A0A087Y7Z8_POEFO Loading...

ST18 C2H2C-type zinc finger transcription factor

AlphaFold DB , UniProt , Accession A0A087Y7Z8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,045 aa.

						>A0A087Y7Z8_POEFO|A0A087Y7Z8
MDTEGEEQTFKTCNSSTGKPLNWICHHLSAPYGSAARKRSAQDGVQGAPVNKRKSLLMKPRHYSPSDACEEESEDLAPPQDKEELRNIDTPAGLPLDPAESNLHSLKSFNNTRKTCMYKHYKSLLMRIKTCFSLNIIIREVRENLKPLRDLLKITKEIQFLLCEGQKQHKFTMQRSNACSPVVSDGNFKAVNGAADKSSCLDVASNSVLLRWPEVASNGSPRCELDTSEHLMAEEDEEFPNNEEEDQSQDRMSGTSSPQSPYGDMREGRASIFQAEALRLDGWALGLHDRGLDMSRGRVNLSLLEQAIALQTEQRQALHHAYREMDRFLLEQMTSERRHHRMMDMESRLNYHGGKDSPRTDKKDIKCPTPGCDGTGHVTGLYPHHRSLSGCPHKVRVPPEIYAVLAMHENVLKCPTPGCTGRGHVNSNRSTHRSLSGCPIAAAVKVSKPQDESLKCRQTPDRSPRAISLIKKFEMNQLNYRLSHPVAALQTSLTKEMDKYSRIRFDYASFDAQVFGKQPLLGTNQDQEMLQYPDSPQQYSGILGASGGCVPISGQHSPPSQFKKEDSLQATAATAAILNLSTRYRKSMETISGQALATSTKDMLIEVDENGTLDLSMKKCKENGKARAKTPSDEQLPPPESALAKGGSLLIGPAFYQPLCDRETWENSIPVNFSKAHVLQDKEEDYDQVSLEDQHYPGDGSMLSPKAKLLLRDSKKELLSCPTPGCDGSGHVTGNYASHRSVSGCPLADKTLKSLMAANSQELKCPTPGCDGSGHVTGNYASHRSLSGCPRARKGGLKLTPNKDDKDEQELKCPVIGCDGQGHISGKYTSHRSAGSCPLAAKRQKESSINGLPFAWKANKQELPHCPLPGCNGLGHANNVFATHRSLSGCPLNAQSIKKKHSEEEMMTIKLKTSSGVENKEDIHHLDHEIKELNNSNMKIEEDMMHLQTQQISSMECNLKTIEEENKMIEQHNNGLLKELARLSQALINSLTDIQLPQMGPISEHNFEAYVNTLTDMYNNSEHEYSPECKALLDNIKQAIKGIHV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.6	Very low	32.6	Very low	215 Å²	215	150.7 Å²	150.7	100%	1.059	77%	0.773	S	S	*	*				0	78.7	0	-64.3	174.2	175.8	0	0	106.1
2	D	32.1	Very low	32.4	Very low	148 Å²	148	148.1 Å²	148.1	79%	0.791	77%	0.769	S	S	*	*				58.3	129.8	51.6	-13.4	-43.6	0	0	0	109.3
3	T	35.8	Very low	32	Very low	113 Å²	113	145.8 Å²	145.8	69%	0.693	77%	0.772	S	S	*	*			cis	-135.1	172.2	19.3	52.1	0	0	0	0	112
4	E	36.5	Very low	31.7	Very low	183 Å²	183	145.7 Å²	145.7	86%	0.855	77%	0.772	S	S	*	*				34.1	137	87.8	-31.1	177.6	124.8	0	0	115.2
5	G	34.4	Very low	31.5	Very low	67 Å²	67	142.3 Å²	142.3	69%	0.691	77%	0.765	S	S	*	*			cis	176.9	-168.4	0.5	0	0	0	0	0	111.9
6	E	33.3	Very low	31.3	Very low	197 Å²	197	140.1 Å²	140.1	92%	0.921	76%	0.764	S	S	*	*			trans	62.7	168.9	162.2	-67.1	-178.1	169.4	0	0	118.9
7	E	34.4	Very low	31.2	Very low	150 Å²	150	140.1 Å²	140.1	70%	0.701	77%	0.769	S	S	*	*				-158.2	-178.5	-51.4	-150.6	-158.3	-163.7	0	0	108.9
8	Q	32.5	Very low	31	Very low	155 Å²	155	136.3 Å²	136.3	72%	0.724	77%	0.768	S	S	*	*			trans	71.7	156.7	159	-69.1	168.2	40.3	0	0	120.3
9	T	31	Very low	30.9	Very low	107 Å²	107	140.1 Å²	140.1	66%	0.656	78%	0.775	S	S	*	*				-169.7	177.5	-58.1	32.2	0	0	0	0	110.3
10	F	27.5	Very low	31.8	Very low	159 Å²	159	138.5 Å²	138.5	70%	0.697	77%	0.771	S	S	*	*			trans	110.7	106	163.5	-76.2	-112.2	0	0	0	115.3
11	K	31.6	Very low	31.5	Very low	164 Å²	164	139.1 Å²	139.1	71%	0.713	77%	0.772	S	S	*	*				72.3	137.2	84.3	-71.8	-171.2	-157.2	172.5	0	112.8
12	T	30.2	Very low	31.4	Very low	119 Å²	119	135.6 Å²	135.6	73%	0.73	76%	0.758	S	S	*	*			cis	-161.7	162	-1.7	11.1	0	0	0	0	107.6
13	C	26.5	Very low	31.1	Very low	118 Å²	118	138.6 Å²	138.6	80%	0.797	76%	0.758	S	S	*	*				-179	178.7	76.6	-130.4	0	0	0	0	114.2
14	N	28	Very low	30.7	Very low	145 Å²	145	140 Å²	140	78%	0.775	76%	0.76	S	S	*	*			trans	-129.8	165.5	-162.4	-62.7	6.8	0	0	0	111.6
15	S	28.6	Very low	30.2	Very low	95 Å²	95	134.3 Å²	134.3	66%	0.664	74%	0.74	S	S	*	*			cis	-179.1	169.2	-19.9	55.8	0	0	0	0	110.5
16	S	29.5	Very low	29.8	Very low	107 Å²	107	138.4 Å²	138.4	75%	0.748	74%	0.74	S	S	*	*			trans	69.7	164.3	162.7	73.3	0	0	0	0	117.5
17	T	28.8	Very low	29.5	Very low	140 Å²	140	135.6 Å²	135.6	86%	0.859	73%	0.727	S	S	*	*			cis	-154.7	160.4	9.2	-31.3	0	0	0	0	111.2
18	G	26.7	Very low	29.1	Very low	72 Å²	72	135.4 Å²	135.4	74%	0.742	73%	0.73	S	S	*	*			trans	153.9	135.8	158.4	0	0	0	0	0	119
19	K	29.8	Very low	28.8	Very low	208 Å²	208	133.1 Å²	133.1	90%	0.904	73%	0.731	S	S	*	*			trans	-150.9	-172.9	164	-58.3	-171.5	179.4	-178.1	0	106.9
20	P	48.3	Very low	28.8	Very low	107 Å²	107	132.1 Å²	132.1	70%	0.695	73%	0.734	S	S	*	*			cis	-136.3	178.4	-10.1	37.4	-17.5	0	0	0	115.6
21	L	26.7	Very low	29.6	Very low	152 Å²	152	129.6 Å²	129.6	80%	0.796	73%	0.734	S	S	*	*			trans	170.7	136.9	135.1	-108.9	61.2	0	0	0	107.1
22	N	27.6	Very low	29.3	Very low	142 Å²	142	133 Å²	133	76%	0.759	74%	0.743	S	S	*	*			cis	74.2	139.6	42.6	-76.4	7.2	0	0	0	113.8
23	W	25.3	Very low	29.1	Very low	210 Å²	210	130.5 Å²	130.5	80%	0.795	74%	0.741	S	S	*	*			cis	-172	179.5	2.3	155.3	-103.9	0	0	0	110.3
24	I	26.9	Very low	29.1	Very low	142 Å²	142	131 Å²	131	73%	0.728	75%	0.746	S	S	*	*			trans	89.5	143.4	174.1	-50.8	-175.1	0	0	0	117
25	C	26.4	Very low	29.1	Very low	64 Å²	64	128.9 Å²	128.9	43%	0.432	75%	0.749	S	S	.	*			cis	160.7	135.5	-50	-86.7	0	0	0	0	112.2
26	H	26.8	Very low	29	Very low	153 Å²	153	128.6 Å²	128.6	71%	0.708	75%	0.752	S	S	*	*			trans	62.1	154.9	136.1	-76	-102.7	0	0	0	120.9
27	H	26.5	Very low	29	Very low	139 Å²	139	133.9 Å²	133.9	64%	0.644	76%	0.756	S	S	*	*			cis	-172.5	167.5	-14.1	-132.1	-148.6	0	0	0	110.8
28	L	26.6	Very low	29.1	Very low	146 Å²	146	133.5 Å²	133.5	76%	0.764	74%	0.742	S	S	*	*			trans	67.2	161.7	153.2	-62.4	160.7	0	0	0	117.8
29	S	26.5	Very low	29.2	Very low	106 Å²	106	140.1 Å²	140.1	74%	0.741	75%	0.745	S	S	*	*			cis	-160.7	170.6	-7.4	-123.6	0	0	0	0	113.1
30	A	31	Very low	29.1	Very low	87 Å²	87	135.2 Å²	135.2	72%	0.719	74%	0.736	S	S	*	*			trans	-90.4	-172.9	161.9	0	0	0	0	0	110.8
31	P	44.2	Very low	28.1	Very low	106 Å²	106	134.4 Å²	134.4	69%	0.688	74%	0.738	S	S	*	*			cis	-155.1	-170.2	37.3	33.5	-4.7	0	0	0	118.9
32	Y	25.4	Very low	28.2	Very low	235 Å²	235	135.5 Å²	135.5	92%	0.922	74%	0.74	S	S	*	*			trans	59.8	162.6	166.9	-67.7	-79.7	0	0	0	119.3
33	G	25.2	Very low	28.1	Very low	66 Å²	66	135.5 Å²	135.5	68%	0.68	74%	0.74	S	S	*	*			cis	169.6	140.1	-13.9	0	0	0	0	0	115.8
34	S	26.9	Very low	28.3	Very low	130 Å²	130	128.4 Å²	128.4	91%	0.909	73%	0.732	S	S	*	*			trans	65.1	125.9	156	-71.8	0	0	0	0	126
35	A	27.5	Very low	28.3	Very low	100 Å²	100	128 Å²	128	83%	0.826	74%	0.735	S	S	*	*				94.1	120.5	126.4	0	0	0	0	0	125.9
36	A	27.3	Very low	28.5	Very low	88 Å²	88	134.1 Å²	134.1	73%	0.727	76%	0.758	S	S	*	*				89.9	127.9	124	0	0	0	0	0	125.9
37	R	29.8	Very low	28.7	Very low	219 Å²	219	130.6 Å²	130.6	83%	0.826	76%	0.763	S	S	*	*			trans	71.2	159.6	143.1	-72.4	-179.1	166.1	-171.3	0.2	118.4
38	K	30.2	Very low	28.8	Very low	131 Å²	131	128.6 Å²	128.6	57%	0.57	77%	0.771	S	S	*	*			cis	-167.1	154.7	-9.9	-124.8	-176.5	175.7	-171.1	0	111.8
39	R	29.6	Very low	29.6	Very low	212 Å²	212	127 Å²	127	80%	0.8	77%	0.769	S	S	*	*			trans	66.6	165	154.7	-66.6	176.1	-64.7	-160	3.3	116.6
40	S	27	Very low	29.6	Very low	104 Å²	104	128.1 Å²	128.1	73%	0.727	77%	0.771	S	S	*	*			cis	-162.4	135.5	-12.3	30.9	0	0	0	0	106.9
41	A	27	Very low	29.6	Very low	90 Å²	90	130.2 Å²	130.2	74%	0.744	77%	0.77	S	S	*	*				84	142	67.3	0	0	0	0	0	114.8
42	Q	28.1	Very low	29	Very low	176 Å²	176	133.9 Å²	133.9	82%	0.822	78%	0.775	S	S	*	*			trans	69.8	151.2	-175.9	-54.3	-167.5	-103.1	0	0	115.8
43	D	26.7	Very low	29.7	Very low	142 Å²	142	134 Å²	134	76%	0.759	77%	0.774	S	S	*	*			cis	-165.1	165.5	-27.2	-89.3	-32.8	0	0	0	106.3
44	G	28	Very low	30.2	Very low	61 Å²	61	140.7 Å²	140.7	63%	0.629	78%	0.784	S	S	*	*			cis	174.7	-171.4	-1.2	0	0	0	0	0	111.7
45	V	28.3	Very low	30.7	Very low	132 Å²	132	139.7 Å²	139.7	80%	0.8	78%	0.777	S	S	*	*			trans	22.3	126.5	145	-177.3	0	0	0	0	118.2
46	Q	30.9	Very low	31	Very low	193 Å²	193	143.1 Å²	143.1	90%	0.902	78%	0.781	S	S	*	*			cis	-162.5	161.5	29.8	-142.6	160.1	51.7	0	0	111.6
47	G	29	Very low	31.4	Very low	80 Å²	80	146.7 Å²	146.7	83%	0.825	79%	0.787	S	S	*	*			trans	148.3	125.8	165.2	0	0	0	0	0	116
48	A	29.8	Very low	31.4	Very low	97 Å²	97	144.2 Å²	144.2	80%	0.802	79%	0.787	S	S	*	*			trans	-114	178.2	176.8	0	0	0	0	0	109.4
49	P	43.6	Very low	31.5	Very low	111 Å²	111	146.6 Å²	146.6	72%	0.721	80%	0.797	S	S	*	*			cis	-145.6	178.1	15.7	45.5	-25.7	0	0	0	118.2
50	V	27.1	Very low	31.7	Very low	130 Å²	130	142.7 Å²	142.7	79%	0.788	80%	0.799	S	S	*	*			trans	44	133	135	171.9	0	0	0	0	119.5
51	N	30.1	Very low	32	Very low	131 Å²	131	149.3 Å²	149.3	70%	0.701	81%	0.808	S	S	*	*			cis	-147.6	-170.2	17.8	-146.7	-19.9	0	0	0	114.2
52	K	31.8	Very low	32.1	Very low	184 Å²	184	154.2 Å²	154.2	80%	0.8	82%	0.815	S	S	*	*			trans	-84.9	141.4	-169.6	-60.9	141.7	-171.8	165.6	0	114.7
53	R	39	Very low	32	Very low	236 Å²	236	156.8 Å²	156.8	89%	0.891	82%	0.819	S	S	*	*			trans	-20.5	142.6	144.6	-49	169.5	-176.6	170.8	-0.1	114.7
54	K	36.8	Very low	32	Very low	208 Å²	208	154.2 Å²	154.2	90%	0.904	81%	0.812	S	S	*	*				-168.4	146.3	110.7	-104.8	166.9	-175.5	-178.7	0	113.6
55	S	36.4	Very low	32.2	Very low	109 Å²	109	157.4 Å²	157.4	76%	0.762	82%	0.822	S	S	*	*			trans	-77.9	151.5	169.1	45.9	0	0	0	0	111.8
56	L	33.8	Very low	32.1	Very low	171 Å²	171	155.8 Å²	155.8	90%	0.895	82%	0.816	S	S	*	*			trans	-138	147.1	152.8	-81.7	-176.6	0	0	0	111.2
57	L	36	Very low	32	Very low	164 Å²	164	154 Å²	154	86%	0.859	81%	0.813	S	S	*	*			trans	-103.5	138.3	176.8	-176.8	90.1	0	0	0	107.8
58	M	31	Very low	31.9	Very low	167 Å²	167	154.1 Å²	154.1	82%	0.823	81%	0.806	S	S	*	*			trans	-137.1	165.7	172.8	-89.1	-58.4	172	0	0	114.4
59	K	31	Very low	31.6	Very low	181 Å²	181	155.2 Å²	155.2	79%	0.787	81%	0.807	S	S	*	*			trans	-96.4	159.4	-160.9	-62.3	169.8	-178.5	174	0	112.6
60	P	35.1	Very low	30.8	Very low	129 Å²	129	157.5 Å²	157.5	84%	0.838	81%	0.808	S	S	*	*			trans	-64.1	157.1	167.1	29.6	-36.5	0	0	0	112.1
61	R	31.9	Very low	30.8	Very low	244 Å²	244	159.1 Å²	159.1	92%	0.921	81%	0.807	S	S	*	*			trans	-129	146.9	169.4	-78.1	-175.1	168.8	-174.1	-4	109.7
62	H	30.6	Very low	30.7	Very low	193 Å²	193	160.8 Å²	160.8	89%	0.894	81%	0.81	S	S	*	*			trans	-84.5	148	164.3	-60.9	-104.8	0	0	0	109.6
63	Y	24.9	Very low	30.3	Very low	230 Å²	230	155.5 Å²	155.5	90%	0.902	80%	0.797	S	S	*	*			trans	-156	158.4	145.3	-154.1	-111.2	0	0	0	110.9
64	S	26.2	Very low	29.9	Very low	87 Å²	87	153.1 Å²	153.1	61%	0.608	80%	0.795	S	S	*	*			trans	-112.4	150.3	178.8	-56.4	0	0	0	0	110.3
65	P	33.8	Very low	29.4	Very low	128 Å²	128	150 Å²	150	83%	0.831	79%	0.789	S	S	*	*			trans	-85.2	134.3	173	33.6	-31.5	0	0	0	111.6
66	S	25.3	Very low	29.1	Very low	98 Å²	98	152.7 Å²	152.7	69%	0.685	79%	0.794	S	S	*	*			trans	-149.4	131.3	163.9	-77.2	0	0	0	0	108
67	D	29.6	Very low	28.8	Very low	155 Å²	155	148.7 Å²	148.7	83%	0.829	79%	0.785	S	S	*	*			trans	58.2	141.3	144.2	-47.1	-24.9	0	0	0	119.6
68	A	26.3	Very low	29.3	Very low	83 Å²	83	146.2 Å²	146.2	69%	0.686	78%	0.779	S	S	*	*			cis	-165.1	-163.8	-15.1	0	0	0	0	0	107.6
69	C	24.3	Very low	29.5	Very low	121 Å²	121	144.3 Å²	144.3	82%	0.818	78%	0.779	S	S	*	*			trans	78.4	140.6	168	-60	0	0	0	0	118
70	E	25.3	Very low	29.6	Very low	158 Å²	158	144.2 Å²	144.2	74%	0.738	78%	0.781	S	S	*	*			cis	-176.4	172.4	-25.4	-106.9	-87.3	-161.5	0	0	105.5
71	E	27.7	Very low	29.2	Very low	164 Å²	164	144.5 Å²	144.5	77%	0.766	78%	0.776	S	S	*	*			trans	62.3	138.5	163.7	-71.5	166.9	-177.9	0	0	118.3
72	E	27.9	Very low	29.1	Very low	166 Å²	166	139.6 Å²	139.6	78%	0.776	76%	0.761	S	S	*	*			cis	-159.1	-167.6	-15.7	-135	-170.6	160.7	0	0	111
73	S	24.6	Very low	28.9	Very low	74 Å²	74	138 Å²	138	52%	0.517	75%	0.754	S	S	.	*			trans	-37.8	164.5	162.2	9.4	0	0	0	0	116.4
74	E	29.1	Very low	29	Very low	185 Å²	185	134.1 Å²	134.1	86%	0.864	74%	0.744	S	S	*	*			cis	-152.8	174.1	7.8	-135.5	149.4	-142.4	0	0	114.4
75	D	26.4	Very low	29.1	Very low	143 Å²	143	136 Å²	136	77%	0.765	75%	0.747	S	S	*	*			trans	-48.9	146.2	168.9	-169.3	12.5	0	0	0	115.1
76	L	29.5	Very low	28.8	Very low	166 Å²	166	139.4 Å²	139.4	87%	0.869	74%	0.743	S	S	*	*			trans	169	136.6	144.1	-96.6	170.8	0	0	0	112.4
77	A	27.9	Very low	29	Very low	86 Å²	86	141.2 Å²	141.2	71%	0.711	75%	0.745	S	S	*	*			trans	-155.7	169.4	169.1	0	0	0	0	0	110.4
78	P	46.8	Very low	29	Very low	113 Å²	113	140.6 Å²	140.6	73%	0.734	74%	0.74	S	S	*	*			cis	-111.9	-166.2	-39.7	36.6	-21.4	0	0	0	109.9
79	P	35.8	Very low	29	Very low	126 Å²	126	143.8 Å²	143.8	82%	0.818	75%	0.746	S	S	*	*				-145.3	170.6	92.9	37.6	-21.2	0	0	0	115.2
80	Q	33.1	Very low	29.3	Very low	180 Å²	180	144.3 Å²	144.3	84%	0.841	75%	0.746	S	S	*	*			trans	-84.4	154.1	169.9	-55.3	168.2	-55.9	0	0	110.5
81	D	26.3	Very low	30.1	Very low	134 Å²	134	142.5 Å²	142.5	72%	0.717	75%	0.747	S	S	*	*			trans	-170.4	154.6	136.2	-117.3	-31	0	0	0	117.3
82	K	30	Very low	30.2	Very low	142 Å²	142	139.4 Å²	139.4	62%	0.617	75%	0.75	S	S	*	*			trans	69.8	112.6	145.2	-70.7	172.4	176.8	60.5	0	125.3
83	E	26.3	Very low	30.1	Very low	160 Å²	160	135.1 Å²	135.1	75%	0.748	75%	0.75	S	S	*	*				75.6	118.3	115.2	-66.4	172.2	138	0	0	124.4
84	E	26.5	Very low	30.2	Very low	148 Å²	148	139.7 Å²	139.7	69%	0.692	77%	0.768	S	S	*	*				49.8	109.8	129.9	-65.4	-138.5	122.9	0	0	124.6
85	L	28.4	Very low	31.2	Very low	127 Å²	127	135.8 Å²	135.8	67%	0.665	76%	0.758	S	S	*	*				44.6	113.2	113.7	-73.1	166	0	0	0	121.2
86	R	28.5	Very low	31.3	Very low	199 Å²	199	136.9 Å²	136.9	75%	0.751	76%	0.763	S	S	*	*				-179.5	129.1	100.8	-102.2	166.4	-87	-148.8	-10.8	116.4
