
1236	V	27.9	Very low	29.8	Very low	143 Å²	143	139.8 Å²	139.8	87%	0.867	78%	0.778	S	S	*	*			cis	71.6	116.2	21.5	-164.4	0	0	0	0	114.7
1237	G	29.8	Very low	29.7	Very low	65 Å²	65	137.6 Å²	137.6	67%	0.67	77%	0.773	S	S	*	*			trans	116.3	131.8	174	0	0	0	0	0	112.6
1238	L	32	Very low	29.7	Very low	154 Å²	154	138 Å²	138	81%	0.806	77%	0.77	S	S	*	*			cis	-143.1	137.5	1.5	-121.7	78.9	0	0	0	110.7
1239	I	29.7	Very low	29.5	Very low	137 Å²	137	138.1 Å²	138.1	70%	0.703	77%	0.765	S	S	*	*				49.9	105.5	126.5	-64.9	179.8	0	0	0	117.4
1240	A	29.2	Very low	29.3	Very low	90 Å²	90	139 Å²	139	74%	0.744	76%	0.764	S	S	*	*				84.1	157	80.6	0	0	0	0	0	112.9
1241	Q	32.1	Very low	29.2	Very low	184 Å²	184	137.9 Å²	137.9	86%	0.86	76%	0.763	S	S	*	*			cis	-140.6	163.5	28.4	-57.1	173.7	6.6	0	0	114.2
1242	K	35.4	Very low	29.1	Very low	192 Å²	192	140.9 Å²	140.9	84%	0.835	77%	0.77	S	S	*	*			trans	-112.9	155.8	161.5	-149	-179.2	-173.4	-177.2	0	106.2
1243	P	32.6	Very low	29	Very low	113 Å²	113	140.5 Å²	140.5	73%	0.734	77%	0.768	S	S	*	*				-149.7	-141.1	99.5	42.6	-20.6	0	0	0	112.6
1244	P	35.5	Very low	29	Very low	100 Å²	100	135.4 Å²	135.4	65%	0.649	76%	0.758	S	S	*	*				-143	-174.7	-120	42.7	-19.2	0	0	0	118.7
1245	I	27.6	Very low	28.9	Very low	136 Å²	136	142.8 Å²	142.8	70%	0.697	77%	0.77	S	S	*	*			trans	76.5	153	143.2	-84.8	160.7	0	0	0	119.6
1246	E	25.4	Very low	28.7	Very low	156 Å²	156	140.5 Å²	140.5	73%	0.729	77%	0.767	S	S	*	*			trans	-6.1	144.9	173	-67.7	109.2	-121	0	0	119
1247	D	26.2	Very low	28.7	Very low	158 Å²	158	137 Å²	137	85%	0.845	76%	0.76	S	S	*	*			cis	-168.1	-171.1	44.7	-145.4	-24.7	0	0	0	114.2
1248	A	29.1	Very low	28.7	Very low	85 Å²	85	138.6 Å²	138.6	70%	0.702	77%	0.767	S	S	*	*			trans	68.5	87.7	155.4	0	0	0	0	0	120.6
1249	V	25.9	Very low	28.6	Very low	129 Å²	129	135 Å²	135	78%	0.782	76%	0.759	S	S	*	*			trans	-14.7	126.5	141.9	178.1	0	0	0	0	116.7
1250	N	27.3	Very low	28.7	Very low	140 Å²	140	138.7 Å²	138.7	75%	0.749	76%	0.764	S	S	*	*				-168.3	113.3	128.2	-106.3	-52.2	0	0	0	116.8
1251	L	25.8	Very low	28.7	Very low	125 Å²	125	139.7 Å²	139.7	65%	0.654	76%	0.757	S	S	*	*			trans	39.6	131.8	135.4	-78.3	171.5	0	0	0	123.8
1252	R	26	Very low	28.4	Very low	209 Å²	209	137.2 Å²	137.2	79%	0.789	76%	0.759	S	S	*	*			trans	77.5	145.7	151.8	-60.2	159.3	-178.1	-167.9	1.7	116.1
1253	K	25.8	Very low	28.3	Very low	183 Å²	183	135.7 Å²	135.7	80%	0.796	76%	0.76	S	S	*	*			cis	-153.7	156.9	-6.7	-117.8	176.3	178.7	-173.8	0	108.1
1254	P	26.5	Very low	28	Very low	109 Å²	109	137.1 Å²	137.1	71%	0.708	76%	0.761	S	S	*	*			trans	-72	156.1	172.9	31.9	-35.7	0	0	0	111.7	C1256	P1254-C1256 VanDerWaalsContact C-N 3.34Å; P1254-C1256 PolarHBondContact O-N 3.44Å
1255	F	26	Very low	28	Very low	224 Å²	224	135.4 Å²	135.4	98%	0.982	75%	0.752	S	S	*	*	S	Bend	trans	-75.9	82.5	175.6	-128.6	-88.5	0	0	0	110.8
1256	C	28.1	Very low	28.1	Very low	119 Å²	119	131.6 Å²	131.6	80%	0.804	74%	0.737	S	S	*	*			trans	-151.4	132.8	173	-162.3	0	0	0	0	110	P1254	P1254-C1256 VanDerWaalsContact C-N 3.34Å; P1254-C1256 PolarHBondContact O-N 3.44Å
1257	G	27.2	Very low	28.4	Very low	70 Å²	70	126.9 Å²	126.9	72%	0.722	73%	0.725	S	S	*	*			trans	93.2	164.5	-162.4	0	0	0	0	0	112
1258	A	30.6	Very low	28.7	Very low	98 Å²	98	125.6 Å²	125.6	81%	0.81	71%	0.712	S	S	*	*			cis	-166.2	177	4.4	0	0	0	0	0	109.8
1259	A	29.2	Very low	29	Very low	79 Å²	79	130.8 Å²	130.8	65%	0.653	72%	0.721	S	S	*	*			cis	-116.9	-117.7	-30.8	0	0	0	0	0	108.5
1260	W	30.8	Very low	29.1	Very low	213 Å²	213	127.6 Å²	127.6	81%	0.807	71%	0.714	S	S	*	*			cis	-145.8	170.8	-2.3	-68	86.8	0	0	0	106.8
1261	D	30.2	Very low	29.4	Very low	111 Å²	111	130.7 Å²	130.7	59%	0.594	72%	0.721	S	S	*	*			cis	-136.4	161.9	14.9	-72.5	-76.8	0	0	0	111.7
1262	C	25.6	Very low	29.7	Very low	132 Å²	132	129.3 Å²	129.3	89%	0.892	72%	0.722	S	S	*	*			trans	-148.2	107.6	159.7	-82.1	0	0	0	0	107.3
1263	D	33	Very low	30.2	Very low	160 Å²	160	125.2 Å²	125.2	86%	0.856	72%	0.72	S	S	*	*			trans	-72.2	140.4	-176.4	-75.6	-58.4	0	0	0	113.3
1264	D	27.3	Very low	30.3	Very low	143 Å²	143	123.9 Å²	123.9	77%	0.765	72%	0.722	S	S	*	*			trans	-130.4	130.9	166.3	-175	2.4	0	0	0	109.2	R1029	R1029-D1264 IonicContact NH2-OD1 3.49Å
1265	S	34.5	Very low	30.7	Very low	65 Å²	65	123.1 Å²	123.1	46%	0.455	73%	0.725	S	S	.	*			trans	-140.3	94.8	-179.8	41.3	0	0	0	0	113.3	R1029	R1029-S1265 WeakPolarHBondContact CG-O 3.26Å; R1029-S1265 PolarHBondContact NE-O 3.33Å