87	N	29.4	Very low	31.4	Very low	135 Å²	135	136.3 Å²	136.3	72%	0.722	76%	0.761	S	S	*	*			trans	58.9	163.9	136.8	-51.6	-4.5	0	0	0	118.3
88	I	28.5	Very low	32.2	Very low	143 Å²	143	137.6 Å²	137.6	73%	0.733	76%	0.763	S	S	*	*			cis	-145.5	155.4	31	-80.7	178.7	0	0	0	112.6
89	D	26.4	Very low	31.4	Very low	150 Å²	150	136.7 Å²	136.7	80%	0.802	76%	0.764	S	S	*	*			trans	79.5	139.8	158.5	-76.8	-18.6	0	0	0	124.8
90	T	31.9	Very low	31.6	Very low	132 Å²	132	140.2 Å²	140.2	81%	0.81	77%	0.77	S	S	*	*			trans	-160.4	127.6	167.2	-67.4	0	0	0	0	108.1
91	P	42.1	Very low	31.6	Very low	119 Å²	119	136.3 Å²	136.3	77%	0.773	76%	0.762	S	S	*	*			trans	-144.4	166.5	135.5	37.1	-23.7	0	0	0	112.8
92	A	28.2	Very low	32.2	Very low	99 Å²	99	136.1 Å²	136.1	82%	0.818	76%	0.762	S	S	*	*			cis	-170.5	145.4	-29.3	0	0	0	0	0	107
93	G	26.4	Very low	32.5	Very low	76 Å²	76	135.2 Å²	135.2	78%	0.784	76%	0.763	S	S	*	*			trans	169.3	118.1	176.1	0	0	0	0	0	115.3
94	L	26.5	Very low	33.1	Very low	170 Å²	170	135.3 Å²	135.3	89%	0.89	76%	0.763	S	S	*	*			trans	-129.4	170.6	174.8	-69.7	175.1	0	0	0	108.2
95	P	50.2	Low	33.5	Very low	103 Å²	103	132.2 Å²	132.2	67%	0.669	76%	0.758	S	S	*	*			cis	-133	-172.3	-11.9	23	1.7	0	0	0	114.1
96	L	28.1	Very low	34.1	Very low	166 Å²	166	131.9 Å²	131.9	87%	0.869	76%	0.756	S	S	*	*			trans	122.4	136.4	144.9	-60.2	178.5	0	0	0	117.8
97	D	32.5	Very low	34.7	Very low	154 Å²	154	128.7 Å²	128.7	82%	0.824	75%	0.747	S	S	*	*			trans	-96.2	-178.1	-170.5	-84.5	-68.1	0	0	0	114
98	P	45	Very low	35.1	Very low	114 Å²	114	125.8 Å²	125.8	74%	0.74	74%	0.738	S	S	*	*			cis	-131.3	-179.1	-18.3	24.8	-2.6	0	0	0	113.6
99	A	30.2	Very low	35.6	Very low	93 Å²	93	126.1 Å²	126.1	77%	0.769	73%	0.734	S	S	*	*			trans	-147.1	112.8	158.5	0	0	0	0	0	113.4
100	E	39.3	Very low	36.2	Very low	201 Å²	201	122.6 Å²	122.6	94%	0.939	72%	0.715	S	S	*	*			trans	-79.5	118.3	176.6	-63.1	-171.9	117.2	0	0	112
101	S	34	Very low	36.8	Very low	97 Å²	97	121.4 Å²	121.4	68%	0.678	70%	0.704	S	S	*	*			trans	-156	-35.2	172.8	54.5	0	0	0	0	115.7
102	N	37.6	Very low	37.1	Very low	131 Å²	131	119.5 Å²	119.5	70%	0.701	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-5.9	-167.5	-90.1	-59.8	0	0	0	116.9	H104	N102-H104 VanDerWaalsContact C-N 3.35Å; N102-H104 PolarHBondContact O-N 2.58Å
103	L	36.5	Very low	37.9	Very low	123 Å²	123	123.3 Å²	123.3	64%	0.644	68%	0.683	S	S	*	*	H	α-helix	trans	-73.7	-21	-171.1	-158.6	68.9	0	0	0	114.4	K107	L103-K107 WeakPolarHBondContact O-CG 3.24Å
104	H	39.1	Very low	38.8	Very low	161 Å²	161	126.5 Å²	126.5	75%	0.745	68%	0.676	S	S	*	*	H	α-helix	trans	-79.1	-41.7	-177	-113.9	-104	0	0	0	113.6	N102 K107 S108	N102-H104 VanDerWaalsContact C-N 3.35Å; N102-H104 PolarHBondContact O-N 2.58Å; H104-K107 PolarHBondContact O-N 2.98Å; H104-S108 PolarHBondContact O-N 2.76Å
105	S	34.3	Very low	40	Very low	84 Å²	84	121.7 Å²	121.7	59%	0.587	65%	0.653	S	S	*	*	H	α-helix	trans	-63.6	-48.3	-178.6	-173.7	0	0	0	0	111.5	K107 S108 F109	S105-K107 VanDerWaalsContact C-N 3.31Å; S105-K107 PolarHBondContact O-N 3.04Å; S105-S108 WeakPolarHBondContact O-CB 3.42Å; S105-S108 PolarHBondContact O-N 3.12Å; S105-S108 VanDerWaalsContact O-N 3.12Å; S105-F109 PolarHBondContact O-N 3.04Å
106	L	41	Very low	39.7	Very low	119 Å²	119	120.7 Å²	120.7	62%	0.623	65%	0.648	S	S	*	*	H	α-helix	trans	-66.8	-30.7	-179.4	-157.2	72.3	0	0	0	112.7	N110	L106-N110 WeakPolarHBondContact O-CB 3.44Å; L106-N110 PolarHBondContact O-N 3.38Å; L106-N110 PolarHBondContact O-ND2 2.91Å
107	K	41.1	Very low	40.5	Very low	132 Å²	132	118.9 Å²	118.9	57%	0.574	64%	0.637	S	S	*	*	H	α-helix	trans	-66.8	-45.4	170.2	-81.6	178.2	177.8	174.5	0	111.5	L103 H104 S105 N110 N111	L103-K107 WeakPolarHBondContact O-CG 3.24Å; H104-K107 PolarHBondContact O-N 2.98Å; S105-K107 VanDerWaalsContact C-N 3.31Å; S105-K107 PolarHBondContact O-N 3.04Å; K107-N110 PolarHBondContact O-N 3.11Å; K107-N111 WeakPolarHBondContact O-CB 3.3Å; K107-N111 PolarHBondContact O-N 2.81Å
108	S	38.5	Very low	41.1	Very low	74 Å²	74	118.8 Å²	118.8	52%	0.517	63%	0.626	S	S	.	*	H	α-helix	trans	-59.1	-50.6	178.4	-170.7	0	0	0	0	111.9	H104 S105 N110 N111 T112	H104-S108 PolarHBondContact O-N 2.76Å; S105-S108 WeakPolarHBondContact O-CB 3.42Å; S105-S108 PolarHBondContact O-N 3.12Å; S105-S108 VanDerWaalsContact O-N 3.12Å; S108-N110 VanDerWaalsContact C-N 3.34Å; S108-N110 PolarHBondContact O-N 3.06Å; S108-N111 PolarHBondContact O-N 3Å; S108-T112 PolarHBondContact O-N 3.41Å; S108-T112 PolarHBondContact O-OG1 2.77Å
109	F	38.7	Very low	41.4	Very low	150 Å²	150	120.7 Å²	120.7	66%	0.658	62%	0.623	S	S	*	*	H	α-helix	trans	-63.8	-36.1	-178.8	-138.4	-86.1	0	0	0	113	S105 T112 R113	S105-F109 PolarHBondContact O-N 3.04Å; F109-T112 PolarHBondContact O-OG1 2.73Å; F109-T112 VanDerWaalsContact O-OG1 3.07Å; F109-R113 WeakPolarHBondContact O-CB 3.49Å; F109-R113 PolarHBondContact O-N 3.37Å; F109-R113 VanDerWaalsContact O-N 3.07Å
110	N	39.5	Very low	42.2	Very low	77 Å²	77	122.2 Å²	122.2	41%	0.412	61%	0.613	S	S	.	*	H	α-helix	trans	-70.3	-31.4	172.5	-84.3	-70.2	0	0	0	112.6	L106 K107 S108 K114	L106-N110 WeakPolarHBondContact O-CB 3.44Å; L106-N110 PolarHBondContact O-N 3.38Å; L106-N110 PolarHBondContact O-ND2 2.91Å; K107-N110 PolarHBondContact O-N 3.11Å; S108-N110 VanDerWaalsContact C-N 3.34Å; S108-N110 PolarHBondContact O-N 3.06Å; N110-K114 VanDerWaalsContact O-CB 3.24Å; N110-K114 WeakPolarHBondContact O-CB 3.41Å; N110-K114 WeakPolarHBondContact O-CG 3.45Å; N110-K114 PolarHBondContact O-N 3.34Å
111	N	43.2	Very low	42.5	Very low	106 Å²	106	119.7 Å²	119.7	57%	0.567	60%	0.596	S	S	*	*	H	α-helix	trans	-77.6	-36.6	179.8	-145.9	12.4	0	0	0	112	K107 S108 T115	K107-N111 WeakPolarHBondContact O-CB 3.3Å; K107-N111 PolarHBondContact O-N 2.81Å; S108-N111 PolarHBondContact O-N 3Å; N111-T115 WeakPolarHBondContact O-CB 3.21Å; N111-T115 WeakPolarHBondContact O-CG2 3.41Å; N111-T115 PolarHBondContact O-N 2.88Å; N111-T115 PolarHBondContact O-OG1 3.46Å
112	T	48.9	Very low	43.3	Very low	79 Å²	79	121 Å²	121	49%	0.485	59%	0.59	S	S	.	*	H	α-helix	trans	-66.6	-42.6	170.2	52.4	0	0	0	0	111.6	S108 F109 T115 C116	S108-T112 PolarHBondContact O-N 3.41Å; S108-T112 PolarHBondContact O-OG1 2.77Å; F109-T112 PolarHBondContact O-OG1 2.73Å; F109-T112 VanDerWaalsContact O-OG1 3.07Å; T112-T115 WeakPolarHBondContact CA-OG1 3.39Å; T112-T115 PolarHBondContact O-N 3.25Å; T112-T115 PolarHBondContact O-OG1 2.99Å; T112-C116 VanDerWaalsContact O-CB 3.26Å; T112-C116 WeakPolarHBondContact O-CB 3.47Å; T112-C116 PolarHBondContact O-N 3.4Å
113	R	45.7	Very low	43.9	Very low	179 Å²	179	117.6 Å²	117.6	68%	0.675	58%	0.576	S	S	*	*	H	α-helix	trans	-63.8	-43	174.7	-162.9	171.5	-174.5	172.9	1.6	112	F109 C116 M117	F109-R113 WeakPolarHBondContact O-CB 3.49Å; F109-R113 PolarHBondContact O-N 3.37Å; F109-R113 VanDerWaalsContact O-N 3.07Å; R113-C116 PolarHBondContact O-N 3.43Å; R113-M117 WeakPolarHBondContact O-CB 3.35Å; R113-M117 VanDerWaalsContact O-CG 3.28Å; R113-M117 WeakPolarHBondContact O-CG 3.26Å; R113-M117 PolarHBondContact O-N 3.46Å
114	K	45.8	Very low	44.7	Very low	143 Å²	143	115.6 Å²	115.6	62%	0.622	57%	0.565	S	S	*	*	H	α-helix	trans	-65.1	-42.4	175.2	-77.2	174.6	-179.3	-176.1	0	112.9	N110 M117 Y118	N110-K114 VanDerWaalsContact O-CB 3.24Å; N110-K114 WeakPolarHBondContact O-CB 3.41Å; N110-K114 WeakPolarHBondContact O-CG 3.45Å; N110-K114 PolarHBondContact O-N 3.34Å; K114-M117 PolarHBondContact O-N 2.99Å; K114-Y118 VanDerWaalsContact O-CB 3.23Å; K114-Y118 WeakPolarHBondContact O-CB 3.44Å; K114-Y118 PolarHBondContact O-N 3.33Å
115	T	52	Low	45.5	Very low	69 Å²	69	110.9 Å²	110.9	42%	0.423	55%	0.546	S	S	.	.	H	α-helix	trans	-71.7	-31.9	177.4	50.9	0	0	0	0	112.8	N111 T112 K119	N111-T115 WeakPolarHBondContact O-CB 3.21Å; N111-T115 WeakPolarHBondContact O-CG2 3.41Å; N111-T115 PolarHBondContact O-N 2.88Å; N111-T115 PolarHBondContact O-OG1 3.46Å; T112-T115 WeakPolarHBondContact CA-OG1 3.39Å; T112-T115 PolarHBondContact O-N 3.25Å; T112-T115 PolarHBondContact O-OG1 2.99Å; T115-K119 WeakPolarHBondContact O-CB 3.38Å; T115-K119 VanDerWaalsContact O-CG 3.26Å; T115-K119 WeakPolarHBondContact O-CG 3.24Å; T115-K119 PolarHBondContact O-N 2.87Å
116	C	42.6	Very low	46.7	Very low	82 Å²	82	112.2 Å²	112.2	55%	0.554	54%	0.544	S	S	*	.	H	α-helix	trans	-64.2	-51.8	169.6	-171	0	0	0	0	111.1	T112 R113 Y118 K119 H120	T112-C116 VanDerWaalsContact O-CB 3.26Å; T112-C116 WeakPolarHBondContact O-CB 3.47Å; T112-C116 PolarHBondContact O-N 3.4Å; R113-C116 PolarHBondContact O-N 3.43Å; C116-Y118 VanDerWaalsContact C-N 3.31Å; C116-Y118 PolarHBondContact O-N 2.67Å; C116-K119 PolarHBondContact O-N 3.21Å; C116-H120 WeakPolarHBondContact O-CB 3.28Å; C116-H120 PolarHBondContact O-N 3.31Å
117	M	44.7	Very low	47.1	Very low	128 Å²	128	114.7 Å²	114.7	63%	0.631	55%	0.545	S	S	*	.	H	α-helix	trans	-60	-38.3	175.9	-70.3	-63.2	-70.4	0	0	112.5	R113 K114 H120 Y121	R113-M117 WeakPolarHBondContact O-CB 3.35Å; R113-M117 VanDerWaalsContact O-CG 3.28Å; R113-M117 WeakPolarHBondContact O-CG 3.26Å; R113-M117 PolarHBondContact O-N 3.46Å; K114-M117 PolarHBondContact O-N 2.99Å; M117-H120 PolarHBondContact O-N 3.28Å; M117-Y121 WeakPolarHBondContact O-CB 3.29Å; M117-Y121 PolarHBondContact O-N 3.47Å
118	Y	45.5	Very low	47.6	Very low	152 Å²	152	112.7 Å²	112.7	60%	0.596	54%	0.539	S	S	*	.	H	α-helix	trans	-69.5	-38	176.3	-174	-98.3	0	0	0	112.5	K114 C116 K122	K114-Y118 VanDerWaalsContact O-CB 3.23Å; K114-Y118 WeakPolarHBondContact O-CB 3.44Å; K114-Y118 PolarHBondContact O-N 3.33Å; C116-Y118 VanDerWaalsContact C-N 3.31Å; C116-Y118 PolarHBondContact O-N 2.67Å; Y118-K122 HydrophobicContact CE1-CD 4.5Å; Y118-K122 WeakPolarHBondContact O-CB 3.23Å; Y118-K122 PolarHBondContact O-N 2.92Å
119	K	50.8	Low	48.3	Very low	155 Å²	155	114.7 Å²	114.7	67%	0.674	54%	0.539	S	S	*	.	H	α-helix	trans	-63.9	-43.9	170.8	-77	173.9	178.9	-176.3	0	111.3	T115 C116 K122 S123	T115-K119 WeakPolarHBondContact O-CB 3.38Å; T115-K119 VanDerWaalsContact O-CG 3.26Å; T115-K119 WeakPolarHBondContact O-CG 3.24Å; T115-K119 PolarHBondContact O-N 2.87Å; C116-K119 PolarHBondContact O-N 3.21Å; K119-K122 PolarHBondContact O-N 3.39Å; K119-S123 WeakPolarHBondContact O-CB 3.32Å; K119-S123 PolarHBondContact O-N 3.05Å
120	H	48.2	Very low	48.8	Very low	124 Å²	124	111.2 Å²	111.2	57%	0.574	53%	0.53	S	S	*	.	H	α-helix	trans	-66.4	-44.3	178.2	-160.6	-91.6	0	0	0	111.5	C116 M117 S123 L124	C116-H120 WeakPolarHBondContact O-CB 3.28Å; C116-H120 PolarHBondContact O-N 3.31Å; M117-H120 PolarHBondContact O-N 3.28Å; H120-S123 PolarHBondContact O-N 3.16Å; H120-L124 VanDerWaalsContact O-CB 3.24Å; H120-L124 WeakPolarHBondContact O-CB 3.43Å; H120-L124 PolarHBondContact O-N 3.29Å
121	Y	45.4	Very low	49.1	Very low	148 Å²	148	110.9 Å²	110.9	58%	0.58	53%	0.533	S	S	*	.	H	α-helix	trans	-63.4	-40.1	174	-176.2	-96	0	0	0	112.1	M117 L124 L125	M117-Y121 WeakPolarHBondContact O-CB 3.29Å; M117-Y121 PolarHBondContact O-N 3.47Å; Y121-L124 PolarHBondContact O-N 2.99Å; Y121-L125 HydrophobicContact CE1-CD2 4.17Å; Y121-L125 WeakPolarHBondContact O-CB 3.46Å; Y121-L125 PolarHBondContact O-N 2.95Å
122	K	51.3	Low	49.2	Very low	126 Å²	126	112.5 Å²	112.5	55%	0.548	54%	0.535	S	S	.	.	H	α-helix	trans	-67.2	-39.3	174.7	-172.3	172.3	-179.6	176.9	0	111.9	Y118 K119 M126	Y118-K122 HydrophobicContact CE1-CD 4.5Å; Y118-K122 WeakPolarHBondContact O-CB 3.23Å; Y118-K122 PolarHBondContact O-N 2.92Å; K119-K122 PolarHBondContact O-N 3.39Å; K122-M126 WeakPolarHBondContact O-CB 3.41Å; K122-M126 VanDerWaalsContact O-CG 3.24Å; K122-M126 WeakPolarHBondContact O-CG 3.42Å; K122-M126 PolarHBondContact O-N 2.67Å
123	S	49.6	Very low	49.3	Very low	58 Å²	58	111.7 Å²	111.7	41%	0.406	53%	0.533	S	S	.	.	H	α-helix	trans	-64.5	-46.2	173.6	-174.9	0	0	0	0	111.6	K119 H120 M126 R127	K119-S123 WeakPolarHBondContact O-CB 3.32Å; K119-S123 PolarHBondContact O-N 3.05Å; H120-S123 PolarHBondContact O-N 3.16Å; S123-M126 PolarHBondContact O-N 3.4Å; S123-R127 WeakPolarHBondContact O-CB 3.49Å; S123-R127 WeakPolarHBondContact O-CG 3.24Å; S123-R127 PolarHBondContact O-N 3.24Å
124	L	52	Low	49.7	Very low	81 Å²	81	107.5 Å²	107.5	42%	0.424	52%	0.523	S	S	.	.	H	α-helix	trans	-63.7	-42.9	176	-176.7	63.6	0	0	0	111.6	H120 Y121 R127 I128	H120-L124 VanDerWaalsContact O-CB 3.24Å; H120-L124 WeakPolarHBondContact O-CB 3.43Å; H120-L124 PolarHBondContact O-N 3.29Å; Y121-L124 PolarHBondContact O-N 2.99Å; L124-R127 PolarHBondContact O-N 3.16Å; L124-I128 HydrophobicContact CD1-CD1 4.18Å; L124-I128 HydrophobicContact CD1-CG1 4.42Å; L124-I128 HydrophobicContact CG-CD1 3.88Å; L124-I128 HydrophobicContact CG-CG1 4.5Å; L124-I128 WeakPolarHBondContact O-CB 3.23Å; L124-I128 VanDerWaalsContact O-CG1 3.25Å; L124-I128 WeakPolarHBondContact O-CG1 3.38Å; L124-I128 PolarHBondContact O-N 2.86Å
125	L	57.9	Low	49.8	Very low	63 Å²	63	105.6 Å²	105.6	33%	0.33	52%	0.52	S	S	.	.	H	α-helix	trans	-68.1	-34.8	176.5	-175.8	63.6	0	0	0	111.9	Y121 K129	Y121-L125 HydrophobicContact CE1-CD2 4.17Å; Y121-L125 WeakPolarHBondContact O-CB 3.46Å; Y121-L125 PolarHBondContact O-N 2.95Å; L125-K129 HydrophobicContact CG-CD 4.47Å; L125-K129 VanDerWaalsContact O-CB 3.29Å; L125-K129 WeakPolarHBondContact O-CB 3.28Å; L125-K129 VanDerWaalsContact O-CG 3.22Å; L125-K129 WeakPolarHBondContact O-CG 3.34Å; L125-K129 PolarHBondContact O-N 3.48Å