1266	S	30	Very low	30.8	Very low	55 Å²	55	120.4 Å²	120.4	39%	0.385	72%	0.72	S	S	.	*				52.3	123.3	126.1	54.5	0	0	0	0	123.8	R1029	R1029-S1266 WeakPolarHBondContact CB-O 3.5Å; R1029-S1266 VanDerWaalsContact CD-C 3.46Å; R1029-S1266 WeakPolarHBondContact CD-O 3.16Å; R1029-S1266 WeakPolarHBondContact CG-O 3.39Å; R1029-S1266 VanDerWaalsContact CZ-C 3.45Å; R1029-S1266 PolarHBondContact NE-O 2.79Å
1267	A	31	Very low	30.9	Very low	58 Å²	58	118.7 Å²	118.7	48%	0.479	71%	0.714	S	S	.	*			trans	73.8	146	142.4	0	0	0	0	0	123.6	R1029	R1029-A1267 WeakPolarHBondContact CB-O 3.42Å; R1029-A1267 VanDerWaalsContact CD-O 3.25Å; R1029-A1267 WeakPolarHBondContact CD-O 3.31Å
1268	K	34	Very low	30.9	Very low	131 Å²	131	122.1 Å²	122.1	57%	0.57	72%	0.716	S	S	*	*			trans	84	138.7	172.9	-50.1	163.8	-171.5	163.5	0	117.8	S1027 L1028	S1027-K1268 PolarHBondContact O-NZ 3.29Å; L1028-K1268 PolarHBondContact O-NZ 2.89Å
1269	H	33.5	Very low	30.8	Very low	194 Å²	194	123.4 Å²	123.4	90%	0.898	71%	0.713	S	S	*	*			cis	-165.7	146.5	-41.9	-127.2	10	0	0	0	112.7
1270	G	29.1	Very low	30.8	Very low	62 Å²	62	125.7 Å²	125.7	64%	0.639	72%	0.718	S	S	*	*			trans	94.9	118.7	139.2	0	0	0	0	0	120.8
1271	K	32.3	Very low	30.8	Very low	205 Å²	205	119.1 Å²	119.1	89%	0.891	71%	0.71	S	S	*	*			trans	72.1	144.6	144.1	-62.6	177.1	-177.4	179.3	0	118
1272	S	32.4	Very low	30.6	Very low	96 Å²	96	119.4 Å²	119.4	67%	0.671	72%	0.721	S	S	*	*			cis	-167.1	176	-10.7	45.3	0	0	0	0	111.9
1273	T	36.2	Very low	31.2	Very low	122 Å²	122	119 Å²	119	75%	0.748	72%	0.716	S	S	*	*			trans	73.2	127.6	171.8	64.3	0	0	0	0	115.9
1274	N	28	Very low	30.9	Very low	156 Å²	156	116.2 Å²	116.2	83%	0.834	71%	0.709	S	S	*	*			cis	110.9	89.1	18.8	-74.2	14.5	0	0	0	112
1275	A	35.4	Very low	30.9	Very low	92 Å²	92	116.1 Å²	116.1	76%	0.76	71%	0.709	S	S	*	*			trans	-167.4	106.3	135.5	0	0	0	0	0	106.2
1276	L	28.2	Very low	30.6	Very low	168 Å²	168	118.1 Å²	118.1	88%	0.88	72%	0.718	S	S	*	*				75.9	134.4	71.1	-86.5	169	0	0	0	114.2
1277	A	30.2	Very low	30.5	Very low	82 Å²	82	121.5 Å²	121.5	68%	0.678	73%	0.731	S	S	*	*			trans	68	139.2	158.1	0	0	0	0	0	118
1278	D	28.3	Very low	30.5	Very low	143 Å²	143	127.8 Å²	127.8	77%	0.765	75%	0.748	S	S	*	*			cis	-168.2	169.5	-18.6	-119.7	-42	0	0	0	110.8
1279	V	28.3	Very low	30.3	Very low	125 Å²	125	126.9 Å²	126.9	76%	0.758	75%	0.753	S	S	*	*			trans	56.2	144.7	143	161.9	0	0	0	0	121
1280	V	27.6	Very low	30.3	Very low	126 Å²	126	124.5 Å²	124.5	76%	0.764	75%	0.747	S	S	*	*			cis	-170.4	176.7	-31.8	94.1	0	0	0	0	107.8
1281	A	32	Very low	30.4	Very low	76 Å²	76	128.9 Å²	128.9	63%	0.628	76%	0.756	S	S	*	*			trans	63.6	102.3	163	0	0	0	0	0	120
1282	S	25.2	Very low	30.4	Very low	117 Å²	117	125.4 Å²	125.4	82%	0.818	75%	0.752	S	S	*	*				45.8	145.4	100.7	-54.2	0	0	0	0	121.9
1283	P	37.9	Very low	30.3	Very low	124 Å²	124	127.9 Å²	127.9	81%	0.805	76%	0.757	S	S	*	*			trans	-92.8	166.4	-169.9	38.8	-38.2	0	0	0	114.5
1284	S	26.8	Very low	30	Very low	100 Å²	100	127.7 Å²	127.7	70%	0.699	76%	0.755	S	S	*	*				179.9	167.5	123.1	54.5	0	0	0	0	113.8
1285	N	28.1	Very low	30.2	Very low	142 Å²	142	128 Å²	128	76%	0.759	75%	0.749	S	S	*	*			trans	93.3	139.5	134.1	-93	-41.9	0	0	0	123.5
1286	V	28.1	Very low	29.9	Very low	106 Å²	106	129.5 Å²	129.5	64%	0.642	74%	0.741	S	S	*	*			trans	82.3	79.1	142.6	176	0	0	0	0	119
1287	N	28.8	Very low	29.9	Very low	126 Å²	126	128.7 Å²	128.7	67%	0.674	73%	0.73	S	S	*	*				78.3	142.5	109.2	-75.7	-37.4	0	0	0	123.3
1288	K	29.4	Very low	29.7	Very low	190 Å²	190	130.6 Å²	130.6	83%	0.826	73%	0.734	S	S	*	*			trans	72.2	141.7	147.5	-71.3	166.7	-176.8	-179.7	0	116.4
1289	V	31.2	Very low	29.6	Very low	113 Å²	113	134.2 Å²	134.2	69%	0.685	74%	0.737	S	S	*	*			cis	-154.7	151.9	10.7	96.6	0	0	0	0	114.3
1290	N	32	Very low	29.9	Very low	144 Å²	144	133.3 Å²	133.3	77%	0.77	73%	0.733	S	S	*	*			trans	55.1	114.4	154.9	-60.2	-9.5	0	0	0	124.4
1291	N	31.8	Very low	29.8	Very low	154 Å²	154	132.3 Å²	132.3	82%	0.824	73%	0.732	S	S	*	*			trans	-51.5	152.6	145.5	-59.4	-51.8	0	0	0	114.6
1292	T	32.5	Very low	29.8	Very low	131 Å²	131	137.5 Å²	137.5	80%	0.804	74%	0.743	S	S	*	*				177.1	149.1	127.9	21.2	0	0	0	0	109
1293	L	31.1	Very low	29.8	Very low	148 Å²	148	143.3 Å²	143.3	78%	0.775	75%	0.747	S	S	*	*			cis	-129.6	141.4	1.4	-80.7	108.3	0	0	0	108.4
1294	V	29.1	Very low	29.4	Very low	118 Å²	118	142.6 Å²	142.6	72%	0.715	75%	0.745	S	S	*	*				56.2	118.1	77	179.6	0	0	0	0	111.5
1295	K	31.9	Very low	29.4	Very low	163 Å²	163	142.7 Å²	142.7	71%	0.709	75%	0.751	S	S	*	*			cis	-123.1	172.8	28	-73	172.8	155.1	-92.5	0	112.1
1296	E	29.5	Very low	29.4	Very low	124 Å²	124	140.2 Å²	140.2	58%	0.579	75%	0.751	S	S	*	*			cis	-160	143.8	-19.2	-103.6	158.5	-14.8	0	0	107.4
1297	F	27.7	Very low	29.4	Very low	150 Å²	150	141.4 Å²	141.4	66%	0.658	76%	0.758	S	S	*	*				49.2	112.7	88.6	-65.2	-74	0	0	0	114.9