126	M	58.4	Low	50.1	Low	111 Å²	111	106.4 Å²	106.4	55%	0.547	52%	0.521	S	S	.	.	H	α-helix	trans	-67.4	-43.1	170.8	-74.7	-58.8	-61.3	0	0	111.4	K122 S123 K129 T130	K122-M126 WeakPolarHBondContact O-CB 3.41Å; K122-M126 VanDerWaalsContact O-CG 3.24Å; K122-M126 WeakPolarHBondContact O-CG 3.42Å; K122-M126 PolarHBondContact O-N 2.67Å; S123-M126 PolarHBondContact O-N 3.4Å; M126-K129 PolarHBondContact O-N 3.17Å; M126-T130 PolarHBondContact O-N 2.86Å; M126-T130 PolarHBondContact O-OG1 3.48Å; M126-T130 VanDerWaalsContact O-OG1 3.05Å
127	R	48.7	Very low	50.7	Low	171 Å²	171	106.9 Å²	106.9	65%	0.645	52%	0.517	S	S	*	.	H	α-helix	trans	-62.8	-43.4	174.1	-79.5	177.4	165.7	-179.4	-5.4	112.4	S123 L124 K129 T130 C131	S123-R127 WeakPolarHBondContact O-CB 3.49Å; S123-R127 WeakPolarHBondContact O-CG 3.24Å; S123-R127 PolarHBondContact O-N 3.24Å; L124-R127 PolarHBondContact O-N 3.16Å; R127-K129 VanDerWaalsContact C-N 3.33Å; R127-T130 WeakPolarHBondContact CA-OG1 3.35Å; R127-T130 PolarHBondContact O-N 3.2Å; R127-T130 PolarHBondContact O-OG1 2.85Å; R127-C131 VanDerWaalsContact O-CB 3.3Å; R127-C131 WeakPolarHBondContact O-CB 3.49Å; R127-C131 PolarHBondContact O-N 3.4Å; R127-C131 PolarHBondContact O-SG 2.87Å
128	I	53.3	Low	51.3	Low	90 Å²	90	105 Å²	105	46%	0.462	51%	0.508	S	S	.	.	H	α-helix	trans	-62.9	-42.6	174	-71.6	167.7	0	0	0	109.5	L124 C131 F132	L124-I128 HydrophobicContact CD1-CD1 4.18Å; L124-I128 HydrophobicContact CD1-CG1 4.42Å; L124-I128 HydrophobicContact CG-CD1 3.88Å; L124-I128 HydrophobicContact CG-CG1 4.5Å; L124-I128 WeakPolarHBondContact O-CB 3.23Å; L124-I128 VanDerWaalsContact O-CG1 3.25Å; L124-I128 WeakPolarHBondContact O-CG1 3.38Å; L124-I128 PolarHBondContact O-N 2.86Å; I128-C131 PolarHBondContact O-N 2.89Å; I128-F132 VanDerWaalsContact O-CB 3.29Å; I128-F132 WeakPolarHBondContact O-CB 3.48Å; I128-F132 PolarHBondContact O-N 3Å
129	K	53.1	Low	51.7	Low	117 Å²	117	106.2 Å²	106.2	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-63.6	-44.5	175	-77.7	176.3	178.5	-171.7	0	112.8	L125 M126 R127 F132 S133	L125-K129 HydrophobicContact CG-CD 4.47Å; L125-K129 VanDerWaalsContact O-CB 3.29Å; L125-K129 WeakPolarHBondContact O-CB 3.28Å; L125-K129 VanDerWaalsContact O-CG 3.22Å; L125-K129 WeakPolarHBondContact O-CG 3.34Å; L125-K129 PolarHBondContact O-N 3.48Å; M126-K129 PolarHBondContact O-N 3.17Å; R127-K129 VanDerWaalsContact C-N 3.33Å; K129-F132 PolarHBondContact O-N 3.18Å; K129-S133 WeakPolarHBondContact O-CB 3.19Å; K129-S133 PolarHBondContact O-N 2.72Å; K129-S133 PolarHBondContact O-OG 3.44Å; K129-S133 VanDerWaalsContact O-OG 3.12Å
130	T	47.9	Very low	52.2	Low	76 Å²	76	104.4 Å²	104.4	47%	0.466	51%	0.506	S	S	.	.	H	α-helix	trans	-66.8	-38.6	173.7	37.9	0	0	0	0	112.1	M126 R127 F132 S133 L134	M126-T130 PolarHBondContact O-N 2.86Å; M126-T130 PolarHBondContact O-OG1 3.48Å; M126-T130 VanDerWaalsContact O-OG1 3.05Å; R127-T130 WeakPolarHBondContact CA-OG1 3.35Å; R127-T130 PolarHBondContact O-N 3.2Å; R127-T130 PolarHBondContact O-OG1 2.85Å; T130-F132 VanDerWaalsContact C-N 3.32Å; T130-F132 PolarHBondContact O-N 3.47Å; T130-S133 PolarHBondContact O-N 2.87Å; T130-L134 WeakPolarHBondContact O-CB 3.46Å; T130-L134 WeakPolarHBondContact O-CG 3.32Å; T130-L134 PolarHBondContact O-N 2.94Å
131	C	45.3	Very low	52.7	Low	70 Å²	70	102.2 Å²	102.2	47%	0.473	50%	0.501	S	S	.	.	H	α-helix	trans	-64.6	-34.5	173	-71.5	0	0	0	0	112.4	R127 I128 N135	R127-C131 VanDerWaalsContact O-CB 3.3Å; R127-C131 WeakPolarHBondContact O-CB 3.49Å; R127-C131 PolarHBondContact O-N 3.4Å; R127-C131 PolarHBondContact O-SG 2.87Å; I128-C131 PolarHBondContact O-N 2.89Å; C131-N135 VanDerWaalsContact O-CB 3.31Å; C131-N135 WeakPolarHBondContact O-CB 3.37Å; C131-N135 PolarHBondContact O-N 2.89Å; C131-N135 PolarHBondContact O-ND2 3.48Å
132	F	47.2	Very low	53.2	Low	140 Å²	140	102.3 Å²	102.3	61%	0.614	50%	0.5	S	S	*	.	H	α-helix	trans	-74.9	-41.6	176.5	-146.9	-95.1	0	0	0	111.3	I128 K129 T130 N135 I136	I128-F132 VanDerWaalsContact O-CB 3.29Å; I128-F132 WeakPolarHBondContact O-CB 3.48Å; I128-F132 PolarHBondContact O-N 3Å; K129-F132 PolarHBondContact O-N 3.18Å; T130-F132 VanDerWaalsContact C-N 3.32Å; T130-F132 PolarHBondContact O-N 3.47Å; F132-N135 PolarHBondContact O-N 3.3Å; F132-I136 HydrophobicContact CD1-CD1 3.74Å; F132-I136 HydrophobicContact CD1-CG1 4.32Å; F132-I136 HydrophobicContact CE1-CD1 4.07Å; F132-I136 WeakPolarHBondContact O-CB 3.33Å; F132-I136 VanDerWaalsContact O-CG1 3.28Å; F132-I136 WeakPolarHBondContact O-CG1 3.47Å; F132-I136 PolarHBondContact O-N 2.92Å
133	S	50.9	Low	53.7	Low	62 Å²	62	100.2 Å²	100.2	43%	0.434	49%	0.493	S	S	.	.	H	α-helix	trans	-62.4	-41.5	170.6	-65.5	0	0	0	0	112.1	K129 T130 I136 I137	K129-S133 WeakPolarHBondContact O-CB 3.19Å; K129-S133 PolarHBondContact O-N 2.72Å; K129-S133 PolarHBondContact O-OG 3.44Å; K129-S133 VanDerWaalsContact O-OG 3.12Å; T130-S133 PolarHBondContact O-N 2.87Å; S133-I136 PolarHBondContact O-N 3.48Å; S133-I137 WeakPolarHBondContact O-CB 3.32Å; S133-I137 WeakPolarHBondContact O-CD1 3.2Å; S133-I137 WeakPolarHBondContact O-CG1 3.48Å; S133-I137 PolarHBondContact O-N 3.09Å
134	L	52.7	Low	53.7	Low	92 Å²	92	102.6 Å²	102.6	48%	0.482	50%	0.501	S	S	.	.	H	α-helix	trans	-66.5	-39.2	174.1	-75.2	167.5	0	0	0	111.3	T130 I137 I138	T130-L134 WeakPolarHBondContact O-CB 3.46Å; T130-L134 WeakPolarHBondContact O-CG 3.32Å; T130-L134 PolarHBondContact O-N 2.94Å; L134-I137 PolarHBondContact O-N 3.01Å; L134-I138 WeakPolarHBondContact O-CB 3.18Å; L134-I138 WeakPolarHBondContact O-CD1 3.43Å; L134-I138 WeakPolarHBondContact O-CG1 3.4Å; L134-I138 PolarHBondContact O-N 2.92Å
135	N	47.7	Very low	53.7	Low	103 Å²	103	102.4 Å²	102.4	55%	0.551	50%	0.5	S	S	*	.	H	α-helix	trans	-67.8	-35.7	173.2	-87.5	-78.3	0	0	0	112.5	C131 F132 R139	C131-N135 VanDerWaalsContact O-CB 3.31Å; C131-N135 WeakPolarHBondContact O-CB 3.37Å; C131-N135 PolarHBondContact O-N 2.89Å; C131-N135 PolarHBondContact O-ND2 3.48Å; F132-N135 PolarHBondContact O-N 3.3Å; N135-R139 WeakPolarHBondContact O-CB 3.34Å; N135-R139 PolarHBondContact O-N 3.16Å
136	I	58.6	Low	53.9	Low	85 Å²	85	103.8 Å²	103.8	44%	0.436	50%	0.503	S	S	.	.	H	α-helix	trans	-62.6	-50.6	171	-72.2	165.2	0	0	0	109.6	F132 S133 I138 R139 E140	F132-I136 HydrophobicContact CD1-CD1 3.74Å; F132-I136 HydrophobicContact CD1-CG1 4.32Å; F132-I136 HydrophobicContact CE1-CD1 4.07Å; F132-I136 WeakPolarHBondContact O-CB 3.33Å; F132-I136 VanDerWaalsContact O-CG1 3.28Å; F132-I136 WeakPolarHBondContact O-CG1 3.47Å; F132-I136 PolarHBondContact O-N 2.92Å; S133-I136 PolarHBondContact O-N 3.48Å; I136-I138 PolarHBondContact O-N 3.32Å; I136-R139 CarbonylContact O-C 3.54Å; I136-R139 PolarHBondContact O-N 3.06Å; I136-E140 VanDerWaalsContact O-CB 3.22Å; I136-E140 WeakPolarHBondContact O-CB 3.37Å; I136-E140 PolarHBondContact O-N 3.16Å
137	I	55.5	Low	53.9	Low	92 Å²	92	102.1 Å²	102.1	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-62.4	-42.7	178.5	-69	162.3	0	0	0	111.4	S133 L134 R139 E140 V141	S133-I137 WeakPolarHBondContact O-CB 3.32Å; S133-I137 WeakPolarHBondContact O-CD1 3.2Å; S133-I137 WeakPolarHBondContact O-CG1 3.48Å; S133-I137 PolarHBondContact O-N 3.09Å; L134-I137 PolarHBondContact O-N 3.01Å; I137-R139 VanDerWaalsContact C-N 3.35Å; I137-E140 PolarHBondContact O-N 3.37Å; I137-V141 HydrophobicContact CG2-CG2 4.34Å; I137-V141 VanDerWaalsContact O-CB 3.26Å; I137-V141 WeakPolarHBondContact O-CB 3.41Å; I137-V141 VanDerWaalsContact O-CG2 3.23Å; I137-V141 WeakPolarHBondContact O-CG2 3.27Å; I137-V141 PolarHBondContact O-N 2.9Å
138	I	56.6	Low	54	Low	89 Å²	89	99.1 Å²	99.1	46%	0.456	50%	0.497	S	S	.	.	H	α-helix	trans	-66	-38.4	176.6	-72.4	163.8	0	0	0	110.5	L134 I136 R142	L134-I138 WeakPolarHBondContact O-CB 3.18Å; L134-I138 WeakPolarHBondContact O-CD1 3.43Å; L134-I138 WeakPolarHBondContact O-CG1 3.4Å; L134-I138 PolarHBondContact O-N 2.92Å; I136-I138 PolarHBondContact O-N 3.32Å; I138-R142 WeakPolarHBondContact O-CB 3.44Å; I138-R142 PolarHBondContact O-N 3.4Å
139	R	55.7	Low	54.3	Low	178 Å²	178	100.9 Å²	100.9	67%	0.672	50%	0.498	S	S	*	.	H	α-helix	trans	-68.9	-44.8	175.1	-160.8	175.4	84.8	148.1	7.3	110.6	N135 I136 I137 R142 E143	N135-R139 WeakPolarHBondContact O-CB 3.34Å; N135-R139 PolarHBondContact O-N 3.16Å; I136-R139 CarbonylContact O-C 3.54Å; I136-R139 PolarHBondContact O-N 3.06Å; I137-R139 VanDerWaalsContact C-N 3.35Å; R139-R142 CarbonylContact O-C 3.52Å; R139-R142 WeakPolarHBondContact O-CA 3.33Å; R139-R142 WeakPolarHBondContact O-CB 3.45Å; R139-R142 PolarHBondContact O-N 3.49Å; R139-R142 VanDerWaalsContact O-N 3.1Å; R139-E143 VanDerWaalsContact O-CG 3.3Å; R139-E143 WeakPolarHBondContact O-CG 3.21Å; R139-E143 PolarHBondContact O-N 3.48Å
140	E	59.6	Low	54.7	Low	116 Å²	116	98.8 Å²	98.8	54%	0.542	49%	0.492	S	S	.	.	H	α-helix	trans	-65.3	-40.1	178.7	-170.2	164.4	-164.7	0	0	111.9	I136 I137 E143 N144	I136-E140 VanDerWaalsContact O-CB 3.22Å; I136-E140 WeakPolarHBondContact O-CB 3.37Å; I136-E140 PolarHBondContact O-N 3.16Å; I137-E140 PolarHBondContact O-N 3.37Å; E140-E143 PolarHBondContact O-N 3.33Å; E140-N144 WeakPolarHBondContact O-CB 3.24Å; E140-N144 PolarHBondContact O-N 2.9Å; E140-N144 PolarHBondContact O-ND2 3.45Å
141	V	58.9	Low	55.1	Low	78 Å²	78	100 Å²	100	47%	0.473	50%	0.495	S	S	.	.	H	α-helix	trans	-64.5	-40.7	168.6	168.3	0	0	0	0	110.9	I137 E143 N144 L145	I137-V141 HydrophobicContact CG2-CG2 4.34Å; I137-V141 VanDerWaalsContact O-CB 3.26Å; I137-V141 WeakPolarHBondContact O-CB 3.41Å; I137-V141 VanDerWaalsContact O-CG2 3.23Å; I137-V141 WeakPolarHBondContact O-CG2 3.27Å; I137-V141 PolarHBondContact O-N 2.9Å; V141-E143 PolarHBondContact O-N 3.02Å; V141-N144 PolarHBondContact O-N 2.98Å; V141-L145 HydrophobicContact CG1-CD1 3.74Å; V141-L145 HydrophobicContact CG1-CG 4.36Å; V141-L145 VanDerWaalsContact O-CB 3.25Å; V141-L145 WeakPolarHBondContact O-CB 3.33Å; V141-L145 WeakPolarHBondContact O-CG 3.47Å; V141-L145 PolarHBondContact O-N 3.5Å
142	R	55.9	Low	55.9	Low	151 Å²	151	101.1 Å²	101.1	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-64.2	-37.2	176.1	-179.6	-177.5	-67.9	-161.9	-1.8	112.5	I138 R139 L145 K146 R149	I138-R142 WeakPolarHBondContact O-CB 3.44Å; I138-R142 PolarHBondContact O-N 3.4Å; R139-R142 CarbonylContact O-C 3.52Å; R139-R142 WeakPolarHBondContact O-CA 3.33Å; R139-R142 WeakPolarHBondContact O-CB 3.45Å; R139-R142 PolarHBondContact O-N 3.49Å; R139-R142 VanDerWaalsContact O-N 3.1Å; R142-L145 CarbonylContact O-C 3.5Å; R142-L145 PolarHBondContact O-N 2.84Å; R142-K146 PolarHBondContact O-N 2.96Å; R142-R149 PolarHBondContact O-NH2 2.96Å; R142-R149 VanDerWaalsContact O-NH2 3.09Å
143	E	61.3	Low	56.7	Low	82 Å²	82	101.2 Å²	101.2	38%	0.383	50%	0.496	S	S	.	.	H	α-helix	trans	-70	-46.4	173.4	-67.6	-54	123.1	0	0	111.2	R139 E140 V141 L145 K146 P147	R139-E143 VanDerWaalsContact O-CG 3.3Å; R139-E143 WeakPolarHBondContact O-CG 3.21Å; R139-E143 PolarHBondContact O-N 3.48Å; E140-E143 PolarHBondContact O-N 3.33Å; V141-E143 PolarHBondContact O-N 3.02Å; E143-L145 PolarHBondContact O-N 2.87Å; E143-K146 VanDerWaalsContact CD-CE 3.48Å; E143-K146 VanDerWaalsContact O-CB 3.29Å; E143-K146 WeakPolarHBondContact O-CB 3.41Å; E143-K146 PolarHBondContact O-N 2.81Å; E143-K146 WeakPolarHBondContact OE1-CE 3.01Å; E143-K146 IonicContact OE1-NZ 2.81Å; E143-K146 PolarHBondContact OE1-NZ 3.19Å; E143-K146 WeakPolarHBondContact OE2-CD 3.26Å; E143-K146 VanDerWaalsContact OE2-CE 3.22Å; E143-K146 WeakPolarHBondContact OE2-CE 3.11Å; E143-K146 IonicContact OE2-NZ 3.49Å; E143-K146 PolarHBondContact OE2-NZ 3.27Å; E143-P147 VanDerWaalsContact O-CD 3.25Å; E143-P147 WeakPolarHBondContact O-CD 3.5Å
144	N	50.5	Low	57.3	Low	108 Å²	108	102.2 Å²	102.2	58%	0.578	50%	0.495	S	S	*	.	H	α-helix	trans	-63.7	-24.4	173.6	-79.8	-82.6	0	0	0	112.6	E140 V141 P147	E140-N144 WeakPolarHBondContact O-CB 3.24Å; E140-N144 PolarHBondContact O-N 2.9Å; E140-N144 PolarHBondContact O-ND2 3.45Å; V141-N144 PolarHBondContact O-N 2.98Å; N144-P147 WeakPolarHBondContact O-CD 3.48Å; N144-P147 WeakPolarHBondContact O-CG 3.12Å
145	L	53	Low	57.5	Low	77 Å²	77	101.3 Å²	101.3	40%	0.403	49%	0.494	S	S	.	.	H	α-helix	trans	-86.7	3.7	170.4	-71.2	170.3	0	0	0	114.1	V141 R142 E143 L148 R149	V141-L145 HydrophobicContact CG1-CD1 3.74Å; V141-L145 HydrophobicContact CG1-CG 4.36Å; V141-L145 VanDerWaalsContact O-CB 3.25Å; V141-L145 WeakPolarHBondContact O-CB 3.33Å; V141-L145 WeakPolarHBondContact O-CG 3.47Å; V141-L145 PolarHBondContact O-N 3.5Å; R142-L145 CarbonylContact O-C 3.5Å; R142-L145 PolarHBondContact O-N 2.84Å; E143-L145 PolarHBondContact O-N 2.87Å; L145-L148 HydrophobicContact CD2-CD1 3.99Å; L145-R149 PolarHBondContact O-N 2.74Å; L145-R149 PolarHBondContact O-NE 3.27Å