1298	T	27.5	Very low	29.3	Very low	122 Å²	122	140.8 Å²	140.8	75%	0.748	76%	0.758	S	S	*	*			cis	57.7	119.9	31.6	82.8	0	0	0	0	115.7
1299	R	26.1	Very low	29.2	Very low	219 Å²	219	137 Å²	137	83%	0.826	75%	0.751	S	S	*	*			trans	-173.2	165.6	157.4	-102	146.2	-164.7	-90.9	-1.1	111.4
1300	P	33.1	Very low	29.2	Very low	106 Å²	106	138.1 Å²	138.1	69%	0.688	75%	0.753	S	S	*	*			trans	-135.3	-170.6	-145.8	40.7	-21.7	0	0	0	115.9
1301	S	26.8	Very low	28.9	Very low	105 Å²	105	137 Å²	137	73%	0.734	75%	0.752	S	S	*	*			trans	58	134.9	147.2	64	0	0	0	0	121.6
1302	H	30.4	Very low	28.8	Very low	186 Å²	186	136 Å²	136	86%	0.861	75%	0.751	S	S	*	*			trans	-36.1	131.8	173.6	-52.5	-97.7	0	0	0	117.7
1303	R	26.7	Very low	28.6	Very low	239 Å²	239	134.2 Å²	134.2	90%	0.902	75%	0.749	S	S	*	*				-178.1	160.1	112.1	-104.9	-179.9	175	-173.3	-1.1	114.5
1304	S	28.7	Very low	28.6	Very low	109 Å²	109	133 Å²	133	76%	0.762	75%	0.75	S	S	*	*			trans	65.8	90.7	153.8	-58.2	0	0	0	0	121.3
1305	A	27.4	Very low	28.6	Very low	101 Å²	101	132.4 Å²	132.4	84%	0.835	75%	0.752	S	S	*	*				47.7	133.9	115	0	0	0	0	0	123.3
1306	A	28	Very low	28.7	Very low	90 Å²	90	130.9 Å²	130.9	74%	0.744	76%	0.761	S	S	*	*			trans	100.8	122.4	133.9	0	0	0	0	0	121.3
1307	V	27	Very low	28.7	Very low	131 Å²	131	135.8 Å²	135.8	79%	0.794	78%	0.775	S	S	*	*			trans	91.6	101.9	134.4	166.3	0	0	0	0	120.3
1308	V	28	Very low	28.9	Very low	113 Å²	113	136.5 Å²	136.5	69%	0.685	79%	0.785	S	S	*	*			trans	86.1	105.5	132.3	169.5	0	0	0	0	120.6
1309	T	27.3	Very low	29.1	Very low	111 Å²	111	135.4 Å²	135.4	68%	0.681	78%	0.78	S	S	*	*			trans	54.9	154.3	139.8	81.1	0	0	0	0	119.8
1310	D	30.9	Very low	29.3	Very low	136 Å²	136	131.8 Å²	131.8	73%	0.727	78%	0.782	S	S	*	*			cis	-141.2	168.7	20.1	-107.1	-61.2	0	0	0	115.8
1311	V	25.5	Very low	29.3	Very low	122 Å²	122	133 Å²	133	74%	0.739	79%	0.788	S	S	*	*			trans	-12	131.6	161.5	179.5	0	0	0	0	118.7
1312	V	29.7	Very low	29.4	Very low	131 Å²	131	132.4 Å²	132.4	79%	0.794	79%	0.789	S	S	*	*				-168.6	137.6	117.2	146.2	0	0	0	0	110
1313	A	28.2	Very low	29.2	Very low	94 Å²	94	134.8 Å²	134.8	78%	0.777	79%	0.791	S	S	*	*			trans	-126.7	124.8	167	0	0	0	0	0	110.1
1314	P	31.7	Very low	29.4	Very low	123 Å²	123	131 Å²	131	80%	0.799	79%	0.787	S	S	*	*			trans	-95.6	109.8	172.4	33.2	-28.8	0	0	0	111.3
1315	S	28.6	Very low	29.5	Very low	106 Å²	106	130.2 Å²	130.2	74%	0.741	79%	0.787	S	S	*	*			trans	-88.8	121.5	165.8	63	0	0	0	0	110.7	R1317	S1315-R1317 PolarHBondContact O-N 3Å
1316	S	33.8	Very low	29.5	Very low	130 Å²	130	130.7 Å²	130.7	91%	0.909	79%	0.785	S	S	*	*			trans	-94.2	82	163	50.5	0	0	0	0	110.8
1317	R	30.1	Very low	29.5	Very low	228 Å²	228	132.4 Å²	132.4	86%	0.86	79%	0.786	S	S	*	*			trans	-81.8	141.3	156.7	-76.6	176.5	168.1	161.6	-4.6	108.2	S1315	S1315-R1317 PolarHBondContact O-N 3Å
1318	D	30.7	Very low	29.7	Very low	164 Å²	164	130.9 Å²	130.9	88%	0.877	79%	0.787	S	S	*	*			trans	-117.1	130	162.1	-144.6	-4.1	0	0	0	107.6
1319	P	32.1	Very low	29.8	Very low	99 Å²	99	128.7 Å²	128.7	64%	0.643	79%	0.787	S	S	*	*			trans	-127.2	141.4	-143.3	38.8	-23.8	0	0	0	117.3
1320	V	30	Very low	29.9	Very low	143 Å²	143	131.6 Å²	131.6	87%	0.867	80%	0.797	S	S	*	*			trans	-149.2	128.4	158.2	179.5	0	0	0	0	107.6
1321	T	33.8	Very low	29.6	Very low	133 Å²	133	130.1 Å²	130.1	82%	0.816	80%	0.797	S	S	*	*			cis	-149.5	150.6	-21.9	-84.3	0	0	0	0	106.7
1322	A	27.8	Very low	29.9	Very low	92 Å²	92	132.3 Å²	132.3	76%	0.76	80%	0.804	S	S	*	*			trans	-107.2	146.1	-172.3	0	0	0	0	0	114.8
1323	R	27.1	Very low	29.8	Very low	236 Å²	236	132.5 Å²	132.5	89%	0.891	81%	0.805	S	S	*	*			trans	168.8	141.3	151.2	-91.7	-176.7	-177.7	-157.3	-1	106.3
1324	L	30.7	Very low	30.3	Very low	158 Å²	158	133 Å²	133	83%	0.827	80%	0.8	S	S	*	*			cis	-147.2	168.7	-3.7	-105.2	158.3	0	0	0	108.5
1325	A	30.6	Very low	30.2	Very low	93 Å²	93	134.9 Å²	134.9	77%	0.769	80%	0.804	S	S	*	*			trans	-121.8	164.5	177	0	0	0	0	0	111.5
1326	S	27.9	Very low	30.3	Very low	111 Å²	111	133.5 Å²	133.5	78%	0.776	81%	0.806	S	S	*	*				168.6	163.9	123.5	-161.9	0	0	0	0	113.3
1327	V	28.4	Very low	30	Very low	127 Å²	127	132.5 Å²	132.5	77%	0.77	80%	0.799	S	S	*	*			trans	62.6	116.5	167	-161.8	0	0	0	0	116.8
1328	A	31.8	Very low	30.1	Very low	99 Å²	99	127 Å²	127	82%	0.818	80%	0.795	S	S	*	*			cis	98.9	140.4	14.9	0	0	0	0	0	117.1
1329	G	28.6	Very low	30	Very low	67 Å²	67	130.2 Å²	130.2	69%	0.691	80%	0.795	S	S	*	*			trans	112.9	90.1	-177.9	0	0	0	0	0	112.5
1330	I	29.2	Very low	29.7	Very low	171 Å²	171	135.1 Å²	135.1	88%	0.877	81%	0.806	S	S	*	*				68.6	107.3	62.8	-53.7	169.9	0	0	0	113.5
1331	S	25.6	Very low	29.4	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	80%	0.8	S	S	*	*				-176.6	157.1	110.3	-160.6	0	0	0	0	112.8
1332	L	32	Very low	29.1	Very low	168 Å²	168	132.2 Å²	132.2	88%	0.88	80%	0.796	S	S	*	*			trans	-135	140.2	174.3	-83.8	168.3	0	0	0	109.7
1333	V	28.5	Very low	29.7	Very low	136 Å²	136	133.8 Å²	133.8	82%	0.824	80%	0.8	S	S	*	*			trans	-143.2	131.1	166.9	-173.6	0	0	0	0	109.9
1334	P	36.6	Very low	29.9	Very low	103 Å²	103	127.6 Å²	127.6	67%	0.669	79%	0.791	S	S	*	*			trans	-121.6	-179.8	-172.1	43.6	-35	0	0	0	116.5
1335	N	30.5	Very low	29.7	Very low	164 Å²	164	126.1 Å²	126.1	88%	0.877	79%	0.788	S	S	*	*			trans	79.9	137.6	156.9	-66.5	-24.4	0	0	0	120.7
1336	G	29.8	Very low	29.6	Very low	77 Å²	77	127.7 Å²	127.7	79%	0.794	79%	0.788	S	S	*	*			trans	-170.2	47.8	-175.2	0	0	0	0	0	116.9
1337	S	29.6	Very low	29.5	Very low	109 Å²	109	130.5 Å²	130.5	76%	0.762	79%	0.793	S	S	*	*			trans	12.7	121.6	161.4	-59.8	0	0	0	0	122.5
1338	S	31.7	Very low	29.6	Very low	111 Å²	111	131.2 Å²	131.2	78%	0.776	79%	0.792	S	S	*	*				173	113	116	-77.9	0	0	0	0	111.7
1339	R	27.1	Very low	29.2	Very low	232 Å²	232	130.9 Å²	130.9	88%	0.875	78%	0.783	S	S	*	*				59.3	100.3	79.1	-66.4	-168.3	-168.8	-158.5	7.3	115.5
1340	K	26.6	Very low	29	Very low	203 Å²	203	136 Å²	136	88%	0.883	79%	0.786	S	S	*	*				-175.4	153.1	111	-100.3	168.3	-177.1	179.1	0	114.3
1341	C	24.3	Very low	28.8	Very low	109 Å²	109	132.7 Å²	132.7	74%	0.736	78%	0.778	S	S	*	*			trans	-30.1	163.9	168.4	53.4	0	0	0	0	119.1
1342	S	27.4	Very low	28.7	Very low	105 Å²	105	136.8 Å²	136.8	73%	0.734	79%	0.786	S	S	*	*			cis	-162.6	150	13.8	21.5	0	0	0	0	113.1
1343	C	39.8	Very low	28.3	Very low	125 Å²	125	134.3 Å²	134.3	85%	0.845	77%	0.772	S	S	*	*			trans	-79.1	147	148.8	-55.7	0	0	0	0	109.2
1344	P	32.1	Very low	28.3	Very low	107 Å²	107	134 Å²	134	70%	0.695	77%	0.773	S	S	*	*				-148.5	143.3	95.5	41.7	-24.9	0	0	0	113.5
1345	T	26.4	Very low	27.8	Very low	126 Å²	126	136.5 Å²	136.5	77%	0.773	77%	0.773	S	S	*	*				83.7	122.1	90.6	-56.1	0	0	0	0	116.1
1346	V	28.7	Very low	27.7	Very low	126 Å²	126	134.6 Å²	134.6	76%	0.764	77%	0.77	S	S	*	*			trans	25.4	130.9	146.2	-176.8	0	0	0	0	119.9
1347	I	26.2	Very low	27.5	Very low	171 Å²	171	138.9 Å²	138.9	88%	0.877	77%	0.774	S	S	*	*			trans	-145.6	145.7	136	-103.5	154.2	0	0	0	109.4
1348	D	30.2	Very low	27.8	Very low	141 Å²	141	137 Å²	137	75%	0.754	77%	0.772	S	S	*	*			trans	-91.7	-175.5	179.6	-176	20.9	0	0	0	111.1
1349	C	23.4	Very low	27.4	Very low	92 Å²	92	140.2 Å²	140.2	62%	0.622	77%	0.772	S	S	*	*			trans	106.8	120.3	165.2	-65.4	0	0	0	0	118.4
1350	K	23.6	Very low	27.4	Very low	175 Å²	175	132.4 Å²	132.4	76%	0.761	75%	0.748	S	S	*	*			trans	70.2	99.2	133.3	-65.3	174	-176	176.5	0	118.8
1351	S	24.4	Very low	27.3	Very low	102 Å²	102	129.9 Å²	129.9	71%	0.713	73%	0.733	S	S	*	*				37.7	93	121.8	63.5	0	0	0	0	117.4
1352	Q	24.1	Very low	27.2	Very low	191 Å²	191	127.9 Å²	127.9	89%	0.893	71%	0.713	S	S	*	*			trans	-147	119.8	151.8	-120.9	154	105.4	0	0	112.3
1353	I	23.7	Very low	27.1	Very low	115 Å²	115	129.3 Å²	129.3	59%	0.59	71%	0.707	S	S	*	*			trans	-70.3	146.9	176	-53.7	153.3	0	0	0	108	K1355	I1353-K1355 HydrophobicContact CB-CG 4.13Å; I1353-K1355 HydrophobicContact CD1-CD 4.24Å; I1353-K1355 HydrophobicContact CD1-CG 4.39Å; I1353-K1355 HydrophobicContact CG2-CG 4.12Å; I1353-K1355 PolarHBondContact O-N 2.77Å
1354	P	28.2	Very low	26.6	Very low	131 Å²	131	128.3 Å²	128.3	85%	0.851	69%	0.692	S	S	*	*			trans	-67.3	70.8	157.5	30.8	-34.7	0	0	0	109.9
1355	K	26.2	Very low	26.3	Very low	154 Å²	154	129.1 Å²	129.1	67%	0.67	69%	0.691	S	S	*	*			trans	-68.1	149.4	172.9	-97.3	172.3	174.1	173	0	109.2	I1353 L1357	I1353-K1355 HydrophobicContact CB-CG 4.13Å; I1353-K1355 HydrophobicContact CD1-CD 4.24Å; I1353-K1355 HydrophobicContact CD1-CG 4.39Å; I1353-K1355 HydrophobicContact CG2-CG 4.12Å; I1353-K1355 PolarHBondContact O-N 2.77Å; K1355-L1357 PolarHBondContact O-N 2.86Å
1356	P	28.4	Very low	26.5	Very low	124 Å²	124	126.9 Å²	126.9	81%	0.805	68%	0.68	S	S	*	*			trans	-71.1	117.7	-163.3	27.2	-35.2	0	0	0	112.6	G1358	P1356-G1358 VanDerWaalsContact C-N 3.25Å; P1356-G1358 PolarHBondContact O-N 3.44Å
1357	L	26.6	Very low	26.5	Very low	168 Å²	168	129.6 Å²	129.6	88%	0.88	68%	0.682	S	S	*	*			trans	-82	68.8	170.7	-72.4	174.7	0	0	0	111.3	K1355 F1359	K1355-L1357 PolarHBondContact O-N 2.86Å; L1357-F1359 PolarHBondContact O-N 3.29Å
1358	G	34.5	Very low	26.7	Very low	70 Å²	70	131 Å²	131	72%	0.722	68%	0.682	S	S	*	*			trans	-78.9	104.3	153.4	0	0	0	0	0	108.2	P1356	P1356-G1358 VanDerWaalsContact C-N 3.25Å; P1356-G1358 PolarHBondContact O-N 3.44Å