146	K	61.2	Low	58.3	Low	91 Å²	91	103.3 Å²	103.3	40%	0.396	50%	0.498	S	S	.	.	H	α-helix	trans	-70.2	-59.3	166.2	-71.5	-178.1	-179.9	168.7	0	111.6	R142 E143 L148 R149 D150	R142-K146 PolarHBondContact O-N 2.96Å; E143-K146 VanDerWaalsContact CD-CE 3.48Å; E143-K146 VanDerWaalsContact O-CB 3.29Å; E143-K146 WeakPolarHBondContact O-CB 3.41Å; E143-K146 PolarHBondContact O-N 2.81Å; E143-K146 WeakPolarHBondContact OE1-CE 3.01Å; E143-K146 IonicContact OE1-NZ 2.81Å; E143-K146 PolarHBondContact OE1-NZ 3.19Å; E143-K146 WeakPolarHBondContact OE2-CD 3.26Å; E143-K146 VanDerWaalsContact OE2-CE 3.22Å; E143-K146 WeakPolarHBondContact OE2-CE 3.11Å; E143-K146 IonicContact OE2-NZ 3.49Å; E143-K146 PolarHBondContact OE2-NZ 3.27Å; K146-L148 PolarHBondContact O-N 3.24Å; K146-R149 CarbonylContact O-C 3.58Å; K146-R149 WeakPolarHBondContact O-CA 3.06Å; K146-R149 PolarHBondContact O-N 2.81Å; K146-D150 PolarHBondContact O-N 2.99Å; K146-D150 VanDerWaalsContact O-OD2 3.05Å
147	P	58.9	Low	58.5	Low	76 Å²	76	105.1 Å²	105.1	49%	0.494	50%	0.504	S	S	.	.	H	α-helix	trans	-58.9	-26.9	-178.4	23.3	-34.2	0	0	0	113.4	E143 N144 L151	E143-P147 VanDerWaalsContact O-CD 3.25Å; E143-P147 WeakPolarHBondContact O-CD 3.5Å; N144-P147 WeakPolarHBondContact O-CD 3.48Å; N144-P147 WeakPolarHBondContact O-CG 3.12Å; P147-L151 WeakPolarHBondContact O-CB 2.96Å; P147-L151 WeakPolarHBondContact O-CD1 3.42Å; P147-L151 VanDerWaalsContact O-CG 3.28Å; P147-L151 WeakPolarHBondContact O-CG 3.27Å; P147-L151 PolarHBondContact O-N 3.31Å
148	L	49.4	Very low	58.7	Low	109 Å²	109	104.9 Å²	104.9	57%	0.571	50%	0.503	S	S	*	.	H	α-helix	trans	-72.7	-35.1	170.8	-85.5	166.1	0	0	0	114	L145 K146 L152	L145-L148 HydrophobicContact CD2-CD1 3.99Å; K146-L148 PolarHBondContact O-N 3.24Å; L148-L152 WeakPolarHBondContact O-CB 3.33Å; L148-L152 PolarHBondContact O-N 3.29Å
149	R	59.6	Low	58.8	Low	127 Å²	127	106.5 Å²	106.5	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-76.1	-32.6	172.5	-83.8	178.1	-71.9	-169.7	-1.2	112.6	R142 L145 K146 L152 K153	R142-R149 PolarHBondContact O-NH2 2.96Å; R142-R149 VanDerWaalsContact O-NH2 3.09Å; L145-R149 PolarHBondContact O-N 2.74Å; L145-R149 PolarHBondContact O-NE 3.27Å; K146-R149 CarbonylContact O-C 3.58Å; K146-R149 WeakPolarHBondContact O-CA 3.06Å; K146-R149 PolarHBondContact O-N 2.81Å; R149-L152 CarbonylContact O-C 3.17Å; R149-L152 PolarHBondContact O-N 3.08Å; R149-K153 PolarHBondContact O-N 3.26Å
150	D	62.5	Low	59.2	Low	73 Å²	73	104 Å²	104	39%	0.39	50%	0.503	S	S	.	.	H	α-helix	trans	-73.9	-38.1	175	-58.6	-42.1	0	0	0	110.1	K146 L152 K153 I154	K146-D150 PolarHBondContact O-N 2.99Å; K146-D150 VanDerWaalsContact O-OD2 3.05Å; D150-L152 VanDerWaalsContact C-N 3.3Å; D150-L152 PolarHBondContact O-N 3.03Å; D150-K153 PolarHBondContact O-N 3.49Å; D150-I154 WeakPolarHBondContact O-CB 3.3Å; D150-I154 WeakPolarHBondContact O-CD1 3.43Å; D150-I154 WeakPolarHBondContact O-CG1 3.21Å; D150-I154 PolarHBondContact O-N 2.92Å
151	L	55.3	Low	59.1	Low	100 Å²	100	103.4 Å²	103.4	52%	0.524	50%	0.503	S	S	.	.	H	α-helix	trans	-60.2	-35.8	164.1	-84.3	165.4	0	0	0	112.5	P147 T155	P147-L151 WeakPolarHBondContact O-CB 2.96Å; P147-L151 WeakPolarHBondContact O-CD1 3.42Å; P147-L151 VanDerWaalsContact O-CG 3.28Å; P147-L151 WeakPolarHBondContact O-CG 3.27Å; P147-L151 PolarHBondContact O-N 3.31Å; L151-T155 WeakPolarHBondContact O-CB 3.38Å; L151-T155 WeakPolarHBondContact O-CG2 3.25Å; L151-T155 PolarHBondContact O-N 3.32Å; L151-T155 PolarHBondContact O-OG1 2.82Å
152	L	62.1	Low	58.7	Low	94 Å²	94	104.5 Å²	104.5	49%	0.492	51%	0.506	S	S	.	.	H	α-helix	trans	-72.3	-32	176.4	-172.8	61.8	0	0	0	112.5	L148 R149 D150 T155 K156	L148-L152 WeakPolarHBondContact O-CB 3.33Å; L148-L152 PolarHBondContact O-N 3.29Å; R149-L152 CarbonylContact O-C 3.17Å; R149-L152 PolarHBondContact O-N 3.08Å; D150-L152 VanDerWaalsContact C-N 3.3Å; D150-L152 PolarHBondContact O-N 3.03Å; L152-T155 WeakPolarHBondContact CA-OG1 3.31Å; L152-T155 PolarHBondContact O-OG1 3.4Å; L152-K156 WeakPolarHBondContact O-CB 3.38Å; L152-K156 VanDerWaalsContact O-CG 3.28Å; L152-K156 WeakPolarHBondContact O-CG 3.26Å; L152-K156 PolarHBondContact O-N 2.91Å
153	K	63.9	Low	58.3	Low	143 Å²	143	100 Å²	100	62%	0.622	50%	0.497	S	S	*	.	H	α-helix	trans	-66.7	-53.9	167.8	-77.7	-179.1	172.3	-176.4	0	110.6	R149 D150 T155 K156 E157	R149-K153 PolarHBondContact O-N 3.26Å; D150-K153 PolarHBondContact O-N 3.49Å; K153-T155 VanDerWaalsContact C-N 3.3Å; K153-T155 PolarHBondContact O-N 2.84Å; K153-K156 CarbonylContact O-C 3.54Å; K153-K156 WeakPolarHBondContact O-CA 3.49Å; K153-K156 WeakPolarHBondContact O-CB 3.49Å; K153-K156 PolarHBondContact O-N 2.79Å; K153-E157 WeakPolarHBondContact O-CB 3.27Å; K153-E157 PolarHBondContact O-N 3.49Å
154	I	63.4	Low	57.9	Low	82 Å²	82	100 Å²	100	42%	0.421	50%	0.497	S	S	.	.	H	α-helix	trans	-59.4	-38.8	-179.1	-70	163.4	0	0	0	111.3	D150 E157 I158	D150-I154 WeakPolarHBondContact O-CB 3.3Å; D150-I154 WeakPolarHBondContact O-CD1 3.43Å; D150-I154 WeakPolarHBondContact O-CG1 3.21Å; D150-I154 PolarHBondContact O-N 2.92Å; I154-E157 PolarHBondContact O-N 3.37Å; I154-I158 HydrophobicContact CG2-CD1 3.68Å; I154-I158 HydrophobicContact CG2-CG1 4.35Å; I154-I158 VanDerWaalsContact O-CB 3.27Å; I154-I158 WeakPolarHBondContact O-CB 3.45Å; I154-I158 WeakPolarHBondContact O-CG1 3.45Å; I154-I158 PolarHBondContact O-N 3.43Å
155	T	58.4	Low	57.7	Low	73 Å²	73	96.7 Å²	96.7	45%	0.448	49%	0.488	S	S	.	.	H	α-helix	trans	-70.5	-34.5	173.8	45.3	0	0	0	0	113	L151 L152 K153 Q159	L151-T155 WeakPolarHBondContact O-CB 3.38Å; L151-T155 WeakPolarHBondContact O-CG2 3.25Å; L151-T155 PolarHBondContact O-N 3.32Å; L151-T155 PolarHBondContact O-OG1 2.82Å; L152-T155 WeakPolarHBondContact CA-OG1 3.31Å; L152-T155 PolarHBondContact O-OG1 3.4Å; K153-T155 VanDerWaalsContact C-N 3.3Å; K153-T155 PolarHBondContact O-N 2.84Å; T155-Q159 WeakPolarHBondContact O-CB 3.49Å; T155-Q159 PolarHBondContact O-N 2.86Å
156	K	64.1	Low	57.4	Low	146 Å²	146	100 Å²	100	64%	0.635	50%	0.502	S	S	*	.	H	α-helix	trans	-68	-35.5	170.5	-76	178.5	176.7	-167.8	0	112.8	L152 K153 Q159 F160	L152-K156 WeakPolarHBondContact O-CB 3.38Å; L152-K156 VanDerWaalsContact O-CG 3.28Å; L152-K156 WeakPolarHBondContact O-CG 3.26Å; L152-K156 PolarHBondContact O-N 2.91Å; K153-K156 CarbonylContact O-C 3.54Å; K153-K156 WeakPolarHBondContact O-CA 3.49Å; K153-K156 WeakPolarHBondContact O-CB 3.49Å; K153-K156 PolarHBondContact O-N 2.79Å; K156-Q159 WeakPolarHBondContact O-CB 3.43Å; K156-Q159 PolarHBondContact O-N 2.91Å; K156-F160 WeakPolarHBondContact O-CB 3.45Å; K156-F160 PolarHBondContact O-N 2.85Å
157	E	63	Low	56.7	Low	122 Å²	122	102.4 Å²	102.4	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-73	-41.4	178.3	-166.1	163.8	-139.8	0	0	111.2	K153 I154 F160 L161	K153-E157 WeakPolarHBondContact O-CB 3.27Å; K153-E157 PolarHBondContact O-N 3.49Å; I154-E157 PolarHBondContact O-N 3.37Å; E157-F160 WeakPolarHBondContact O-CB 3.41Å; E157-F160 PolarHBondContact O-N 2.89Å; E157-L161 WeakPolarHBondContact O-CB 2.98Å; E157-L161 WeakPolarHBondContact O-CG 3.23Å; E157-L161 PolarHBondContact O-N 3.21Å
158	I	58.9	Low	56.1	Low	87 Å²	87	105.6 Å²	105.6	45%	0.446	52%	0.52	S	S	.	.	H	α-helix	trans	-63.2	-41.1	167.9	-70.7	168.1	0	0	0	110.7	I154 F160 L161 L162	I154-I158 HydrophobicContact CG2-CD1 3.68Å; I154-I158 HydrophobicContact CG2-CG1 4.35Å; I154-I158 VanDerWaalsContact O-CB 3.27Å; I154-I158 WeakPolarHBondContact O-CB 3.45Å; I154-I158 WeakPolarHBondContact O-CG1 3.45Å; I154-I158 PolarHBondContact O-N 3.43Å; I158-F160 VanDerWaalsContact C-N 3.31Å; I158-F160 PolarHBondContact O-N 3.48Å; I158-L161 PolarHBondContact O-N 2.94Å; I158-L162 HydrophobicContact CG2-CD1 3.75Å; I158-L162 HydrophobicContact CG2-CG 4.21Å; I158-L162 VanDerWaalsContact O-CB 3.3Å; I158-L162 WeakPolarHBondContact O-CB 3.27Å; I158-L162 WeakPolarHBondContact O-CG 3.48Å; I158-L162 PolarHBondContact O-N 3.36Å
159	Q	59.1	Low	55.6	Low	123 Å²	123	106.3 Å²	106.3	58%	0.575	52%	0.521	S	S	*	.	H	α-helix	trans	-61.6	-40.2	174.9	-168.1	75.2	17.5	0	0	111.3	T155 K156 C163	T155-Q159 WeakPolarHBondContact O-CB 3.49Å; T155-Q159 PolarHBondContact O-N 2.86Å; K156-Q159 WeakPolarHBondContact O-CB 3.43Å; K156-Q159 PolarHBondContact O-N 2.91Å; Q159-C163 WeakPolarHBondContact O-CB 3.48Å; Q159-C163 PolarHBondContact O-N 3.01Å; Q159-C163 PolarHBondContact O-SG 3.42Å
160	F	64.6	Low	54.7	Low	127 Å²	127	107.3 Å²	107.3	56%	0.557	53%	0.528	S	S	*	.	H	α-helix	trans	-64	-50.3	175.1	-175.4	-90.1	0	0	0	111.5	K156 E157 I158 L162 C163 E164	K156-F160 WeakPolarHBondContact O-CB 3.45Å; K156-F160 PolarHBondContact O-N 2.85Å; E157-F160 WeakPolarHBondContact O-CB 3.41Å; E157-F160 PolarHBondContact O-N 2.89Å; I158-F160 VanDerWaalsContact C-N 3.31Å; I158-F160 PolarHBondContact O-N 3.48Å; F160-L162 VanDerWaalsContact C-N 3.33Å; F160-L162 PolarHBondContact O-N 2.87Å; F160-C163 CarbonylContact O-C 3.59Å; F160-C163 WeakPolarHBondContact O-CA 3.37Å; F160-C163 WeakPolarHBondContact O-CB 3.32Å; F160-C163 PolarHBondContact O-N 3.18Å; F160-C163 VanDerWaalsContact O-N 3.1Å; F160-E164 HydrophobicContact CD1-CG 4.29Å; F160-E164 HydrophobicContact CE1-CG 3.95Å; F160-E164 WeakPolarHBondContact CE1-OE2 3.4Å; F160-E164 HydrophobicContact CZ-CG 4.4Å; F160-E164 PolarHBondContact O-N 3.48Å
161	L	56.5	Low	53.6	Low	103 Å²	103	111.6 Å²	111.6	54%	0.539	54%	0.544	S	S	.	.	H	α-helix	trans	-63.9	-34.2	178	-70	168.4	0	0	0	112.8	E157 I158 E164 G165	E157-L161 WeakPolarHBondContact O-CB 2.98Å; E157-L161 WeakPolarHBondContact O-CG 3.23Å; E157-L161 PolarHBondContact O-N 3.21Å; I158-L161 PolarHBondContact O-N 2.94Å; L161-E164 PolarHBondContact O-N 3.4Å; L161-G165 PolarHBondContact O-N 3.04Å
162	L	50.9	Low	52.9	Low	101 Å²	101	111 Å²	111	53%	0.529	55%	0.545	S	S	.	.	H	α-helix	trans	-68.2	-39.1	171.8	-74	170.3	0	0	0	111.7	I158 F160 G165 Q166	I158-L162 HydrophobicContact CG2-CD1 3.75Å; I158-L162 HydrophobicContact CG2-CG 4.21Å; I158-L162 VanDerWaalsContact O-CB 3.3Å; I158-L162 WeakPolarHBondContact O-CB 3.27Å; I158-L162 WeakPolarHBondContact O-CG 3.48Å; I158-L162 PolarHBondContact O-N 3.36Å; F160-L162 VanDerWaalsContact C-N 3.33Å; F160-L162 PolarHBondContact O-N 2.87Å; L162-G165 PolarHBondContact O-N 3.48Å; L162-Q166 WeakPolarHBondContact O-CG 3.38Å; L162-Q166 PolarHBondContact O-N 3.05Å
163	C	48.4	Very low	51.6	Low	57 Å²	57	111.6 Å²	111.6	39%	0.385	55%	0.546	S	S	.	.	H	α-helix	trans	-65.3	-38	172.5	-81.9	0	0	0	0	112.5	Q159 F160 K167	Q159-C163 WeakPolarHBondContact O-CB 3.48Å; Q159-C163 PolarHBondContact O-N 3.01Å; Q159-C163 PolarHBondContact O-SG 3.42Å; F160-C163 CarbonylContact O-C 3.59Å; F160-C163 WeakPolarHBondContact O-CA 3.37Å; F160-C163 WeakPolarHBondContact O-CB 3.32Å; F160-C163 PolarHBondContact O-N 3.18Å; F160-C163 VanDerWaalsContact O-N 3.1Å; C163-K167 WeakPolarHBondContact O-CG 3.47Å; C163-K167 PolarHBondContact O-N 3.5Å
164	E	52	Low	50.3	Low	81 Å²	81	112.2 Å²	112.2	38%	0.379	55%	0.551	S	S	.	*	H	α-helix	trans	-68.6	-42.4	172.2	-70.7	-158.3	113.3	0	0	112.4	F160 L161 Q166 K167 Q168	F160-E164 HydrophobicContact CD1-CG 4.29Å; F160-E164 HydrophobicContact CE1-CG 3.95Å; F160-E164 WeakPolarHBondContact CE1-OE2 3.4Å; F160-E164 HydrophobicContact CZ-CG 4.4Å; F160-E164 PolarHBondContact O-N 3.48Å; L161-E164 PolarHBondContact O-N 3.4Å; E164-Q166 VanDerWaalsContact C-N 3.3Å; E164-Q166 PolarHBondContact O-N 3.24Å; E164-K167 WeakPolarHBondContact O-CB 3.37Å; E164-K167 PolarHBondContact O-N 3.49Å; E164-K167 VanDerWaalsContact O-N 3.08Å; E164-Q168 PolarHBondContact O-N 2.83Å
165	G	45.9	Very low	48.9	Very low	39 Å²	39	119.3 Å²	119.3	40%	0.402	57%	0.573	S	S	.	*	H	α-helix	trans	-56.3	-43.4	172.8	0	0	0	0	0	112.2	L161 L162 Q168 H169	L161-G165 PolarHBondContact O-N 3.04Å; L162-G165 PolarHBondContact O-N 3.48Å; G165-Q168 PolarHBondContact O-N 2.59Å; G165-H169 WeakPolarHBondContact O-CB 3.37Å; G165-H169 PolarHBondContact O-N 3.16Å
166	Q	46.8	Very low	47.8	Very low	146 Å²	146	119.4 Å²	119.4	68%	0.682	58%	0.576	S	S	*	*	H	α-helix	trans	-66	-37.7	173.8	-74.3	-174.9	2.9	0	0	113.1	L162 E164 H169 K170	L162-Q166 WeakPolarHBondContact O-CG 3.38Å; L162-Q166 PolarHBondContact O-N 3.05Å; E164-Q166 VanDerWaalsContact C-N 3.3Å; E164-Q166 PolarHBondContact O-N 3.24Å; Q166-H169 PolarHBondContact O-N 2.9Å; Q166-K170 WeakPolarHBondContact O-CB 3.31Å; Q166-K170 PolarHBondContact O-N 3.37Å
167	K	47.1	Very low	46.4	Very low	142 Å²	142	119.6 Å²	119.6	62%	0.617	58%	0.584	S	S	*	*	H	α-helix	trans	-61.3	-46	173.2	-73.5	169.2	-176.3	175.2	0	111.3	C163 E164 K170 F171	C163-K167 WeakPolarHBondContact O-CG 3.47Å; C163-K167 PolarHBondContact O-N 3.5Å; E164-K167 WeakPolarHBondContact O-CB 3.37Å; E164-K167 PolarHBondContact O-N 3.49Å; E164-K167 VanDerWaalsContact O-N 3.08Å; K167-K170 PolarHBondContact O-N 2.86Å; K167-F171 PolarHBondContact O-N 3.31Å; K167-F171 VanDerWaalsContact O-N 3.16Å
168	Q	45.7	Very low	44.9	Very low	142 Å²	142	118.5 Å²	118.5	66%	0.664	60%	0.596	S	S	*	*	H	α-helix	trans	-67.7	-41	178.2	-65.6	-162.3	20.5	0	0	112.4	E164 G165 K170 F171 T172	E164-Q168 PolarHBondContact O-N 2.83Å; G165-Q168 PolarHBondContact O-N 2.59Å; Q168-K170 PolarHBondContact O-N 3.19Å; Q168-F171 WeakPolarHBondContact O-CB 3.37Å; Q168-F171 PolarHBondContact O-N 3.26Å; Q168-T172 PolarHBondContact O-N 3.19Å; Q168-T172 PolarHBondContact O-OG1 2.81Å