1359	F	24.6	Very low	26.8	Very low	177 Å²	177	133.1 Å²	133.1	78%	0.776	68%	0.684	S	S	*	*			trans	-135.7	110.5	177.8	-151.1	-83.1	0	0	0	113.2	L1357	L1357-F1359 PolarHBondContact O-N 3.29Å
1360	N	25.1	Very low	27.1	Very low	68 Å²	68	136.4 Å²	136.4	36%	0.364	70%	0.695	S	S	.	*			trans	80.6	152.4	176.5	-42.5	-51.3	0	0	0	109.6	K706 D707	K706-N1360 VanDerWaalsContact C-OD1 3.22Å; K706-N1360 PolarHBondContact O-ND2 3.02Å; K706-N1360 PolarHBondContact O-OD1 3.24Å; D707-N1360 VanDerWaalsContact C-CG 3.41Å; D707-N1360 PolarHBondContact N-OD1 3.08Å; D707-N1360 VanDerWaalsContact N-OD1 3.08Å; D707-N1360 VanDerWaalsContact O-CB 3.26Å; D707-N1360 WeakPolarHBondContact O-CB 3.12Å; D707-N1360 PolarHBondContact O-ND2 3.46Å
1361	R	24.5	Very low	27.5	Very low	150 Å²	150	133.5 Å²	133.5	57%	0.566	69%	0.692	S	S	*	*			cis	177.5	115.6	23.3	-55.3	-169.9	67.2	-172.7	-10.4	106.3	N708 V709 S710	N708-R1361 VanDerWaalsContact C-CB 3.44Å; N708-R1361 WeakPolarHBondContact O-CB 3.47Å; N708-R1361 WeakPolarHBondContact O-CG 3.33Å; N708-R1361 PolarHBondContact O-NE 3.11Å; N708-R1361 PolarHBondContact O-NH2 2.97Å; V709-R1361 VanDerWaalsContact C-NH2 3.29Å; V709-R1361 VanDerWaalsContact CA-CB 3.47Å; V709-R1361 HydrophobicContact CB-CB 4.4Å; V709-R1361 PolarHBondContact O-NH2 3.03Å; S710-R1361 PolarHBondContact O-NH1 3.17Å; S710-R1361 PolarHBondContact O-NH2 2.95Å
1362	M	24.2	Very low	27.8	Very low	67 Å²	67	132.3 Å²	132.3	33%	0.33	70%	0.696	S	S	.	*			cis	-118.4	-122.5	9	-156.8	-157.2	-125.2	0	0	110.8	N708 V709 L1364	N708-M1362 HydrophobicContact CB-CE 4.44Å; N708-M1362 HydrophobicContact CB-CG 3.91Å; N708-M1362 WeakPolarHBondContact OD1-CG 3.42Å; V709-M1362 HydrophobicContact CB-CB 3.76Å; V709-M1362 HydrophobicContact CG1-CB 4.04Å; V709-M1362 HydrophobicContact CG1-CE 4.45Å; V709-M1362 HydrophobicContact CG1-SD 4.47Å; M1362-L1364 HydrophobicContact SD-CG 4.21Å
1363	F	24.8	Very low	28.1	Very low	136 Å²	136	130.6 Å²	130.6	60%	0.596	69%	0.693	S	S	*	*			cis	-139.7	151.9	1.5	-140	-77.9	0	0	0	113.6	K706 D707 V709	K706-F1363 PolarHBondContact NZ-O 3.16Å; D707-F1363 PolarHBondContact OD1-N 3.41Å; D707-F1363 VanDerWaalsContact OD1-N 3.11Å; V709-F1363 HydrophobicContact CG1-CE2 4.29Å
1364	L	28	Very low	28.5	Very low	103 Å²	103	135.1 Å²	135.1	54%	0.539	71%	0.708	S	S	.	*			trans	-51.5	151.4	163.6	-53.7	-176.4	0	0	0	109.8	M1362	M1362-L1364 HydrophobicContact SD-CG 4.21Å
1365	N	27	Very low	28.5	Very low	124 Å²	124	134 Å²	134	66%	0.663	70%	0.703	S	S	*	*			cis	-176.4	170.1	-0.7	-111.7	-22.1	0	0	0	105.4
1366	S	29.3	Very low	29	Very low	79 Å²	79	131.8 Å²	131.8	55%	0.552	71%	0.705	S	S	*	*			cis	-160.5	144	-15.1	-127.8	0	0	0	0	111.2
1367	K	28.9	Very low	29	Very low	184 Å²	184	131.2 Å²	131.2	80%	0.8	70%	0.704	S	S	*	*			trans	32.5	110.5	141	-59	173.1	179.2	174.9	0	121.1
1368	K	32	Very low	29.2	Very low	200 Å²	200	127.4 Å²	127.4	87%	0.87	70%	0.696	S	S	*	*				160.9	129.3	116.9	-85.6	160	-177.2	-179.8	0	109
1369	K	30.3	Very low	29	Very low	185 Å²	185	130.4 Å²	130.4	80%	0.804	70%	0.696	S	S	*	*			cis	94.3	103.3	34.1	-173.1	-170.2	-178.5	-174.7	0	112.8
1370	L	31.5	Very low	29.1	Very low	161 Å²	161	128.5 Å²	128.5	84%	0.843	69%	0.694	S	S	*	*			trans	179.1	92.2	153.2	-93.3	162.6	0	0	0	105.8
1371	T	30.7	Very low	29.3	Very low	114 Å²	114	132.1 Å²	132.1	70%	0.699	72%	0.719	S	S	*	*				64.9	114.2	83.4	63	0	0	0	0	116
1372	G	31.6	Very low	29.4	Very low	77 Å²	77	130.1 Å²	130.1	79%	0.794	73%	0.727	S	S	*	*			trans	-175.9	114.9	170.6	0	0	0	0	0	110.6
1373	N	29.4	Very low	29.6	Very low	155 Å²	155	134.1 Å²	134.1	83%	0.829	75%	0.749	S	S	*	*			trans	-98.7	144.6	-164.5	-56.3	-33	0	0	0	113.6
1374	K	32	Very low	29.7	Very low	210 Å²	210	132.4 Å²	132.4	91%	0.913	76%	0.759	S	S	*	*				177.6	164	111.2	-94.6	171.1	-178.5	-177.8	0	112.4
1375	S	29.4	Very low	29.6	Very low	108 Å²	108	131.5 Å²	131.5	76%	0.755	76%	0.755	S	S	*	*			trans	-150.3	-162.5	-172.4	52.8	0	0	0	0	110.2
1376	P	35.4	Very low	29.5	Very low	107 Å²	107	131.7 Å²	131.7	70%	0.695	76%	0.761	S	S	*	*				-129.7	-167.8	-87.7	41.9	-25.3	0	0	0	114.7
1377	S	28.6	Very low	29.3	Very low	113 Å²	113	137.2 Å²	137.2	79%	0.79	77%	0.769	S	S	*	*			trans	75.6	150.4	148.8	62.7	0	0	0	0	123
1378	A	31.1	Very low	29.2	Very low	87 Å²	87	135.1 Å²	135.1	72%	0.719	77%	0.765	S	S	*	*			trans	101.8	112.2	152.4	0	0	0	0	0	120.8
1379	D	29.7	Very low	28.9	Very low	134 Å²	134	134.1 Å²	134.1	72%	0.717	76%	0.761	S	S	*	*				80.1	122.6	126.1	-73.2	33.3	0	0	0	125.8
1380	N	27.3	Very low	28.6	Very low	136 Å²	136	132.9 Å²	132.9	73%	0.727	76%	0.756	S	S	*	*			trans	59.2	100.1	135.3	-56	-34.5	0	0	0	121.2