169	H	39.6	Very low	43.4	Very low	125 Å²	125	120.6 Å²	120.6	58%	0.579	62%	0.617	S	S	*	*	H	α-helix	trans	-65.5	-27.5	177.1	-155.9	-70.2	0	0	0	112.8	G165 Q166 T172 M173	G165-H169 WeakPolarHBondContact O-CB 3.37Å; G165-H169 PolarHBondContact O-N 3.16Å; Q166-H169 PolarHBondContact O-N 2.9Å; H169-T172 WeakPolarHBondContact CA-OG1 3.46Å; H169-T172 PolarHBondContact O-OG1 3.15Å; H169-M173 WeakPolarHBondContact O-CG 3.47Å; H169-M173 PolarHBondContact O-N 3.5Å; H169-M173 VanDerWaalsContact O-N 3.16Å
170	K	40.7	Very low	41.9	Very low	148 Å²	148	120 Å²	120	64%	0.643	63%	0.627	S	S	*	*	H	α-helix	trans	-71.8	-38.2	171.3	-161.7	171.9	-174.8	179.1	0	111.6	Q166 K167 Q168 M173 Q174	Q166-K170 WeakPolarHBondContact O-CB 3.31Å; Q166-K170 PolarHBondContact O-N 3.37Å; K167-K170 PolarHBondContact O-N 2.86Å; Q168-K170 PolarHBondContact O-N 3.19Å; K170-M173 PolarHBondContact O-N 2.79Å; K170-Q174 PolarHBondContact O-N 3.43Å
171	F	38.2	Very low	41	Very low	162 Å²	162	119.1 Å²	119.1	71%	0.711	63%	0.634	S	S	*	*	H	α-helix	trans	-67.6	-34.5	177	-135.7	-89.5	0	0	0	113	K167 Q168	K167-F171 PolarHBondContact O-N 3.31Å; K167-F171 VanDerWaalsContact O-N 3.16Å; Q168-F171 WeakPolarHBondContact O-CB 3.37Å; Q168-F171 PolarHBondContact O-N 3.26Å
172	T	40.8	Very low	39.8	Very low	88 Å²	88	120.6 Å²	120.6	54%	0.54	65%	0.647	S	S	.	*	H	α-helix	trans	-77.3	-35.4	174.5	50	0	0	0	0	113	Q168 H169 R175 S176	Q168-T172 PolarHBondContact O-N 3.19Å; Q168-T172 PolarHBondContact O-OG1 2.81Å; H169-T172 WeakPolarHBondContact CA-OG1 3.46Å; H169-T172 PolarHBondContact O-OG1 3.15Å; T172-R175 PolarHBondContact O-N 3.1Å; T172-S176 PolarHBondContact O-OG 3.02Å
173	M	34.8	Very low	38.7	Very low	107 Å²	107	122 Å²	122	53%	0.527	66%	0.659	S	S	.	*	H	α-helix	trans	-68.9	-33.6	173.6	-77.7	-139.7	73.8	0	0	113.7	H169 K170 R175 S176	H169-M173 WeakPolarHBondContact O-CG 3.47Å; H169-M173 PolarHBondContact O-N 3.5Å; H169-M173 VanDerWaalsContact O-N 3.16Å; K170-M173 PolarHBondContact O-N 2.79Å; M173-R175 PolarHBondContact O-N 3.39Å; M173-S176 WeakPolarHBondContact CA-OG 3.5Å; M173-S176 PolarHBondContact O-N 2.82Å; M173-S176 PolarHBondContact O-OG 3.24Å
174	Q	36.9	Very low	37.8	Very low	155 Å²	155	124.5 Å²	124.5	72%	0.724	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-15.2	174.4	-76.3	-172.7	-73.7	0	0	113.7	K170	K170-Q174 PolarHBondContact O-N 3.43Å
175	R	35.3	Very low	36.7	Very low	232 Å²	232	128.9 Å²	128.9	88%	0.875	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	1.5	-179.6	-141.1	176.4	-168.9	177.6	3.7	114.3	T172 M173	T172-R175 PolarHBondContact O-N 3.1Å; M173-R175 PolarHBondContact O-N 3.39Å
176	S	35	Very low	35.9	Very low	75 Å²	75	130.5 Å²	130.5	52%	0.524	72%	0.72	S	S	.	*	S	Bend	trans	-121.2	11.3	-169.6	37.9	0	0	0	0	115.2	T172 M173	T172-S176 PolarHBondContact O-OG 3.02Å; M173-S176 WeakPolarHBondContact CA-OG 3.5Å; M173-S176 PolarHBondContact O-N 2.82Å; M173-S176 PolarHBondContact O-OG 3.24Å
177	N	34.3	Very low	35	Very low	149 Å²	149	129.8 Å²	129.8	80%	0.797	72%	0.72	S	S	*	*			trans	-122.1	69.4	173.6	-92.3	-23.9	0	0	0	112.5
178	A	31	Very low	34	Very low	99 Å²	99	130.8 Å²	130.8	82%	0.818	73%	0.725	S	S	*	*	S	Bend	trans	-140	132	156.7	0	0	0	0	0	107.6
179	C	28.3	Very low	33.2	Very low	132 Å²	132	132.5 Å²	132.5	89%	0.892	73%	0.731	S	S	*	*			trans	-80.9	158.5	-161.7	-70.7	0	0	0	0	115.6
180	S	28.1	Very low	32.6	Very low	111 Å²	111	130.9 Å²	130.9	78%	0.776	74%	0.739	S	S	*	*			trans	-58.8	179.3	166.4	-40.5	0	0	0	0	112.5
181	P	45.5	Very low	32.1	Very low	108 Å²	108	129.6 Å²	129.6	70%	0.701	74%	0.743	S	S	*	*			cis	-150.1	169.2	18.3	43.3	-22.3	0	0	0	120.3
182	V	29.7	Very low	31.6	Very low	134 Å²	134	129.6 Å²	129.6	81%	0.812	75%	0.75	S	S	*	*			trans	61.2	154.9	165.4	-120.8	0	0	0	0	115
183	V	28.7	Very low	30.9	Very low	131 Å²	131	129.1 Å²	129.1	79%	0.794	76%	0.763	S	S	*	*			cis	-140.7	165.4	19.2	-171.8	0	0	0	0	112
184	S	29.6	Very low	30.5	Very low	108 Å²	108	128.9 Å²	128.9	76%	0.755	78%	0.778	S	S	*	*			trans	-43.8	155.8	-178.5	-39.9	0	0	0	0	120.1
185	D	29	Very low	30.1	Very low	173 Å²	173	125.3 Å²	125.3	93%	0.925	78%	0.775	S	S	*	*			trans	-54.7	150.1	151.7	-85.6	-58.2	0	0	0	112.4
186	G	28.7	Very low	29.7	Very low	73 Å²	73	120 Å²	120	75%	0.753	76%	0.764	S	S	*	*			trans	-176.5	0.3	-178.1	0	0	0	0	0	123.7
187	N	28.8	Very low	29.4	Very low	131 Å²	131	124.1 Å²	124.1	70%	0.701	77%	0.772	S	S	*	*			trans	60.3	119.7	164.6	179	29.4	0	0	0	119.5
188	F	25.2	Very low	29	Very low	164 Å²	164	122.1 Å²	122.1	72%	0.719	77%	0.77	S	S	*	*				171.1	143.3	124.3	-103.7	-72.6	0	0	0	115.8
189	K	28.5	Very low	28.8	Very low	178 Å²	178	122.6 Å²	122.6	77%	0.774	77%	0.767	S	S	*	*			trans	40.3	105.1	150.6	-85	167.3	-179.7	178	0	122.2
190	A	28.2	Very low	28.7	Very low	91 Å²	91	121.1 Å²	121.1	75%	0.752	76%	0.757	S	S	*	*				62.9	160	106.7	0	0	0	0	0	123.9
191	V	28.7	Very low	28.8	Very low	121 Å²	121	122.9 Å²	122.9	73%	0.733	76%	0.757	S	S	*	*			trans	95.3	112.8	159.6	-172.2	0	0	0	0	118.7
192	N	28.6	Very low	27.9	Very low	162 Å²	162	124.3 Å²	124.3	87%	0.866	76%	0.759	S	S	*	*			trans	54.6	150.8	152.4	-58.5	-7.6	0	0	0	121.9
193	G	26.8	Very low	27.8	Very low	78 Å²	78	124.1 Å²	124.1	80%	0.804	76%	0.758	S	S	*	*			trans	156.4	72.3	158.4	0	0	0	0	0	118.2
194	A	26.5	Very low	27.8	Very low	102 Å²	102	122 Å²	122	84%	0.843	75%	0.754	S	S	*	*			trans	-77.6	158.9	154.9	0	0	0	0	0	109.9
195	A	27.5	Very low	27.7	Very low	80 Å²	80	122 Å²	122	66%	0.661	75%	0.754	S	S	*	*			cis	-172.9	-167.7	-17	0	0	0	0	0	108.3
196	D	27	Very low	27.7	Very low	119 Å²	119	121.5 Å²	121.5	64%	0.636	75%	0.751	S	S	*	*			trans	78.5	121.7	139.6	-83.7	-18.4	0	0	0	123.8
197	K	29.2	Very low	27.6	Very low	162 Å²	162	123.3 Å²	123.3	70%	0.704	75%	0.753	S	S	*	*				82.7	93.5	121.1	-69.7	168.6	-172.9	142.3	0	123.3
198	S	25.6	Very low	27.7	Very low	107 Å²	107	123.4 Å²	123.4	75%	0.748	76%	0.758	S	S	*	*				54.3	126.9	104.3	69.6	0	0	0	0	123.7
199	S	26.7	Very low	27.8	Very low	109 Å²	109	122.8 Å²	122.8	76%	0.762	76%	0.761	S	S	*	*			trans	-157	136.5	133.8	-163.3	0	0	0	0	106.5
200	C	26.5	Very low	27.7	Very low	101 Å²	101	121.8 Å²	121.8	68%	0.682	76%	0.763	S	S	*	*			cis	70	130.2	41.5	-50.9	0	0	0	0	111.2
201	L	30.5	Very low	27.4	Very low	148 Å²	148	129.3 Å²	129.3	78%	0.775	77%	0.772	S	S	*	*			cis	-146	-178.2	28.2	-88.2	174.7	0	0	0	114.7
202	D	25.4	Very low	27	Very low	138 Å²	138	135 Å²	135	74%	0.738	78%	0.781	S	S	*	*			trans	80.2	141.6	151.9	-64.9	-22.7	0	0	0	122.2
203	V	28.5	Very low	27.8	Very low	131 Å²	131	132.2 Å²	132.2	79%	0.794	77%	0.772	S	S	*	*			cis	-164.9	164.2	-31.4	106.7	0	0	0	0	111.9
204	A	28.1	Very low	27.6	Very low	85 Å²	85	137.1 Å²	137.1	70%	0.702	77%	0.774	S	S	*	*			trans	97	133.9	160.7	0	0	0	0	0	121.5
205	S	28.5	Very low	27.3	Very low	110 Å²	110	138.9 Å²	138.9	77%	0.769	77%	0.773	S	S	*	*			trans	84.2	69.3	154.6	-56.7	0	0	0	0	121
206	N	29.1	Very low	27.2	Very low	161 Å²	161	139.3 Å²	139.3	86%	0.861	78%	0.777	S	S	*	*				35.1	140.8	118.2	-65.5	3.5	0	0	0	120.9
207	S	25.9	Very low	27	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	78%	0.78	S	S	*	*			cis	-165.7	156.2	1.2	45.1	0	0	0	0	112.6
208	V	31.8	Very low	26.7	Very low	133 Å²	133	138.5 Å²	138.5	81%	0.806	79%	0.788	S	S	*	*			trans	-134.7	146.3	172	172.6	0	0	0	0	108.2
209	L	26.3	Very low	26.6	Very low	152 Å²	152	137.2 Å²	137.2	80%	0.796	79%	0.792	S	S	*	*			trans	176.8	119.3	141	-96.6	163.5	0	0	0	114.7
210	L	27	Very low	26.4	Very low	157 Å²	157	137.6 Å²	137.6	82%	0.822	80%	0.795	S	S	*	*			trans	21.5	125.4	142.9	-59	172.7	0	0	0	122.4
211	R	22.3	Very low	27.2	Very low	249 Å²	249	138.2 Å²	138.2	94%	0.94	80%	0.798	S	S	*	*				-163.8	155.5	118.7	-139.7	175.9	172.8	145.5	-2.3	113.8
212	W	19.7	Very low	26.9	Very low	239 Å²	239	142.5 Å²	142.5	91%	0.905	80%	0.803	S	S	*	*			trans	-91	-174.3	160.2	-46.4	-55.6	0	0	0	110.6
213	P	44.8	Very low	26.8	Very low	105 Å²	105	141.3 Å²	141.3	68%	0.682	81%	0.805	S	S	*	*			cis	-133.8	-155.5	-18.7	28.4	-3.2	0	0	0	112.7
214	E	21.8	Very low	26.7	Very low	181 Å²	181	143.1 Å²	143.1	85%	0.846	81%	0.805	S	S	*	*			trans	94.9	172.5	136.4	-104.1	173.9	141.8	0	0	122.7
215	V	22	Very low	26.7	Very low	138 Å²	138	145.9 Å²	145.9	84%	0.836	81%	0.807	S	S	*	*			trans	-131.7	138.6	-155	169.4	0	0	0	0	111.1
216	A	24.1	Very low	26.5	Very low	90 Å²	90	146.3 Å²	146.3	74%	0.744	80%	0.801	S	S	*	*			trans	178.5	113	142.4	0	0	0	0	0	115.8
217	S	23.2	Very low	26.3	Very low	98 Å²	98	144.8 Å²	144.8	69%	0.685	80%	0.797	S	S	*	*				57	130.7	113.9	-148.5	0	0	0	0	124.2
218	N	23.7	Very low	26.3	Very low	165 Å²	165	144.7 Å²	144.7	88%	0.882	80%	0.796	S	S	*	*			trans	75.5	128.8	146.1	-67.3	-15.7	0	0	0	122.6
219	G	23.7	Very low	25.9	Very low	81 Å²	81	147.6 Å²	147.6	84%	0.835	80%	0.801	S	S	*	*			trans	167	74.1	166.4	0	0	0	0	0	116.8
220	S	22.6	Very low	26	Very low	117 Å²	117	147.8 Å²	147.8	82%	0.818	80%	0.798	S	S	*	*			trans	-83.4	163.8	165.5	-133.1	0	0	0	0	110.2
221	P	41.5	Very low	26.1	Very low	114 Å²	114	146.8 Å²	146.8	74%	0.74	79%	0.792	S	S	*	*				-155.4	172.5	50.1	43.4	-21.9	0	0	0	120.8
222	R	24.9	Very low	26.2	Very low	237 Å²	237	143.1 Å²	143.1	89%	0.894	79%	0.788	S	S	*	*			trans	90.7	135.7	140	-99.6	-178.8	174	-160.9	-6.8	123.1
223	C	23.1	Very low	27	Very low	114 Å²	114	135.8 Å²	135.8	77%	0.77	78%	0.778	S	S	*	*			trans	-77.7	-176.6	177.9	-44.8	0	0	0	0	112.1
224	E	26.4	Very low	26	Very low	168 Å²	168	138.4 Å²	138.4	79%	0.785	78%	0.782	S	S	*	*			cis	-171.2	164	49.1	-119.9	152.5	-122.9	0	0	107.2
225	L	27.8	Very low	26.1	Very low	143 Å²	143	137.8 Å²	137.8	75%	0.749	78%	0.779	S	S	*	*			cis	-160.5	159.3	-2.6	-161.1	57.6	0	0	0	104.3
226	D	25.8	Very low	26.3	Very low	120 Å²	120	139.5 Å²	139.5	64%	0.642	78%	0.783	S	S	*	*			cis	-165	165	35.4	-155.7	-7.3	0	0	0	113
227	T	23.9	Very low	26.3	Very low	128 Å²	128	143.4 Å²	143.4	79%	0.785	79%	0.786	S	S	*	*			trans	60.2	123.5	167.2	53.9	0	0	0	0	119.4
228	S	26.5	Very low	26.3	Very low	109 Å²	109	146.4 Å²	146.4	76%	0.762	79%	0.789	S	S	*	*			trans	-162	138.7	178.3	176.7	0	0	0	0	110.5
229	E	22.9	Very low	26.6	Very low	194 Å²	194	147.8 Å²	147.8	91%	0.907	79%	0.788	S	S	*	*			trans	-145.7	126.1	146.7	-73.7	-157.7	150.5	0	0	109.6
230	H	28.4	Very low	27	Very low	157 Å²	157	148.9 Å²	148.9	73%	0.727	78%	0.78	S	S	*	*			trans	-153.2	114.4	178.1	-145.7	64.7	0	0	0	106.4
231	L	28.9	Very low	26.9	Very low	135 Å²	135	149.9 Å²	149.9	71%	0.707	78%	0.776	S	S	*	*				48	91.8	87.9	-61.8	180	0	0	0	113.8
232	M	25.5	Very low	26	Very low	173 Å²	173	150.7 Å²	150.7	85%	0.852	77%	0.774	S	S	*	*				166.3	146.8	108.4	-87.1	-58.7	-162.6	0	0	113.5
233	A	36.3	Very low	26	Very low	84 Å²	84	147.9 Å²	147.9	69%	0.694	77%	0.771	S	S	*	*			trans	69.9	172.1	156.9	0	0	0	0	0	119.4
234	E	22.6	Very low	26.4	Very low	161 Å²	161	150.9 Å²	150.9	75%	0.752	77%	0.774	S	S	*	*			trans	58.8	147	-159.4	-35.3	-47.5	163.2	0	0	113.5
235	E	25	Very low	26.3	Very low	168 Å²	168	150.4 Å²	150.4	79%	0.785	77%	0.772	S	S	*	*			cis	-158.1	153.3	-19.7	-114	177.5	148.5	0	0	105.4
236	D	25.9	Very low	26.2	Very low	174 Å²	174	150.9 Å²	150.9	93%	0.93	78%	0.775	S	S	*	*			trans	175.2	103.4	154.4	-99.5	-21.4	0	0	0	111.2
237	E	24.7	Very low	26.2	Very low	172 Å²	172	152 Å²	152	80%	0.804	78%	0.777	S	S	*	*			trans	-137.9	152.3	160.3	-104.9	-71.9	-158.3	0	0	108.7
238	E	21.7	Very low	26.2	Very low	161 Å²	161	150.8 Å²	150.8	75%	0.752	77%	0.773	S	S	*	*			trans	54	104.4	175.2	-57.9	-160.3	106.8	0	0	120.4
239	F	30.8	Very low	26	Very low	193 Å²	193	153.9 Å²	153.9	85%	0.846	78%	0.776	S	S	*	*				30.5	137.5	124.3	-62.7	-74.4	0	0	0	120.6
240	P	31.6	Very low	26	Very low	104 Å²	104	150 Å²	150	68%	0.675	76%	0.762	S	S	*	*				-156.5	169.5	86.7	41.9	-23.9	0	0	0	118.7
241	N	20.9	Very low	25.9	Very low	139 Å²	139	152.2 Å²	152.2	74%	0.743	76%	0.763	S	S	*	*			trans	59.7	135.1	153.8	-57.5	-20.2	0	0	0	119.3
242	N	22.6	Very low	25.6	Very low	131 Å²	131	153.8 Å²	153.8	70%	0.701	77%	0.769	S	S	*	*			cis	73.6	119.1	37.7	-61.2	-15.7	0	0	0	115.1
243	E	25.2	Very low	25.7	Very low	177 Å²	177	150.9 Å²	150.9	83%	0.827	77%	0.766	S	S	*	*			trans	66.4	151.8	150.9	-67.2	159.2	-168.4	0	0	116
244	E	30.6	Very low	25.3	Very low	178 Å²	178	150 Å²	150	83%	0.832	77%	0.766	S	S	*	*			cis	-152.4	-147.8	-7.5	-137.8	-178.6	-176.1	0	0	110.2
245	E	24.9	Very low	25.4	Very low	157 Å²	157	149 Å²	149	73%	0.734	77%	0.77	S	S	*	*			trans	72.6	122.2	174.7	-49.4	-162.5	137.1	0	0	115.9
246	D	25.3	Very low	25.4	Very low	154 Å²	154	146 Å²	146	82%	0.824	77%	0.768	S	S	*	*			cis	78.9	159	27.4	-156.9	22.8	0	0	0	115.2
247	Q	26.3	Very low	25.5	Very low	143 Å²	143	143.3 Å²	143.3	67%	0.668	76%	0.763	S	S	*	*			trans	75.7	144	-172.1	-48.9	173.8	57.3	0	0	114.8
248	S	23.5	Very low	26.3	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	76%	0.755	S	S	*	*			cis	-160.2	-176.6	-23.7	59.6	0	0	0	0	110.9
249	Q	22.8	Very low	26.4	Very low	173 Å²	173	140.5 Å²	140.5	81%	0.808	76%	0.758	S	S	*	*			trans	-33.2	157.6	172.9	-68.1	149	-3.6	0	0	116.8
250	D	23.4	Very low	26.1	Very low	114 Å²	114	136.4 Å²	136.4	61%	0.61	75%	0.753	S	S	*	*			cis	-160.4	147.1	35.5	-144.5	8.7	0	0	0	117.4