1381	T	30.5	Very low	28.4	Very low	145 Å²	145	132.1 Å²	132.1	89%	0.89	75%	0.75	S	S	*	*			trans	-153.3	158	137.3	-15.4	0	0	0	0	111.6
1382	S	26.3	Very low	28.1	Very low	107 Å²	107	136.8 Å²	136.8	75%	0.748	76%	0.755	S	S	*	*			trans	-78.3	151.5	176	49.6	0	0	0	0	112.2
1383	I	28.4	Very low	27.9	Very low	152 Å²	152	141.8 Å²	141.8	78%	0.779	76%	0.755	S	S	*	*			trans	-153.3	139.7	160.4	-101.4	142.8	0	0	0	109.4	D1385	I1383-D1385 HydrophobicContact CG2-CB 4Å
1384	A	26.1	Very low	27.8	Very low	99 Å²	99	140.8 Å²	140.8	82%	0.818	75%	0.749	S	S	*	*			trans	-112.2	113.7	158.6	0	0	0	0	0	107.7
1385	D	26.2	Very low	27.5	Very low	85 Å²	85	136.7 Å²	136.7	46%	0.455	74%	0.743	S	S	.	*			trans	-154.5	138.8	172.6	-99.4	-32.3	0	0	0	105.5	I1383 R1387	I1383-D1385 HydrophobicContact CG2-CB 4Å; D1385-R1387 HydrophobicContact CB-CG 4.38Å; D1385-R1387 IonicContact OD1-NE 2.72Å; D1385-R1387 IonicContact OD1-NH2 2.64Å; D1385-R1387 IonicContact OD2-CZ 3.62Å; D1385-R1387 IonicContact OD2-NE 2.71Å; D1385-R1387 PolarHBondContact OD2-NE 3.05Å; D1385-R1387 IonicContact OD2-NH2 3.45Å; D1385-R1387 PolarHBondContact OD2-NH2 2.93Å
1386	V	25.5	Very low	27.5	Very low	128 Å²	128	138.7 Å²	138.7	78%	0.776	75%	0.745	S	S	*	*			cis	68.7	42.3	17.9	-155.9	0	0	0	0	114.6
1387	R	25.6	Very low	27.1	Very low	195 Å²	195	140.3 Å²	140.3	74%	0.736	74%	0.743	S	S	*	*			trans	-133	100.1	155.7	-66.8	176	-155.2	-147.4	0	108.5	D1385	D1385-R1387 HydrophobicContact CB-CG 4.38Å; D1385-R1387 IonicContact OD1-NE 2.72Å; D1385-R1387 IonicContact OD1-NH2 2.64Å; D1385-R1387 IonicContact OD2-CZ 3.62Å; D1385-R1387 IonicContact OD2-NE 2.71Å; D1385-R1387 PolarHBondContact OD2-NE 3.05Å; D1385-R1387 IonicContact OD2-NH2 3.45Å; D1385-R1387 PolarHBondContact OD2-NH2 2.93Å
1388	I	26.1	Very low	26.9	Very low	140 Å²	140	143.4 Å²	143.4	72%	0.718	74%	0.743	S	S	*	*				52.7	75.8	82.5	-54.2	177.9	0	0	0	110.7	K1390	I1388-K1390 VanDerWaalsContact C-N 3.26Å; I1388-K1390 HydrophobicContact CG2-CB 3.79Å; I1388-K1390 PolarHBondContact O-N 3.46Å
1389	F	24.6	Very low	26.6	Very low	179 Å²	179	144.4 Å²	144.4	79%	0.785	74%	0.74	S	S	*	*			trans	-86.9	69.4	165.8	-144.7	-80.6	0	0	0	110.3	M1391	F1389-M1391 VanDerWaalsContact C-N 3.29Å; F1389-M1391 HydrophobicContact CD1-CG 3.97Å; F1389-M1391 HydrophobicContact CE1-CE 3.86Å; F1389-M1391 HydrophobicContact CE1-CG 3.85Å; F1389-M1391 PolarHBondContact O-N 3.08Å
1390	K	24.4	Very low	26.6	Very low	159 Å²	159	146.4 Å²	146.4	69%	0.691	75%	0.745	S	S	*	*			trans	-78.3	75.4	-176.8	-168.4	170.9	-170.9	167.8	0	110.6	I1388 R1392	I1388-K1390 VanDerWaalsContact C-N 3.26Å; I1388-K1390 HydrophobicContact CG2-CB 3.79Å; I1388-K1390 PolarHBondContact O-N 3.46Å; K1390-R1392 PolarHBondContact O-N 3.02Å
1391	M	27.6	Very low	26.5	Very low	145 Å²	145	143.8 Å²	143.8	71%	0.714	74%	0.737	S	S	*	*			trans	-64.5	85	165.2	-84.7	-161.5	176.7	0	0	110	F1389 F1393	F1389-M1391 VanDerWaalsContact C-N 3.29Å; F1389-M1391 HydrophobicContact CD1-CG 3.97Å; F1389-M1391 HydrophobicContact CE1-CE 3.86Å; F1389-M1391 HydrophobicContact CE1-CG 3.85Å; F1389-M1391 PolarHBondContact O-N 3.08Å; M1391-F1393 VanDerWaalsContact C-N 3.26Å; M1391-F1393 PolarHBondContact O-N 2.99Å
1392	R	23.6	Very low	26.2	Very low	212 Å²	212	144.3 Å²	144.3	80%	0.8	73%	0.734	S	S	*	*			trans	-67.7	91.2	151.5	-87.8	-179.7	161.3	168.5	-7.1	107.2	K1390	K1390-R1392 PolarHBondContact O-N 3.02Å
1393	F	29	Very low	26.4	Very low	181 Å²	181	145 Å²	145	79%	0.794	73%	0.734	S	S	*	*			trans	-90.4	128.2	150	-110	-84.1	0	0	0	109.4	M1391	M1391-F1393 VanDerWaalsContact C-N 3.26Å; M1391-F1393 PolarHBondContact O-N 2.99Å
1394	L	26.3	Very low	26.3	Very low	135 Å²	135	143.5 Å²	143.5	71%	0.707	73%	0.726	S	S	*	*			trans	-50.9	143.8	-167.6	-64.2	148.3	0	0	0	113.9	L1396	L1394-L1396 PolarHBondContact O-N 3.46Å
1395	P	26.2	Very low	26.3	Very low	123 Å²	123	149 Å²	149	80%	0.799	73%	0.726	S	S	*	*			trans	-73.9	115.2	164.6	31.4	-31.1	0	0	0	109.7
1396	L	30.1	Very low	26.3	Very low	150 Å²	150	150.6 Å²	150.6	79%	0.785	73%	0.734	S	S	*	*			trans	-104.8	112.9	160.4	-67.4	175.1	0	0	0	106.1	L1394	L1394-L1396 PolarHBondContact O-N 3.46Å
1397	Q	25.7	Very low	26.6	Very low	141 Å²	141	153.4 Å²	153.4	66%	0.659	74%	0.743	S	S	*	*				71.8	118	82.5	-68.6	-77.8	-48.7	0	0	109.9
1398	F	24.4	Very low	26.9	Very low	179 Å²	179	150.9 Å²	150.9	79%	0.785	74%	0.74	S	S	*	*				60.7	127.4	86	-90.7	-126.4	0	0	0	110.8
1399	V	25.4	Very low	27	Very low	108 Å²	108	150.7 Å²	150.7	66%	0.655	74%	0.741	S	S	*	*			cis	-142.9	157.6	5.5	-163	0	0	0	0	106.3
1400	E	29.6	Very low	27.4	Very low	176 Å²	176	152.4 Å²	152.4	82%	0.822	75%	0.748	S	S	*	*				176.6	142.4	79.2	-79.6	172.6	170.4	0	0	105.7