251	R	24.5	Very low	26.4	Very low	202 Å²	202	135.9 Å²	135.9	76%	0.762	75%	0.75	S	S	*	*			trans	31.9	127.2	144.4	-77.8	168.7	178.4	167.3	-4.3	126.2
252	M	24.1	Very low	26.7	Very low	168 Å²	168	140.1 Å²	140.1	83%	0.828	76%	0.757	S	S	*	*				69.7	153.5	120.8	-56.1	-98.1	-76.9	0	0	119.5
253	S	27.6	Very low	26.9	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	76%	0.759	S	S	*	*			cis	-144.5	162.8	10.5	-49.3	0	0	0	0	111.5
254	G	26.4	Very low	26.8	Very low	67 Å²	67	135.2 Å²	135.2	69%	0.691	75%	0.754	S	S	*	*			trans	-155	-6.4	-178.1	0	0	0	0	0	122.4
255	T	26.5	Very low	26.6	Very low	138 Å²	138	133.5 Å²	133.5	85%	0.847	75%	0.747	S	S	*	*			trans	75.7	147.9	170.7	70	0	0	0	0	121.8
256	S	25	Very low	26.6	Very low	107 Å²	107	134.5 Å²	134.5	75%	0.748	75%	0.745	S	S	*	*			trans	60.8	91.7	160.2	49.2	0	0	0	0	123.3
257	S	26.1	Very low	26.6	Very low	117 Å²	117	134.8 Å²	134.8	82%	0.818	74%	0.741	S	S	*	*				25.2	161.3	100.2	-108.4	0	0	0	0	121.8
258	P	42.3	Very low	26.6	Very low	97 Å²	97	131.4 Å²	131.4	63%	0.63	74%	0.744	S	S	*	*			cis	-142.4	-173.7	7.5	41.7	-21.7	0	0	0	118.2
259	Q	24.7	Very low	26.7	Very low	176 Å²	176	138.6 Å²	138.6	82%	0.822	76%	0.756	S	S	*	*			trans	73.5	119.2	159.8	-74.4	164.8	-85.7	0	0	118.9
260	S	24.4	Very low	26.9	Very low	107 Å²	107	134.9 Å²	134.9	75%	0.748	76%	0.755	S	S	*	*			cis	72.9	144.7	22.4	-152.1	0	0	0	0	114.6
261	P	37.7	Very low	27	Very low	94 Å²	94	134.7 Å²	134.7	61%	0.61	76%	0.762	S	S	*	*			cis	-136.3	-173.7	10.8	24	2.8	0	0	0	117.3
262	Y	27.2	Very low	27.2	Very low	228 Å²	228	132.5 Å²	132.5	89%	0.894	76%	0.764	S	S	*	*			trans	81.9	135	164.8	-61.6	-74.1	0	0	0	119.3
263	G	26.4	Very low	27.2	Very low	72 Å²	72	134.2 Å²	134.2	74%	0.742	77%	0.767	S	S	*	*			cis	-169.6	93.3	0.9	0	0	0	0	0	115.6
264	D	23.7	Very low	27	Very low	133 Å²	133	136.6 Å²	136.6	71%	0.711	77%	0.766	S	S	*	*			trans	-35.7	136.8	164.8	179.4	33	0	0	0	118.2
265	M	25.3	Very low	26.9	Very low	141 Å²	141	136.9 Å²	136.9	70%	0.695	76%	0.762	S	S	*	*				178.6	131.9	119.1	-98.9	-72	166.8	0	0	116.6
266	R	26.3	Very low	26.7	Very low	179 Å²	179	139.3 Å²	139.3	68%	0.675	76%	0.764	S	S	*	*			trans	67.5	97.5	146.1	-88.5	167.5	165.7	-67.6	-28.3	123.5
267	E	23.8	Very low	26.7	Very low	159 Å²	159	137.8 Å²	137.8	74%	0.743	76%	0.757	S	S	*	*				63.4	110.8	102.9	-169.9	175	-99.8	0	0	119.8
268	G	25.9	Very low	26.6	Very low	72 Å²	72	139.7 Å²	139.7	74%	0.742	76%	0.757	S	S	*	*			trans	174.1	62.9	169.7	0	0	0	0	0	121.1
269	R	27.2	Very low	25.7	Very low	255 Å²	255	144.7 Å²	144.7	96%	0.962	76%	0.764	S	S	*	*			trans	59.7	153.2	160.7	-71.6	-177.4	171.5	-176.1	-3.2	120.1
270	A	26.5	Very low	25.7	Very low	95 Å²	95	142.8 Å²	142.8	79%	0.785	76%	0.759	S	S	*	*			trans	-61.6	127.2	-173.9	0	0	0	0	0	115.6
271	S	24.6	Very low	25.7	Very low	109 Å²	109	144.8 Å²	144.8	76%	0.762	76%	0.761	S	S	*	*				30.3	133.6	106.2	-132.7	0	0	0	0	117.7
272	I	28.4	Very low	25.2	Very low	157 Å²	157	143 Å²	143	81%	0.805	76%	0.759	S	S	*	*			cis	-127.6	144.8	14.3	-67.5	169.6	0	0	0	109.9
273	F	24.2	Very low	25.1	Very low	203 Å²	203	144.6 Å²	144.6	89%	0.89	76%	0.764	S	S	*	*			trans	-107	176.1	-179.4	-128.2	-92.1	0	0	0	114.4
274	Q	23.9	Very low	25.1	Very low	162 Å²	162	145.7 Å²	145.7	76%	0.757	77%	0.766	S	S	*	*			trans	-104.4	137.6	-166.2	174.6	-179.3	9.2	0	0	112.9
275	A	24.4	Very low	25.4	Very low	73 Å²	73	148.1 Å²	148.1	60%	0.603	78%	0.778	S	S	*	*			trans	60.3	153.7	151.3	0	0	0	0	0	122.5
276	E	22.9	Very low	25.5	Very low	190 Å²	190	144.6 Å²	144.6	89%	0.888	78%	0.778	S	S	*	*			trans	63.4	159.2	152.4	-70.8	169	120	0	0	119.3
277	A	25.2	Very low	25.5	Very low	75 Å²	75	144.5 Å²	144.5	62%	0.62	79%	0.79	S	S	*	*			cis	-167.9	-179	-29.7	0	0	0	0	0	109.3
278	L	23.5	Very low	25.7	Very low	156 Å²	156	145.7 Å²	145.7	82%	0.817	80%	0.795	S	S	*	*			trans	76.8	147.6	169.4	-44	170.6	0	0	0	116
279	R	24	Very low	26.1	Very low	202 Å²	202	148.1 Å²	148.1	76%	0.762	79%	0.791	S	S	*	*			cis	-168	150.6	-17.8	-114.5	-172	174.7	-162.7	-2.2	111.1
280	L	23.2	Very low	26.1	Very low	137 Å²	137	146.9 Å²	146.9	72%	0.717	79%	0.786	S	S	*	*			trans	57.6	150.2	152.1	-91.6	59.3	0	0	0	118.8
281	D	26.3	Very low	26.5	Very low	149 Å²	149	145 Å²	145	80%	0.797	78%	0.776	S	S	*	*			cis	-161.5	166.4	-15	-141.7	-7.5	0	0	0	106.3
282	G	25.7	Very low	26.8	Very low	56 Å²	56	147.5 Å²	147.5	58%	0.577	78%	0.78	S	S	*	*			cis	-159.5	-149.8	0.3	0	0	0	0	0	108.8
283	W	25.1	Very low	27.4	Very low	262 Å²	262	146 Å²	146	99%	0.992	77%	0.774	S	S	*	*			cis	-127.5	165	2.3	-56.6	-52.4	0	0	0	110.2
284	A	27.6	Very low	27.8	Very low	95 Å²	95	144.1 Å²	144.1	79%	0.785	77%	0.769	S	S	*	*			trans	-136.3	141.5	-178.4	0	0	0	0	0	114.7
285	L	29.7	Very low	28.6	Very low	184 Å²	184	141.6 Å²	141.6	96%	0.963	77%	0.77	S	S	*	*			trans	-149	126.9	160.3	-66.9	175.2	0	0	0	106.9
286	G	27.4	Very low	29.2	Very low	67 Å²	67	148.5 Å²	148.5	69%	0.691	78%	0.78	S	S	*	*			cis	142	110.6	-13.8	0	0	0	0	0	112.7
287	L	26.9	Very low	29.8	Very low	176 Å²	176	142.5 Å²	142.5	92%	0.921	77%	0.77	S	S	*	*			trans	-169.8	118.6	136.6	-127.8	74.2	0	0	0	114.1
288	H	28.1	Very low	30.9	Very low	184 Å²	184	150.4 Å²	150.4	85%	0.852	78%	0.784	S	S	*	*			trans	49	125.1	148.6	-126.8	-71.9	0	0	0	124
289	D	32.5	Very low	32.2	Very low	124 Å²	124	148.2 Å²	148.2	66%	0.663	78%	0.776	S	S	*	*			trans	-77.2	160.8	165.5	165.8	55.1	0	0	0	113.4	G291	D289-G291 PolarHBondContact OD1-N 3.26Å; D289-G291 PolarHBondContact OD2-N 2.96Å
290	R	27.4	Very low	33.7	Very low	228 Å²	228	145.7 Å²	145.7	86%	0.86	78%	0.778	S	S	*	*			trans	-154.6	56.2	153.3	-141.9	179.1	-153.3	-99.1	2.9	113.2
291	G	35.8	Very low	35.6	Very low	55 Å²	55	143 Å²	143	57%	0.567	76%	0.764	S	S	*	*			trans	-58.3	142.6	172.1	0	0	0	0	0	112.7	D289	D289-G291 PolarHBondContact OD1-N 3.26Å; D289-G291 PolarHBondContact OD2-N 2.96Å
292	L	31.1	Very low	37.7	Very low	163 Å²	163	139 Å²	139	85%	0.853	75%	0.747	S	S	*	*			trans	-132	130.2	157.5	-81.6	-179.4	0	0	0	109.8
293	D	40	Very low	39.7	Very low	126 Å²	126	143.1 Å²	143.1	67%	0.674	76%	0.755	S	S	*	*			trans	-34.1	134.6	176.1	178.3	34.7	0	0	0	115.6	S295	D293-S295 WeakPolarHBondContact OD1-CB 3.38Å; D293-S295 PolarHBondContact OD1-N 3.19Å; D293-S295 PolarHBondContact OD1-OG 3.18Å
294	M	33.6	Very low	41.4	Very low	162 Å²	162	136.2 Å²	136.2	80%	0.798	74%	0.737	S	S	*	*			trans	-139.8	55.1	154.6	-139.8	177.8	73	0	0	112.4	R296	M294-R296 HydrophobicContact CG-CB 4.11Å; M294-R296 PolarHBondContact O-N 3.28Å
295	S	40.5	Very low	43.3	Very low	109 Å²	109	136.4 Å²	136.4	76%	0.762	72%	0.722	S	S	*	*			trans	-64.8	61.2	166.9	-56.2	0	0	0	0	111.7	D293	D293-S295 WeakPolarHBondContact OD1-CB 3.38Å; D293-S295 PolarHBondContact OD1-N 3.19Å; D293-S295 PolarHBondContact OD1-OG 3.18Å
296	R	36.6	Very low	45.3	Very low	218 Å²	218	132 Å²	132	82%	0.823	70%	0.697	S	S	*	*			trans	-113.3	76.4	-165.7	-155.9	174.7	-156	-144.4	2.4	114.3	M294	M294-R296 HydrophobicContact CG-CB 4.11Å; M294-R296 PolarHBondContact O-N 3.28Å
297	G	36.3	Very low	47.2	Very low	65 Å²	65	131.4 Å²	131.4	67%	0.67	69%	0.685	S	S	*	*			trans	79.3	120.8	153.4	0	0	0	0	0	116.4	V299	G297-V299 VanDerWaalsContact C-N 3.28Å; G297-V299 PolarHBondContact O-N 2.04Å
298	R	47.5	Very low	49.1	Very low	241 Å²	241	127.1 Å²	127.1	91%	0.909	66%	0.662	S	S	*	*			trans	-69.3	88.8	158.1	-76.8	-167.7	-69.8	-128.3	-0.3	109.4
299	V	50.5	Low	51.1	Low	110 Å²	110	120.4 Å²	120.4	67%	0.667	64%	0.639	S	S	*	*			trans	-72.1	121	155.2	-178.3	0	0	0	0	106.4	G297 L301	G297-V299 VanDerWaalsContact C-N 3.28Å; G297-V299 PolarHBondContact O-N 2.04Å; V299-L301 HydrophobicContact CG1-CD2 4.37Å; V299-L301 HydrophobicContact CG1-CG 4.34Å; V299-L301 PolarHBondContact O-N 3.19Å
300	N	55.3	Low	53	Low	149 Å²	149	120 Å²	120	80%	0.797	64%	0.635	S	S	*	*			trans	-75	75.5	172.4	-67.8	-28.5	0	0	0	108.8	S302	N300-S302 PolarHBondContact O-N 3.21Å
301	L	63.1	Low	54.8	Low	79 Å²	79	115.7 Å²	115.7	41%	0.414	63%	0.625	S	S	.	*			trans	-53.7	134.9	170.1	-70.5	165.3	0	0	0	109	V299 E305 Q306	V299-L301 HydrophobicContact CG1-CD2 4.37Å; V299-L301 HydrophobicContact CG1-CG 4.34Å; V299-L301 PolarHBondContact O-N 3.19Å; L301-E305 HydrophobicContact CB-CB 4.09Å; L301-E305 HydrophobicContact CD2-CB 4.01Å; L301-Q306 HydrophobicContact CB-CG 3.76Å
302	S	72.1	Confident	56.1	Low	65 Å²	65	116.2 Å²	116.2	46%	0.455	62%	0.618	S	S	.	*			trans	-56.5	152.1	173.7	178.3	0	0	0	0	110.5	N300 L304 E305 Q306	N300-S302 PolarHBondContact O-N 3.21Å; S302-L304 PolarHBondContact O-N 3.33Å; S302-E305 WeakPolarHBondContact CB-OE2 3.45Å; S302-E305 PolarHBondContact N-OE2 2.7Å; S302-E305 CarbonylContact O-C 3.59Å; S302-E305 WeakPolarHBondContact O-CA 3.44Å; S302-E305 WeakPolarHBondContact O-CB 3.32Å; S302-E305 PolarHBondContact O-N 3.23Å; S302-Q306 PolarHBondContact O-N 2.64Å
303	L	67.6	Low	57.8	Low	143 Å²	143	114.7 Å²	114.7	75%	0.749	61%	0.606	S	S	*	*	H	α-helix	trans	-52.2	-33.1	174.5	-77.9	167.8	0	0	0	112.2	A307	L303-A307 VanDerWaalsContact O-CB 3.26Å; L303-A307 WeakPolarHBondContact O-CB 3.31Å; L303-A307 PolarHBondContact O-N 3.21Å
304	L	60	Low	59	Low	117 Å²	117	114.8 Å²	114.8	61%	0.613	60%	0.603	S	S	*	*	H	α-helix	trans	-68.3	-40.9	173.9	-179.7	59.9	0	0	0	112.5	S302 A307 I308	S302-L304 PolarHBondContact O-N 3.33Å; L304-A307 PolarHBondContact O-N 3Å; L304-I308 HydrophobicContact CD1-CD1 4.06Å; L304-I308 HydrophobicContact CD1-CG1 4.42Å; L304-I308 HydrophobicContact CG-CD1 3.97Å; L304-I308 WeakPolarHBondContact O-CB 3.49Å; L304-I308 WeakPolarHBondContact O-CD1 3.21Å; L304-I308 WeakPolarHBondContact O-CG1 3.47Å; L304-I308 PolarHBondContact O-N 3.02Å
305	E	68.3	Low	60.1	Low	100 Å²	100	116.6 Å²	116.6	47%	0.467	60%	0.6	S	S	.	*	H	α-helix	trans	-71.8	-36.3	178.5	-63.9	173	125	0	0	111.5	L301 S302 I308 A309	L301-E305 HydrophobicContact CB-CB 4.09Å; L301-E305 HydrophobicContact CD2-CB 4.01Å; S302-E305 WeakPolarHBondContact CB-OE2 3.45Å; S302-E305 PolarHBondContact N-OE2 2.7Å; S302-E305 CarbonylContact O-C 3.59Å; S302-E305 WeakPolarHBondContact O-CA 3.44Å; S302-E305 WeakPolarHBondContact O-CB 3.32Å; S302-E305 PolarHBondContact O-N 3.23Å; E305-I308 PolarHBondContact O-N 3.03Å; E305-A309 VanDerWaalsContact O-CB 3.31Å; E305-A309 WeakPolarHBondContact O-CB 3.5Å; E305-A309 PolarHBondContact O-N 3.33Å
306	Q	71.4	Confident	61.3	Low	92 Å²	92	117.8 Å²	117.8	43%	0.43	59%	0.594	S	S	.	*	H	α-helix	trans	-65.5	-42.9	171.1	-68.1	-173.6	-29.8	0	0	111.6	L301 S302 A309 L310	L301-Q306 HydrophobicContact CB-CG 3.76Å; S302-Q306 PolarHBondContact O-N 2.64Å; Q306-A309 PolarHBondContact O-N 2.99Å; Q306-L310 WeakPolarHBondContact O-CB 3.49Å; Q306-L310 WeakPolarHBondContact O-CG 3.22Å; Q306-L310 PolarHBondContact O-N 3.1Å
307	A	65.6	Low	62.8	Low	53 Å²	53	110.3 Å²	110.3	44%	0.438	58%	0.579	S	S	.	*	H	α-helix	trans	-62.8	-42.5	174.5	0	0	0	0	0	112	L303 L304 Q311	L303-A307 VanDerWaalsContact O-CB 3.26Å; L303-A307 WeakPolarHBondContact O-CB 3.31Å; L303-A307 PolarHBondContact O-N 3.21Å; L304-A307 PolarHBondContact O-N 3Å; A307-Q311 WeakPolarHBondContact O-CB 3.43Å; A307-Q311 PolarHBondContact O-N 2.83Å
308	I	67.9	Low	64.2	Low	87 Å²	87	112.1 Å²	112.1	45%	0.446	57%	0.573	S	S	.	*	H	α-helix	trans	-63.8	-45.1	174.6	-70.8	164.4	0	0	0	110.6	L304 E305 Q311 T312	L304-I308 HydrophobicContact CD1-CD1 4.06Å; L304-I308 HydrophobicContact CD1-CG1 4.42Å; L304-I308 HydrophobicContact CG-CD1 3.97Å; L304-I308 WeakPolarHBondContact O-CB 3.49Å; L304-I308 WeakPolarHBondContact O-CD1 3.21Å; L304-I308 WeakPolarHBondContact O-CG1 3.47Å; L304-I308 PolarHBondContact O-N 3.02Å; E305-I308 PolarHBondContact O-N 3.03Å; I308-Q311 PolarHBondContact O-N 3.45Å; I308-T312 HydrophobicContact CG2-CG2 4.31Å; I308-T312 WeakPolarHBondContact O-CG2 3.37Å; I308-T312 PolarHBondContact O-N 3.4Å; I308-T312 PolarHBondContact O-OG1 3.44Å
309	A	70.8	Confident	64.8	Low	43 Å²	43	106.4 Å²	106.4	36%	0.355	56%	0.556	S	S	.	*	H	α-helix	trans	-56.8	-55.4	176.9	0	0	0	0	0	111	E305 Q306 Q311 T312 E313	E305-A309 VanDerWaalsContact O-CB 3.31Å; E305-A309 WeakPolarHBondContact O-CB 3.5Å; E305-A309 PolarHBondContact O-N 3.33Å; Q306-A309 PolarHBondContact O-N 2.99Å; A309-Q311 VanDerWaalsContact C-N 3.33Å; A309-Q311 PolarHBondContact O-N 3.4Å; A309-T312 PolarHBondContact O-N 2.85Å; A309-T312 VanDerWaalsContact O-N 3.13Å; A309-T312 PolarHBondContact O-OG1 3.38Å; A309-E313 WeakPolarHBondContact O-CB 3.49Å; A309-E313 PolarHBondContact O-N 3.45Å
310	L	71.9	Confident	65.5	Low	114 Å²	114	106.8 Å²	106.8	60%	0.597	55%	0.55	S	S	*	*	H	α-helix	trans	-58.6	-40.3	177.7	-70.9	168.4	0	0	0	112.6	Q306 E313 Q314	Q306-L310 WeakPolarHBondContact O-CB 3.49Å; Q306-L310 WeakPolarHBondContact O-CG 3.22Å; Q306-L310 PolarHBondContact O-N 3.1Å; L310-E313 PolarHBondContact O-N 2.87Å; L310-Q314 VanDerWaalsContact O-CB 3.29Å; L310-Q314 WeakPolarHBondContact O-CB 3.37Å; L310-Q314 PolarHBondContact O-N 2.87Å
311	Q	65.5	Low	66.2	Low	138 Å²	138	102 Å²	102	65%	0.645	53%	0.531	S	S	*	.	H	α-helix	trans	-71.1	-33.6	178.1	-166.2	175.8	53.9	0	0	112.2	A307 I308 A309 R315	A307-Q311 WeakPolarHBondContact O-CB 3.43Å; A307-Q311 PolarHBondContact O-N 2.83Å; I308-Q311 PolarHBondContact O-N 3.45Å; A309-Q311 VanDerWaalsContact C-N 3.33Å; A309-Q311 PolarHBondContact O-N 3.4Å; Q311-R315 WeakPolarHBondContact O-CB 3.18Å; Q311-R315 PolarHBondContact O-N 2.84Å