1401	S	25.3	Very low	27.5	Very low	81 Å²	81	151.5 Å²	151.5	57%	0.566	75%	0.746	S	S	*	*			cis	74.9	109.4	20.9	86.6	0	0	0	0	116.5
1402	L	24.8	Very low	27.7	Very low	155 Å²	155	153.8 Å²	153.8	81%	0.812	76%	0.757	S	S	*	*			trans	71.5	154.4	176.2	-48.5	151.6	0	0	0	111.8
1403	T	28.8	Very low	27.9	Very low	122 Å²	122	151 Å²	151	75%	0.748	75%	0.751	S	S	*	*			cis	-147.3	118.4	22.8	-58.2	0	0	0	0	108
1404	I	27.2	Very low	28	Very low	120 Å²	120	152.9 Å²	152.9	62%	0.615	75%	0.754	S	S	*	*				52.5	126.7	98.6	-64.2	174.6	0	0	0	115.9
1405	R	26.3	Very low	28.1	Very low	216 Å²	216	152 Å²	152	82%	0.815	75%	0.746	S	S	*	*			trans	81.4	114.2	164	-74.8	164	-164.3	152.1	4.6	121.2
1406	N	26.1	Very low	28.1	Very low	118 Å²	118	157.3 Å²	157.3	63%	0.631	75%	0.752	S	S	*	*				60.8	100.6	125.4	-56.4	5.5	0	0	0	120.5
1407	L	32.5	Very low	28.1	Very low	186 Å²	186	157.5 Å²	157.5	97%	0.974	75%	0.747	S	S	*	*				-118.9	135.5	119.6	-80.2	174.1	0	0	0	108.7
1408	Q	30.2	Very low	28.4	Very low	143 Å²	143	161.2 Å²	161.2	67%	0.668	76%	0.755	S	S	*	*			trans	-104.9	159.3	-169.1	-72.3	178.9	-81.8	0	0	113.1
1409	N	28.2	Very low	28.6	Very low	136 Å²	136	158.4 Å²	158.4	73%	0.727	75%	0.752	S	S	*	*			trans	58	97.5	151.9	-59.3	-7.4	0	0	0	118.4
1410	K	32.8	Very low	29.1	Very low	215 Å²	215	159.3 Å²	159.3	94%	0.935	76%	0.76	S	S	*	*				-134.8	140.8	119.1	-109.8	172.6	-175.9	176.5	0	109.8
1411	E	28.2	Very low	29.1	Very low	139 Å²	139	159.4 Å²	159.4	65%	0.65	76%	0.761	S	S	*	*			trans	-89.4	142.7	-163.3	-62.7	175.7	97.1	0	0	113.2	K1413	E1411-K1413 IonicContact OE1-NZ 2.82Å; E1411-K1413 PolarHBondContact OE1-NZ 3.12Å
1412	M	31.4	Very low	29.5	Very low	193 Å²	193	164.1 Å²	164.1	95%	0.951	77%	0.771	S	S	*	*			trans	-137.1	89.1	145	-78.6	-153.9	-65.4	0	0	109.8
1413	K	26.8	Very low	29.8	Very low	155 Å²	155	162.5 Å²	162.5	67%	0.674	76%	0.763	S	S	*	*			trans	-84.9	127.7	154.8	-62.4	162.3	-179.5	139.5	0	107.2	E1411	E1411-K1413 IonicContact OE1-NZ 2.82Å; E1411-K1413 PolarHBondContact OE1-NZ 3.12Å
1414	Y	31.7	Very low	30	Very low	219 Å²	219	164.4 Å²	164.4	86%	0.859	77%	0.768	S	S	*	*			trans	-179.1	135.6	150.4	-82.7	-60.2	0	0	0	108.2
1415	E	28.1	Very low	30.2	Very low	116 Å²	116	165.6 Å²	165.6	54%	0.542	78%	0.775	S	S	.	*			cis	-158.1	124.6	-28.8	-146.4	179.3	172.9	0	0	109	K1417	E1415-K1417 VanDerWaalsContact CD-CE 3.46Å; E1415-K1417 HydrophobicContact CG-CD 4.46Å; E1415-K1417 HydrophobicContact CG-CG 4.41Å; E1415-K1417 PolarHBondContact O-N 2.87Å; E1415-K1417 WeakPolarHBondContact OE1-CE 3.43Å; E1415-K1417 IonicContact OE1-NZ 2.83Å; E1415-K1417 PolarHBondContact OE1-NZ 2.84Å; E1415-K1417 WeakPolarHBondContact OE2-CD 3.37Å; E1415-K1417 WeakPolarHBondContact OE2-CE 3.48Å; E1415-K1417 IonicContact OE2-NZ 2.73Å; E1415-K1417 PolarHBondContact OE2-NZ 3.2Å
1416	Y	26	Very low	30.5	Very low	235 Å²	235	162.4 Å²	162.4	92%	0.922	77%	0.769	S	S	*	*			trans	-95.5	75.3	176.3	-153	-84.1	0	0	0	109.4	R1418	Y1416-R1418 PolarHBondContact O-N 3.47Å
1417	K	31.5	Very low	30.8	Very low	154 Å²	154	165.1 Å²	165.1	67%	0.67	78%	0.778	S	S	*	*			trans	-85.2	108	-165.9	-129.8	170.8	-169.2	145.9	0	112.4	E1415	E1415-K1417 VanDerWaalsContact CD-CE 3.46Å; E1415-K1417 HydrophobicContact CG-CD 4.46Å; E1415-K1417 HydrophobicContact CG-CG 4.41Å; E1415-K1417 PolarHBondContact O-N 2.87Å; E1415-K1417 WeakPolarHBondContact OE1-CE 3.43Å; E1415-K1417 IonicContact OE1-NZ 2.83Å; E1415-K1417 PolarHBondContact OE1-NZ 2.84Å; E1415-K1417 WeakPolarHBondContact OE2-CD 3.37Å; E1415-K1417 WeakPolarHBondContact OE2-CE 3.48Å; E1415-K1417 IonicContact OE2-NZ 2.73Å; E1415-K1417 PolarHBondContact OE2-NZ 3.2Å
1418	R	30.6	Very low	30.8	Very low	220 Å²	220	159.4 Å²	159.4	83%	0.83	76%	0.764	S	S	*	*			trans	-73	142.3	163.6	-75.7	-177.8	169.8	176.1	-4.6	110.2	Y1416	Y1416-R1418 PolarHBondContact O-N 3.47Å
1419	T	29.5	Very low	31	Very low	119 Å²	119	160.3 Å²	160.3	73%	0.73	77%	0.774	S	S	*	*			trans	34.3	148.1	144.2	58.7	0	0	0	0	120.8
1420	P	35.2	Very low	31.2	Very low	127 Å²	127	159.2 Å²	159.2	83%	0.825	77%	0.772	S	S	*	*				-122.1	147	107.7	35.3	-33.9	0	0	0	113
1421	E	29.4	Very low	31	Very low	179 Å²	179	157.3 Å²	157.3	84%	0.836	76%	0.764	S	S	*	*			trans	-66.1	153.5	158.3	-64.6	166	99.2	0	0	110
1422	K	33.5	Very low	31.1	Very low	180 Å²	180	156.3 Å²	156.3	78%	0.783	77%	0.767	S	S	*	*				-167.7	135.8	124.4	-106.4	-176.2	175.1	-171.3	0	113.5
1423	D	32.5	Very low	30.9	Very low	121 Å²	121	155.8 Å²	155.8	65%	0.647	76%	0.76	S	S	*	*			trans	46.5	98.9	141	-47.8	-26.8	0	0	0	119.2