312	T	62.4	Low	66.3	Low	67 Å²	67	106 Å²	106	41%	0.411	54%	0.542	S	S	.	.	H	α-helix	trans	-71.3	-37.2	171.5	59.9	0	0	0	0	112.3	I308 A309 R315 Q316	I308-T312 HydrophobicContact CG2-CG2 4.31Å; I308-T312 WeakPolarHBondContact O-CG2 3.37Å; I308-T312 PolarHBondContact O-N 3.4Å; I308-T312 PolarHBondContact O-OG1 3.44Å; A309-T312 PolarHBondContact O-N 2.85Å; A309-T312 VanDerWaalsContact O-N 3.13Å; A309-T312 PolarHBondContact O-OG1 3.38Å; T312-R315 PolarHBondContact O-N 2.85Å; T312-Q316 WeakPolarHBondContact O-CB 3.48Å; T312-Q316 VanDerWaalsContact O-CG 3.24Å; T312-Q316 WeakPolarHBondContact O-CG 3.47Å; T312-Q316 PolarHBondContact O-N 2.94Å
313	E	67	Low	66	Low	130 Å²	130	110.3 Å²	110.3	61%	0.607	55%	0.549	S	S	*	.	H	α-helix	trans	-67.8	-46.5	176.4	-173.3	171.5	-162	0	0	111	A309 L310 R315 Q316 A317	A309-E313 WeakPolarHBondContact O-CB 3.49Å; A309-E313 PolarHBondContact O-N 3.45Å; L310-E313 PolarHBondContact O-N 2.87Å; E313-R315 VanDerWaalsContact C-N 3.31Å; E313-R315 PolarHBondContact O-N 3.44Å; E313-Q316 CarbonylContact O-C 3.51Å; E313-Q316 PolarHBondContact O-N 2.86Å; E313-Q316 VanDerWaalsContact O-N 3.13Å; E313-A317 WeakPolarHBondContact O-CB 3.19Å; E313-A317 PolarHBondContact O-N 2.9Å
314	Q	65.9	Low	66.1	Low	129 Å²	129	106.7 Å²	106.7	60%	0.603	53%	0.528	S	S	*	.	H	α-helix	trans	-59.1	-42	173.2	-169.9	-176.5	45.3	0	0	111.6	L310 A317 L318	L310-Q314 VanDerWaalsContact O-CB 3.29Å; L310-Q314 WeakPolarHBondContact O-CB 3.37Å; L310-Q314 PolarHBondContact O-N 2.87Å; Q314-A317 PolarHBondContact O-N 2.93Å; Q314-L318 HydrophobicContact CG-CD1 4.48Å; Q314-L318 WeakPolarHBondContact O-CB 3.44Å; Q314-L318 WeakPolarHBondContact O-CG 3.45Å; Q314-L318 PolarHBondContact O-N 3.35Å
315	R	56.7	Low	66.4	Low	199 Å²	199	105.8 Å²	105.8	75%	0.751	52%	0.522	S	S	*	.	H	α-helix	trans	-67.2	-36.4	175.4	-173	174.5	-178.2	173.3	1.1	112.4	Q311 T312 E313 H319	Q311-R315 WeakPolarHBondContact O-CB 3.18Å; Q311-R315 PolarHBondContact O-N 2.84Å; T312-R315 PolarHBondContact O-N 2.85Å; E313-R315 VanDerWaalsContact C-N 3.31Å; E313-R315 PolarHBondContact O-N 3.44Å; R315-H319 WeakPolarHBondContact O-CB 3.32Å; R315-H319 PolarHBondContact O-N 3.07Å
316	Q	63.9	Low	66.2	Low	134 Å²	134	105.7 Å²	105.7	63%	0.626	52%	0.524	S	S	*	.	H	α-helix	trans	-70.1	-40.1	174.5	-76.9	178.2	35.5	0	0	111.7	T312 E313 H319 H320	T312-Q316 WeakPolarHBondContact O-CB 3.48Å; T312-Q316 VanDerWaalsContact O-CG 3.24Å; T312-Q316 WeakPolarHBondContact O-CG 3.47Å; T312-Q316 PolarHBondContact O-N 2.94Å; E313-Q316 CarbonylContact O-C 3.51Å; E313-Q316 PolarHBondContact O-N 2.86Å; E313-Q316 VanDerWaalsContact O-N 3.13Å; Q316-H319 CarbonylContact O-C 3.27Å; Q316-H319 PolarHBondContact O-N 2.9Å; Q316-H320 VanDerWaalsContact O-CB 3.23Å; Q316-H320 WeakPolarHBondContact O-CB 3.34Å; Q316-H320 PolarHBondContact O-N 3.24Å
317	A	68.3	Low	66.1	Low	61 Å²	61	108.1 Å²	108.1	50%	0.504	53%	0.529	S	S	.	.	H	α-helix	trans	-63.1	-45	175.2	0	0	0	0	0	111.7	E313 Q314 H320 A321	E313-A317 WeakPolarHBondContact O-CB 3.19Å; E313-A317 PolarHBondContact O-N 2.9Å; Q314-A317 PolarHBondContact O-N 2.93Å; A317-H320 PolarHBondContact O-N 3.36Å; A317-A321 WeakPolarHBondContact O-CB 3.33Å; A317-A321 PolarHBondContact O-N 3.09Å
318	L	66.4	Low	66.7	Low	103 Å²	103	112 Å²	112	54%	0.539	54%	0.537	S	S	.	.	H	α-helix	trans	-62.6	-45.4	172.8	-72.1	170.4	0	0	0	111.7	Q314 H320 A321 Y322	Q314-L318 HydrophobicContact CG-CD1 4.48Å; Q314-L318 WeakPolarHBondContact O-CB 3.44Å; Q314-L318 WeakPolarHBondContact O-CG 3.45Å; Q314-L318 PolarHBondContact O-N 3.35Å; L318-H320 VanDerWaalsContact C-N 3.3Å; L318-H320 PolarHBondContact O-N 3.32Å; L318-A321 PolarHBondContact O-N 2.77Å; L318-Y322 WeakPolarHBondContact O-CD2 3.21Å; L318-Y322 PolarHBondContact O-N 2.85Å
319	H	59.7	Low	66.7	Low	121 Å²	121	112.7 Å²	112.7	56%	0.56	54%	0.541	S	S	*	.	H	α-helix	trans	-66.2	-31.4	177.4	-172.3	-94.7	0	0	0	112.5	R315 Q316 R323	R315-H319 WeakPolarHBondContact O-CB 3.32Å; R315-H319 PolarHBondContact O-N 3.07Å; Q316-H319 CarbonylContact O-C 3.27Å; Q316-H319 PolarHBondContact O-N 2.9Å; H319-R323 WeakPolarHBondContact O-CB 3.28Å; H319-R323 VanDerWaalsContact O-CG 3.24Å; H319-R323 WeakPolarHBondContact O-CG 3.21Å; H319-R323 PolarHBondContact O-N 3.37Å
320	H	64.6	Low	66.6	Low	118 Å²	118	116 Å²	116	55%	0.546	55%	0.552	S	S	.	*	H	α-helix	trans	-69.8	-43.7	172.3	-170.3	-76.1	0	0	0	111.1	Q316 A317 L318 Y322 R323 E324	Q316-H320 VanDerWaalsContact O-CB 3.23Å; Q316-H320 WeakPolarHBondContact O-CB 3.34Å; Q316-H320 PolarHBondContact O-N 3.24Å; A317-H320 PolarHBondContact O-N 3.36Å; L318-H320 VanDerWaalsContact C-N 3.3Å; L318-H320 PolarHBondContact O-N 3.32Å; H320-Y322 PolarHBondContact O-N 3.4Å; H320-R323 WeakPolarHBondContact O-CB 3.44Å; H320-R323 PolarHBondContact O-N 3.32Å; H320-E324 WeakPolarHBondContact O-CG 3.34Å; H320-E324 PolarHBondContact O-N 3.27Å
321	A	70.5	Confident	66.4	Low	49 Å²	49	115.2 Å²	115.2	41%	0.405	55%	0.545	S	S	.	.	H	α-helix	trans	-60.1	-43.8	174.2	0	0	0	0	0	111.8	A317 L318 E324 M325	A317-A321 WeakPolarHBondContact O-CB 3.33Å; A317-A321 PolarHBondContact O-N 3.09Å; L318-A321 PolarHBondContact O-N 2.77Å; A321-E324 PolarHBondContact O-N 3.35Å; A321-M325 WeakPolarHBondContact O-CG 3.45Å; A321-M325 PolarHBondContact O-N 3.19Å
322	Y	65.7	Low	66.4	Low	163 Å²	163	113.3 Å²	113.3	64%	0.639	54%	0.536	S	S	*	.	H	α-helix	trans	-64.4	-40.9	173.1	-90.6	-85.4	0	0	0	112.8	L318 H320 E324 M325 D326	L318-Y322 WeakPolarHBondContact O-CD2 3.21Å; L318-Y322 PolarHBondContact O-N 2.85Å; H320-Y322 PolarHBondContact O-N 3.4Å; Y322-E324 VanDerWaalsContact C-N 3.34Å; Y322-E324 PolarHBondContact O-N 2.8Å; Y322-M325 HydrophobicContact CD1-CE 3.78Å; Y322-M325 HydrophobicContact CD2-CE 4.35Å; Y322-M325 HydrophobicContact CE1-CE 3.92Å; Y322-M325 HydrophobicContact CE2-CE 4.47Å; Y322-M325 HydrophobicContact CG-CE 4.02Å; Y322-M325 PolarHBondContact O-N 3.22Å; Y322-D326 WeakPolarHBondContact O-CB 3.34Å; Y322-D326 PolarHBondContact O-N 2.92Å
323	R	65.7	Low	66.1	Low	156 Å²	156	115.8 Å²	115.8	59%	0.589	54%	0.544	S	S	*	.	H	α-helix	trans	-59.3	-41.5	172.4	-83	-74.6	-149.1	-168.4	2.8	112.6	H319 H320 R327	H319-R323 WeakPolarHBondContact O-CB 3.28Å; H319-R323 VanDerWaalsContact O-CG 3.24Å; H319-R323 WeakPolarHBondContact O-CG 3.21Å; H319-R323 PolarHBondContact O-N 3.37Å; H320-R323 WeakPolarHBondContact O-CB 3.44Å; H320-R323 PolarHBondContact O-N 3.32Å; R323-R327 VanDerWaalsContact O-CB 3.29Å; R323-R327 WeakPolarHBondContact O-CB 3.45Å; R323-R327 PolarHBondContact O-N 2.84Å
324	E	69.1	Low	66	Low	67 Å²	67	112.3 Å²	112.3	31%	0.313	53%	0.532	S	S	.	.	H	α-helix	trans	-74	-35.3	179.2	-71.3	-53.4	112.6	0	0	112.4	H320 A321 Y322 R327 F328	H320-E324 WeakPolarHBondContact O-CG 3.34Å; H320-E324 PolarHBondContact O-N 3.27Å; A321-E324 PolarHBondContact O-N 3.35Å; Y322-E324 VanDerWaalsContact C-N 3.34Å; Y322-E324 PolarHBondContact O-N 2.8Å; E324-R327 VanDerWaalsContact CD-NE 3.33Å; E324-R327 IonicContact OE1-CZ 2.61Å; E324-R327 IonicContact OE1-NE 2.7Å; E324-R327 PolarHBondContact OE1-NE 2.88Å; E324-R327 IonicContact OE1-NH2 3.74Å; E324-R327 PolarHBondContact OE1-NH2 2.99Å; E324-R327 IonicContact OE2-NE 3.8Å; E324-R327 PolarHBondContact OE2-NE 2.83Å; E324-R327 VanDerWaalsContact OE2-NE 3.12Å; E324-F328 WeakPolarHBondContact O-CB 3.15Å; E324-F328 PolarHBondContact O-N 3.28Å
325	M	66.1	Low	65.7	Low	98 Å²	98	108.4 Å²	108.4	48%	0.483	52%	0.519	S	S	.	.	H	α-helix	trans	-64.4	-43.8	170.5	-71.4	-168	-58.2	0	0	111.9	A321 Y322 F328 L329	A321-M325 WeakPolarHBondContact O-CG 3.45Å; A321-M325 PolarHBondContact O-N 3.19Å; Y322-M325 HydrophobicContact CD1-CE 3.78Å; Y322-M325 HydrophobicContact CD2-CE 4.35Å; Y322-M325 HydrophobicContact CE1-CE 3.92Å; Y322-M325 HydrophobicContact CE2-CE 4.47Å; Y322-M325 HydrophobicContact CG-CE 4.02Å; Y322-M325 PolarHBondContact O-N 3.22Å; M325-F328 PolarHBondContact O-N 2.76Å; M325-L329 WeakPolarHBondContact O-CB 3.47Å; M325-L329 VanDerWaalsContact O-CG 3.31Å; M325-L329 WeakPolarHBondContact O-CG 3.24Å; M325-L329 PolarHBondContact O-N 3.37Å
326	D	64.4	Low	65.7	Low	97 Å²	97	104.2 Å²	104.2	52%	0.519	51%	0.508	S	S	.	.	H	α-helix	trans	-64.2	-43.8	176.3	-173.8	48.8	0	0	0	111.3	Y322 F328 L329 L330	Y322-D326 WeakPolarHBondContact O-CB 3.34Å; Y322-D326 PolarHBondContact O-N 2.92Å; D326-F328 PolarHBondContact O-N 3.18Å; D326-L329 PolarHBondContact O-N 3.09Å; D326-L330 VanDerWaalsContact O-CB 3.29Å; D326-L330 WeakPolarHBondContact O-CB 3.11Å; D326-L330 PolarHBondContact O-N 2.85Å
327	R	70.6	Confident	65.4	Low	143 Å²	143	105.5 Å²	105.5	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-56.7	-48.8	170.5	-171.6	-157.3	-56.5	-79.8	0.9	111.1	R323 E324 L330 E331	R323-R327 VanDerWaalsContact O-CB 3.29Å; R323-R327 WeakPolarHBondContact O-CB 3.45Å; R323-R327 PolarHBondContact O-N 2.84Å; E324-R327 VanDerWaalsContact CD-NE 3.33Å; E324-R327 IonicContact OE1-CZ 2.61Å; E324-R327 IonicContact OE1-NE 2.7Å; E324-R327 PolarHBondContact OE1-NE 2.88Å; E324-R327 IonicContact OE1-NH2 3.74Å; E324-R327 PolarHBondContact OE1-NH2 2.99Å; E324-R327 IonicContact OE2-NE 3.8Å; E324-R327 PolarHBondContact OE2-NE 2.83Å; E324-R327 VanDerWaalsContact OE2-NE 3.12Å; R327-L330 PolarHBondContact O-N 2.9Å; R327-E331 VanDerWaalsContact O-CB 3.24Å; R327-E331 WeakPolarHBondContact O-CB 3.47Å; R327-E331 PolarHBondContact O-N 3.5Å
328	F	76.7	Confident	64.9	Low	135 Å²	135	108 Å²	108	59%	0.592	50%	0.504	S	S	*	.	H	α-helix	trans	-63.6	-43.1	-178.3	-179.7	-91.6	0	0	0	112.1	E324 M325 D326 E331 Q332	E324-F328 WeakPolarHBondContact O-CB 3.15Å; E324-F328 PolarHBondContact O-N 3.28Å; M325-F328 PolarHBondContact O-N 2.76Å; D326-F328 PolarHBondContact O-N 3.18Å; F328-E331 PolarHBondContact O-N 3.28Å; F328-Q332 VanDerWaalsContact O-CB 3.3Å; F328-Q332 WeakPolarHBondContact O-CB 3.28Å; F328-Q332 PolarHBondContact O-N 3.49Å
329	L	69.4	Low	64.3	Low	101 Å²	101	108.9 Å²	108.9	53%	0.529	51%	0.505	S	S	.	.	H	α-helix	trans	-64.8	-39.4	175.5	-71.7	168.1	0	0	0	111.7	M325 D326 Q332 M333	M325-L329 WeakPolarHBondContact O-CB 3.47Å; M325-L329 VanDerWaalsContact O-CG 3.31Å; M325-L329 WeakPolarHBondContact O-CG 3.24Å; M325-L329 PolarHBondContact O-N 3.37Å; D326-L329 PolarHBondContact O-N 3.09Å; L329-Q332 PolarHBondContact O-N 3.01Å; L329-M333 VanDerWaalsContact O-CB 3.32Å; L329-M333 WeakPolarHBondContact O-CB 2.98Å; L329-M333 WeakPolarHBondContact O-CG 3.18Å; L329-M333 PolarHBondContact O-N 3.26Å
330	L	67.1	Low	63.6	Low	113 Å²	113	109.8 Å²	109.8	59%	0.592	51%	0.509	S	S	*	.	H	α-helix	trans	-72	-36.1	176.9	-161.6	68.9	0	0	0	112.3	D326 R327 T334	D326-L330 VanDerWaalsContact O-CB 3.29Å; D326-L330 WeakPolarHBondContact O-CB 3.11Å; D326-L330 PolarHBondContact O-N 2.85Å; R327-L330 PolarHBondContact O-N 2.9Å; L330-T334 VanDerWaalsContact O-CB 3.32Å; L330-T334 WeakPolarHBondContact O-CB 3.37Å; L330-T334 VanDerWaalsContact O-CG2 3.24Å; L330-T334 WeakPolarHBondContact O-CG2 3.41Å; L330-T334 PolarHBondContact O-N 2.95Å; L330-T334 PolarHBondContact O-OG1 3.48Å
331	E	69.6	Low	63.1	Low	98 Å²	98	112.1 Å²	112.1	46%	0.458	51%	0.513	S	S	.	.	H	α-helix	trans	-65	-42.6	171	-171.4	80	-111.4	0	0	110.7	R327 F328 T334 S335 R338	R327-E331 VanDerWaalsContact O-CB 3.24Å; R327-E331 WeakPolarHBondContact O-CB 3.47Å; R327-E331 PolarHBondContact O-N 3.5Å; F328-E331 PolarHBondContact O-N 3.28Å; E331-T334 PolarHBondContact O-N 3.47Å; E331-T334 PolarHBondContact O-OG1 3.37Å; E331-S335 WeakPolarHBondContact O-CB 3.48Å; E331-S335 PolarHBondContact O-N 3.14Å; E331-S335 PolarHBondContact O-OG 2.79Å; E331-R338 IonicContact OE1-CZ 3.16Å; E331-R338 IonicContact OE1-NH1 3.12Å; E331-R338 PolarHBondContact OE1-NH1 3.31Å; E331-R338 IonicContact OE1-NH2 2.67Å; E331-R338 PolarHBondContact OE1-NH2 3.15Å
332	Q	65.1	Low	62.2	Low	98 Å²	98	115.2 Å²	115.2	46%	0.458	52%	0.52	S	S	.	.	H	α-helix	trans	-63.5	-52.9	175.1	-172.3	176.9	-8.2	0	0	111	F328 L329 T334 S335 E336	F328-Q332 VanDerWaalsContact O-CB 3.3Å; F328-Q332 WeakPolarHBondContact O-CB 3.28Å; F328-Q332 PolarHBondContact O-N 3.49Å; L329-Q332 PolarHBondContact O-N 3.01Å; Q332-T334 VanDerWaalsContact C-N 3.27Å; Q332-T334 PolarHBondContact O-N 3.21Å; Q332-S335 WeakPolarHBondContact CA-OG 3.39Å; Q332-S335 PolarHBondContact O-N 2.86Å; Q332-S335 VanDerWaalsContact O-N 3.11Å; Q332-S335 PolarHBondContact O-OG 3.19Å; Q332-E336 WeakPolarHBondContact O-CB 3.34Å; Q332-E336 PolarHBondContact O-N 2.9Å
333	M	55.1	Low	61.5	Low	118 Å²	118	112.4 Å²	112.4	58%	0.581	51%	0.514	S	S	*	.	H	α-helix	trans	-59.5	-35.4	177.5	-75.2	-84.9	-84.4	0	0	112.9	L329 R337	L329-M333 VanDerWaalsContact O-CB 3.32Å; L329-M333 WeakPolarHBondContact O-CB 2.98Å; L329-M333 WeakPolarHBondContact O-CG 3.18Å; L329-M333 PolarHBondContact O-N 3.26Å; M333-R337 VanDerWaalsContact O-CB 3.25Å; M333-R337 WeakPolarHBondContact O-CB 3.26Å; M333-R337 PolarHBondContact O-N 3.41Å; M333-R337 VanDerWaalsContact O-N 3.13Å