1424	L	33.3	Very low	31.2	Very low	161 Å²	161	156.4 Å²	156.4	84%	0.843	77%	0.766	S	S	*	*				173.3	87.7	119.7	-89.1	158.4	0	0	0	108.6
1425	L	31.3	Very low	31.2	Very low	146 Å²	146	152.4 Å²	152.4	76%	0.764	76%	0.759	S	S	*	*				82.5	129.1	83	-92.9	163.6	0	0	0	115.9
1426	Q	31.4	Very low	31.3	Very low	148 Å²	148	154.7 Å²	154.7	69%	0.692	77%	0.771	S	S	*	*			trans	84.4	108	158.3	-63.8	-175	2.2	0	0	120.8
1427	Q	32.8	Very low	31.7	Very low	176 Å²	176	148.2 Å²	148.2	82%	0.822	76%	0.759	S	S	*	*			trans	74	126.8	132.3	-59.3	166.1	28.3	0	0	118.6
1428	G	32.7	Very low	31.7	Very low	66 Å²	66	146 Å²	146	68%	0.68	76%	0.758	S	S	*	*			cis	164.7	171.8	-7.2	0	0	0	0	0	113.9
1429	N	34.5	Very low	31.8	Very low	162 Å²	162	141.4 Å²	141.4	87%	0.866	75%	0.749	S	S	*	*			trans	67.7	144.5	168.6	-54.8	-13.5	0	0	0	116.4
1430	T	33.3	Very low	31.7	Very low	112 Å²	112	146.3 Å²	146.3	69%	0.687	75%	0.754	S	S	*	*			cis	-158.1	143	-14.6	15.8	0	0	0	0	106.6
1431	F	27.9	Very low	31.4	Very low	175 Å²	175	144.6 Å²	144.6	77%	0.768	75%	0.745	S	S	*	*				37.5	140.1	99.5	-73.3	-70.6	0	0	0	116.3
1432	T	30.8	Very low	31.6	Very low	118 Å²	118	140.8 Å²	140.8	72%	0.724	74%	0.738	S	S	*	*			cis	-152.9	157.9	21.3	-17.8	0	0	0	0	113.5
1433	F	26.6	Very low	31.3	Very low	183 Å²	183	142.4 Å²	142.4	80%	0.803	74%	0.739	S	S	*	*			trans	-8.1	149.5	150.6	-82.9	-114.7	0	0	0	120.5
1434	E	32.2	Very low	31	Very low	168 Å²	168	143.9 Å²	143.9	79%	0.785	74%	0.74	S	S	*	*				-158.6	153.9	109.4	-119.5	-179.2	-138.6	0	0	115.1
1435	N	33.1	Very low	30.7	Very low	134 Å²	134	144.5 Å²	144.5	72%	0.717	74%	0.736	S	S	*	*			trans	60.9	74.3	160.4	-55.4	-38.8	0	0	0	120.8
1436	M	29.2	Very low	30.5	Very low	164 Å²	164	142.7 Å²	142.7	81%	0.808	73%	0.731	S	S	*	*			trans	-70.9	167.6	132.5	-158.7	-152.2	-71.8	0	0	108.7
1437	P	34.6	Very low	30.2	Very low	100 Å²	100	141.8 Å²	141.8	65%	0.649	73%	0.73	S	S	*	*				-156.7	147.1	96.1	39.9	-20.8	0	0	0	117.9
1438	T	32.3	Very low	29.9	Very low	108 Å²	108	139.6 Å²	139.6	66%	0.663	72%	0.723	S	S	*	*			trans	71.3	158	135	55.5	0	0	0	0	121.9
1439	L	31	Very low	29.8	Very low	122 Å²	122	142.5 Å²	142.5	64%	0.639	72%	0.723	S	S	*	*			cis	-145.6	138.7	-4.5	-106.4	144.6	0	0	0	106.6
1440	R	29.1	Very low	29.4	Very low	223 Å²	223	143.3 Å²	143.3	84%	0.842	72%	0.719	S	S	*	*				53.5	149.7	100.9	-80.4	-162.8	-153.5	139.6	-0.4	116.7
1441	S	28.4	Very low	29.2	Very low	90 Å²	90	148.9 Å²	148.9	63%	0.629	73%	0.728	S	S	*	*			cis	-167.4	174.3	0.3	167.1	0	0	0	0	110.1
1442	S	32.8	Very low	29.2	Very low	99 Å²	99	148 Å²	148	69%	0.692	73%	0.729	S	S	*	*			trans	85.8	112.2	156.8	-53.4	0	0	0	0	114.8
1443	R	27.3	Very low	29.4	Very low	214 Å²	214	148 Å²	148	81%	0.808	73%	0.731	S	S	*	*				80.7	138	51.9	-78.6	-169.7	165.7	-172.6	-2.5	113.5
1444	F	26.4	Very low	29.6	Very low	152 Å²	152	142.3 Å²	142.3	67%	0.667	73%	0.725	S	S	*	*			trans	79.3	124.5	143.9	-91.3	-144.6	0	0	0	118.4
1445	K	26.8	Very low	29.5	Very low	175 Å²	175	142 Å²	142	76%	0.761	73%	0.728	S	S	*	*			trans	75.9	149.6	131.8	-76.4	-165.1	177.7	-174.5	0	118.2
1446	T	26.8	Very low	29.5	Very low	107 Å²	107	150.7 Å²	150.7	66%	0.656	75%	0.751	S	S	*	*			cis	-170.7	155.9	-24.4	-133.3	0	0	0	0	110.1
1447	I	27	Very low	29.5	Very low	130 Å²	130	150.1 Å²	150.1	67%	0.667	75%	0.748	S	S	*	*			trans	68.7	128.6	157.5	-81.1	174.1	0	0	0	118.8
1448	L	26.4	Very low	29.2	Very low	130 Å²	130	152.7 Å²	152.7	68%	0.681	75%	0.753	S	S	*	*			trans	28.7	135.1	135.3	-39.2	173.5	0	0	0	118.2
1449	N	29.2	Very low	29	Very low	127 Å²	127	155.2 Å²	155.2	68%	0.679	76%	0.758	S	S	*	*				-158.3	169	57	-86.1	-78.5	0	0	0	114.6
1450	F	26.1	Very low	28.9	Very low	179 Å²	179	157.1 Å²	157.1	79%	0.785	77%	0.765	S	S	*	*			trans	-10.3	150.4	145.8	-59.7	-99.1	0	0	0	116.3
1451	R	30.4	Very low	28.9	Very low	229 Å²	229	153 Å²	153	86%	0.864	76%	0.761	S	S	*	*			cis	-166.3	153.1	45.7	-157.2	172.8	-175.9	151.4	-1.9	112.7
1452	I	28	Very low	28.9	Very low	155 Å²	155	157.2 Å²	157.2	80%	0.795	77%	0.77	S	S	*	*			trans	-74.5	133.1	166	-59.9	166.2	0	0	0	109.1
1453	P	34.8	Very low	28.7	Very low	119 Å²	119	161.4 Å²	161.4	77%	0.773	78%	0.775	S	S	*	*				-119.6	155.4	116.8	35.3	-32	0	0	0	110.1
1454	G	30.3	Very low	28.8	Very low	64 Å²	64	157.3 Å²	157.3	66%	0.66	77%	0.773	S	S	*	*			cis	122.5	98.2	12.6	0	0	0	0	0	109.2
1455	N	29.3	Very low	29	Very low	160 Å²	160	157.8 Å²	157.8	86%	0.856	78%	0.781	S	S	*	*			trans	1.8	116.6	-176.9	-64.3	5.5	0	0	0	119.1
1456	R	32.7	Very low	29.2	Very low	318 Å²	318	156.2 Å²	156.2	100%	1.2	78%	0.783	S	S	*	*				-137	0	115.7	-84.8	-163	175.1	-172.1	-2.7	109.4

Retrieved 1,456 of 1,456 residues in 701 ms (Link to these results)

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