334	T	64.8	Low	60.8	Low	58 Å²	58	108.7 Å²	108.7	36%	0.356	51%	0.506	S	S	.	.	H	α-helix	trans	-83.4	-24.3	176.1	57.7	0	0	0	0	113.3	L330 E331 Q332 R338	L330-T334 VanDerWaalsContact O-CB 3.32Å; L330-T334 WeakPolarHBondContact O-CB 3.37Å; L330-T334 VanDerWaalsContact O-CG2 3.24Å; L330-T334 WeakPolarHBondContact O-CG2 3.41Å; L330-T334 PolarHBondContact O-N 2.95Å; L330-T334 PolarHBondContact O-OG1 3.48Å; E331-T334 PolarHBondContact O-N 3.47Å; E331-T334 PolarHBondContact O-OG1 3.37Å; Q332-T334 VanDerWaalsContact C-N 3.27Å; Q332-T334 PolarHBondContact O-N 3.21Å; T334-R338 WeakPolarHBondContact O-CB 3.33Å; T334-R338 WeakPolarHBondContact O-CG 3.12Å; T334-R338 PolarHBondContact O-N 3.16Å; T334-R338 PolarHBondContact O-NE 3.32Å; T334-R338 PolarHBondContact OG1-NH2 3.35Å
335	S	59.4	Low	59.6	Low	47 Å²	47	111 Å²	111	33%	0.329	52%	0.519	S	S	.	.	H	α-helix	trans	-77	-35.9	173.2	65	0	0	0	0	111.5	E331 Q332 R338 H339	E331-S335 WeakPolarHBondContact O-CB 3.48Å; E331-S335 PolarHBondContact O-N 3.14Å; E331-S335 PolarHBondContact O-OG 2.79Å; Q332-S335 WeakPolarHBondContact CA-OG 3.39Å; Q332-S335 PolarHBondContact O-N 2.86Å; Q332-S335 VanDerWaalsContact O-N 3.11Å; Q332-S335 PolarHBondContact O-OG 3.19Å; S335-R338 CarbonylContact O-C 3.59Å; S335-R338 WeakPolarHBondContact O-CA 3.34Å; S335-R338 WeakPolarHBondContact O-CB 3.38Å; S335-R338 PolarHBondContact O-N 2.69Å; S335-H339 PolarHBondContact O-N 2.84Å
336	E	58.4	Low	58.4	Low	111 Å²	111	112.4 Å²	112.4	52%	0.519	52%	0.524	S	S	.	.	H	α-helix	trans	-65.4	-43.6	169.6	-176.1	172.3	-127.1	0	0	111.5	Q332 R338 H339 H340	Q332-E336 WeakPolarHBondContact O-CB 3.34Å; Q332-E336 PolarHBondContact O-N 2.9Å; E336-R338 VanDerWaalsContact C-N 3.27Å; E336-R338 PolarHBondContact O-N 2.93Å; E336-H339 WeakPolarHBondContact O-CB 3.27Å; E336-H339 PolarHBondContact O-N 2.81Å; E336-H340 PolarHBondContact O-N 3.4Å
337	R	57.5	Low	57.4	Low	160 Å²	160	112.6 Å²	112.6	60%	0.604	53%	0.533	S	S	*	.	H	α-helix	trans	-67.3	-24	171.2	-169.9	176.3	-70	-170.4	-2	113	M333 R341	M333-R337 VanDerWaalsContact O-CB 3.25Å; M333-R337 WeakPolarHBondContact O-CB 3.26Å; M333-R337 PolarHBondContact O-N 3.41Å; M333-R337 VanDerWaalsContact O-N 3.13Å; R337-R341 WeakPolarHBondContact O-CD 3.34Å; R337-R341 VanDerWaalsContact O-CG 3.24Å; R337-R341 WeakPolarHBondContact O-CG 3.4Å; R337-R341 PolarHBondContact O-N 2.68Å
338	R	56.5	Low	56.2	Low	115 Å²	115	113 Å²	113	43%	0.434	53%	0.534	S	S	.	.	H	α-helix	trans	-73.7	-45	168.2	-81.8	169	-90.3	171.8	-6.8	110.5	E331 T334 S335 E336 H340 R341 M342	E331-R338 IonicContact OE1-CZ 3.16Å; E331-R338 IonicContact OE1-NH1 3.12Å; E331-R338 PolarHBondContact OE1-NH1 3.31Å; E331-R338 IonicContact OE1-NH2 2.67Å; E331-R338 PolarHBondContact OE1-NH2 3.15Å; T334-R338 WeakPolarHBondContact O-CB 3.33Å; T334-R338 WeakPolarHBondContact O-CG 3.12Å; T334-R338 PolarHBondContact O-N 3.16Å; T334-R338 PolarHBondContact O-NE 3.32Å; T334-R338 PolarHBondContact OG1-NH2 3.35Å; S335-R338 CarbonylContact O-C 3.59Å; S335-R338 WeakPolarHBondContact O-CA 3.34Å; S335-R338 WeakPolarHBondContact O-CB 3.38Å; S335-R338 PolarHBondContact O-N 2.69Å; E336-R338 VanDerWaalsContact C-N 3.27Å; E336-R338 PolarHBondContact O-N 2.93Å; R338-H340 PolarHBondContact O-N 3.43Å; R338-R341 CarbonylContact O-C 3.2Å; R338-R341 WeakPolarHBondContact O-CA 3.14Å; R338-R341 WeakPolarHBondContact O-CB 3.32Å; R338-R341 PolarHBondContact O-N 2.81Å; R338-M342 WeakPolarHBondContact O-CG 3.31Å; R338-M342 PolarHBondContact O-N 3.33Å
339	H	53.4	Low	54.5	Low	120 Å²	120	113 Å²	113	56%	0.556	54%	0.54	S	S	*	.	H	α-helix	trans	-57.2	-49.3	175.3	-109.1	71.1	0	0	0	112.1	S335 E336 R341 M342 M343	S335-H339 PolarHBondContact O-N 2.84Å; E336-H339 WeakPolarHBondContact O-CB 3.27Å; E336-H339 PolarHBondContact O-N 2.81Å; H339-R341 PolarHBondContact O-N 3Å; H339-M342 PolarHBondContact O-N 3.31Å; H339-M342 VanDerWaalsContact O-N 3.08Å; H339-M343 VanDerWaalsContact O-CG 3.28Å; H339-M343 WeakPolarHBondContact O-CG 3.31Å; H339-M343 PolarHBondContact O-N 2.8Å
340	H	46.8	Very low	53.1	Low	140 Å²	140	115.1 Å²	115.1	65%	0.648	55%	0.552	S	S	*	*	H	α-helix	trans	-56.5	-35	173.6	-96	81.6	0	0	0	113	E336 R338 D344	E336-H340 PolarHBondContact O-N 3.4Å; R338-H340 PolarHBondContact O-N 3.43Å; H340-D344 WeakPolarHBondContact O-CB 3.28Å; H340-D344 PolarHBondContact O-N 2.8Å
341	R	53.8	Low	51.4	Low	168 Å²	168	120 Å²	120	63%	0.634	56%	0.564	S	S	*	*	H	α-helix	trans	-77.2	-28.5	176.4	-74.6	170.9	175.7	-176.1	-3.3	113.7	R337 R338 H339 M345	R337-R341 WeakPolarHBondContact O-CD 3.34Å; R337-R341 VanDerWaalsContact O-CG 3.24Å; R337-R341 WeakPolarHBondContact O-CG 3.4Å; R337-R341 PolarHBondContact O-N 2.68Å; R338-R341 CarbonylContact O-C 3.2Å; R338-R341 WeakPolarHBondContact O-CA 3.14Å; R338-R341 WeakPolarHBondContact O-CB 3.32Å; R338-R341 PolarHBondContact O-N 2.81Å; H339-R341 PolarHBondContact O-N 3Å; R341-M345 WeakPolarHBondContact O-CB 3.11Å; R341-M345 PolarHBondContact O-N 3.18Å
342	M	52.2	Low	49.7	Very low	113 Å²	113	124.7 Å²	124.7	56%	0.557	59%	0.585	S	S	*	*	H	α-helix	trans	-71.2	-46.5	171.5	-62.7	-161.2	-47.8	0	0	110	R338 H339 D344 M345 E346	R338-M342 WeakPolarHBondContact O-CG 3.31Å; R338-M342 PolarHBondContact O-N 3.33Å; H339-M342 PolarHBondContact O-N 3.31Å; H339-M342 VanDerWaalsContact O-N 3.08Å; M342-D344 VanDerWaalsContact C-N 3.32Å; M342-D344 PolarHBondContact O-N 3.16Å; M342-M345 PolarHBondContact O-N 2.82Å; M342-E346 WeakPolarHBondContact O-CB 3.12Å; M342-E346 PolarHBondContact O-N 2.9Å
343	M	50.4	Low	48.3	Very low	104 Å²	104	124 Å²	124	51%	0.512	60%	0.604	S	S	.	*	H	α-helix	trans	-58.1	-42.1	175.3	-61	-95	70.9	0	0	112.1	H339 M345 E346 S347	H339-M343 VanDerWaalsContact O-CG 3.28Å; H339-M343 WeakPolarHBondContact O-CG 3.31Å; H339-M343 PolarHBondContact O-N 2.8Å; M343-M345 VanDerWaalsContact C-N 3.29Å; M343-M345 PolarHBondContact O-N 3.4Å; M343-E346 VanDerWaalsContact CE-OE2 3.23Å; M343-E346 WeakPolarHBondContact CE-OE2 3.21Å; M343-S347 VanDerWaalsContact O-CB 3.3Å; M343-S347 WeakPolarHBondContact O-CB 3.03Å; M343-S347 PolarHBondContact O-N 3.28Å; M343-S347 PolarHBondContact O-OG 2.89Å
344	D	49.7	Very low	46.9	Very low	78 Å²	78	122.2 Å²	122.2	42%	0.417	62%	0.617	S	S	.	*	H	α-helix	trans	-73.2	-13.4	175.6	-175.2	64.9	0	0	0	114.1	H340 M342 R348	H340-D344 WeakPolarHBondContact O-CB 3.28Å; H340-D344 PolarHBondContact O-N 2.8Å; M342-D344 VanDerWaalsContact C-N 3.32Å; M342-D344 PolarHBondContact O-N 3.16Å; D344-R348 WeakPolarHBondContact O-CD 3.35Å; D344-R348 WeakPolarHBondContact O-CG 3.34Å; D344-R348 PolarHBondContact O-NE 2.89Å; D344-R348 IonicContact OD1-CZ 3.42Å; D344-R348 IonicContact OD1-NE 3.5Å; D344-R348 IonicContact OD1-NH2 3.56Å; D344-R348 PolarHBondContact OD1-NH2 3.34Å; D344-R348 IonicContact OD2-CZ 3.52Å; D344-R348 IonicContact OD2-NE 3.5Å; D344-R348 PolarHBondContact OD2-NE 2.79Å; D344-R348 VanDerWaalsContact OD2-NE 3.16Å; D344-R348 IonicContact OD2-NH2 2.72Å; D344-R348 PolarHBondContact OD2-NH2 2.94Å
345	M	45.3	Very low	45.6	Very low	117 Å²	117	128.5 Å²	128.5	58%	0.576	64%	0.639	S	S	*	*	H	α-helix	trans	-92.7	-41.6	171.9	-90.8	-70.1	164.3	0	0	112.5	R341 M342 M343 S347 R348 L349	R341-M345 WeakPolarHBondContact O-CB 3.11Å; R341-M345 PolarHBondContact O-N 3.18Å; M342-M345 PolarHBondContact O-N 2.82Å; M343-M345 VanDerWaalsContact C-N 3.29Å; M343-M345 PolarHBondContact O-N 3.4Å; M345-S347 VanDerWaalsContact C-N 3.28Å; M345-S347 PolarHBondContact O-N 3.13Å; M345-R348 WeakPolarHBondContact O-CB 3.21Å; M345-R348 PolarHBondContact O-N 3.34Å; M345-L349 PolarHBondContact O-N 3.32Å
346	E	40.8	Very low	44.3	Very low	127 Å²	127	133.4 Å²	133.4	59%	0.593	66%	0.662	S	S	*	*	H	α-helix	trans	-59.5	-42.2	174.1	-160.2	157.3	-134.6	0	0	110.3	M342 M343 R348 L349	M342-E346 WeakPolarHBondContact O-CB 3.12Å; M342-E346 PolarHBondContact O-N 2.9Å; M343-E346 VanDerWaalsContact CE-OE2 3.23Å; M343-E346 WeakPolarHBondContact CE-OE2 3.21Å; E346-R348 PolarHBondContact O-N 3.47Å; E346-L349 PolarHBondContact O-N 2.77Å
347	S	42.3	Very low	42.8	Very low	101 Å²	101	134 Å²	134	71%	0.706	68%	0.678	S	S	*	*	H	α-helix	trans	-61.4	-12.2	171	-57.3	0	0	0	0	115.2	M343 M345	M343-S347 VanDerWaalsContact O-CB 3.3Å; M343-S347 WeakPolarHBondContact O-CB 3.03Å; M343-S347 PolarHBondContact O-N 3.28Å; M343-S347 PolarHBondContact O-OG 2.89Å; M345-S347 VanDerWaalsContact C-N 3.28Å; M345-S347 PolarHBondContact O-N 3.13Å
348	R	46.9	Very low	42	Very low	151 Å²	151	132 Å²	132	57%	0.57	69%	0.685	S	S	*	*	H	α-helix	trans	-105.2	-16	-179.4	-67.2	170.9	-163.8	-88.7	-4.2	113.4	D344 M345 E346	D344-R348 WeakPolarHBondContact O-CD 3.35Å; D344-R348 WeakPolarHBondContact O-CG 3.34Å; D344-R348 PolarHBondContact O-NE 2.89Å; D344-R348 IonicContact OD1-CZ 3.42Å; D344-R348 IonicContact OD1-NE 3.5Å; D344-R348 IonicContact OD1-NH2 3.56Å; D344-R348 PolarHBondContact OD1-NH2 3.34Å; D344-R348 IonicContact OD2-CZ 3.52Å; D344-R348 IonicContact OD2-NE 3.5Å; D344-R348 PolarHBondContact OD2-NE 2.79Å; D344-R348 VanDerWaalsContact OD2-NE 3.16Å; D344-R348 IonicContact OD2-NH2 2.72Å; D344-R348 PolarHBondContact OD2-NH2 2.94Å; M345-R348 WeakPolarHBondContact O-CB 3.21Å; M345-R348 PolarHBondContact O-N 3.34Å; E346-R348 PolarHBondContact O-N 3.47Å
349	L	40.8	Very low	40.8	Very low	136 Å²	136	138.4 Å²	138.4	71%	0.712	71%	0.71	S	S	*	*	H	α-helix	trans	-81.3	-25.7	-176.4	-94.8	153.1	0	0	0	113.8	M345 E346 Y351	M345-L349 PolarHBondContact O-N 3.32Å; E346-L349 PolarHBondContact O-N 2.77Å; L349-Y351 PolarHBondContact O-N 2.61Å
350	N	38.8	Very low	39.8	Very low	145 Å²	145	139 Å²	139	78%	0.775	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-0.9	-173.6	-92.9	16.3	0	0	0	116.7
351	Y	32.9	Very low	39.6	Very low	215 Å²	215	139.9 Å²	139.9	84%	0.843	73%	0.731	S	S	*	*			trans	-138.1	58.7	-177.6	-87.5	-73.8	0	0	0	114.7	L349	L349-Y351 PolarHBondContact O-N 2.61Å
352	H	34.1	Very low	38.7	Very low	196 Å²	196	140.4 Å²	140.4	91%	0.907	74%	0.738	S	S	*	*			trans	-126.4	67.3	164.1	-93.6	20.8	0	0	0	112
353	G	34	Very low	38.4	Very low	83 Å²	83	145 Å²	145	86%	0.856	76%	0.755	S	S	*	*			trans	-152.8	89.2	174.1	0	0	0	0	0	111.9
354	G	26.5	Very low	38.1	Very low	82 Å²	82	143.9 Å²	143.9	85%	0.845	75%	0.751	S	S	*	*			trans	157.1	133.1	178.1	0	0	0	0	0	112.5
355	K	38.3	Very low	38.4	Very low	190 Å²	190	146.2 Å²	146.2	83%	0.826	76%	0.762	S	S	*	*			trans	-109.6	155.7	171.7	-74.8	-177.4	176.2	176	0	110.4
356	D	31.3	Very low	39.4	Very low	150 Å²	150	147 Å²	147	80%	0.802	76%	0.762	S	S	*	*			trans	71.8	168.1	162.8	-51.1	-45.5	0	0	0	118
357	S	26.2	Very low	41	Very low	123 Å²	123	141.4 Å²	141.4	86%	0.86	74%	0.737	S	S	*	*			trans	74.3	153.2	-174.3	-87.1	0	0	0	0	118.3
358	P	41.6	Very low	42.4	Very low	117 Å²	117	140.3 Å²	140.3	76%	0.76	73%	0.728	S	S	*	*			trans	-107.8	146.5	-142.4	6.2	16.2	0	0	0	115.2	T360	P358-T360 PolarHBondContact O-N 2.78Å
359	R	31.3	Very low	43.4	Very low	251 Å²	251	133.4 Å²	133.4	95%	0.947	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-71.9	124.1	174	-69	178.9	174.9	167.4	-1.4	111.7
360	T	33.1	Very low	44.8	Very low	131 Å²	131	131.1 Å²	131.1	80%	0.804	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-82.2	162.4	171.3	46.6	0	0	0	0	112.4	P358 K362	P358-T360 PolarHBondContact O-N 2.78Å; T360-K362 PolarHBondContact O-N 3.35Å
361	D	40.8	Very low	46.2	Very low	159 Å²	159	128.7 Å²	128.7	85%	0.85	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-60.8	124.2	-165.5	-66.4	-93.9	0	0	0	115.7
362	K	35.5	Very low	48.6	Very low	180 Å²	180	119 Å²	119	78%	0.783	67%	0.668	S	S	*	*			trans	-104.7	131	148	-68.2	-168.8	177.9	-176.9	0	109.1	T360 D364	T360-K362 PolarHBondContact O-N 3.35Å; K362-D364 PolarHBondContact O-N 3.27Å
363	K	45.4	Very low	50.7	Low	209 Å²	209	114.2 Å²	114.2	91%	0.909	65%	0.649	S	S	*	*			trans	-80.2	57.6	-172.3	-165	179.4	-178.8	179.3	0	111.5
364	D	44.9	Very low	52.8	Low	80 Å²	80	110.3 Å²	110.3	43%	0.428	61%	0.609	S	S	.	*			trans	-60.5	144.3	177.5	-95.8	-65.7	0	0	0	111.9	K362 K366 R386	K362-D364 PolarHBondContact O-N 3.27Å; D364-K366 VanDerWaalsContact C-N 3.26Å; D364-K366 PolarHBondContact O-N 3.43Å; D364-R386 IonicContact OD1-CZ 2.82Å; D364-R386 IonicContact OD1-NH1 2.67Å; D364-R386 IonicContact OD1-NH2 2.81Å; D364-R386 PolarHBondContact OD1-NH2 3.47Å
365	I	56.3	Low	55.3	Low	128 Å²	128	110.4 Å²	110.4	66%	0.656	59%	0.593	S	S	*	*			trans	-78	81	179.6	-55.4	172	0	0	0	107.9	R386	I365-R386 WeakPolarHBondContact O-CG 3.46Å
366	K	66.5	Low	57.1	Low	133 Å²	133	102.5 Å²	102.5	58%	0.578	57%	0.566	S	S	*	*			trans	-66	155.5	-179.3	-69.4	173.2	-176.8	176.7	0	111.6	D364	D364-K366 VanDerWaalsContact C-N 3.26Å; D364-K366 PolarHBondContact O-N 3.43Å
367	C	72.9	Confident	59.6	Low	9 Å²	9	97.5 Å²	97.5	6%	0.061	54%	0.537	C	S	.	.			trans	-57.8	139.9	176.8	-175.6	0	0	0	0	110.9	T369 C372 H385 S387	C367-T369 PolarHBondContact O-N 2.91Å; C367-T369 VanDerWaalsContact O-N 3.09Å; C367-T369 PolarHBondContact SG-OG1 3.02Å; C367-C372 HydrophobicContact CB-CB 4.41Å; C367-H385 VanDerWaalsContact SG-CD2 3.59Å; C367-S387 PolarHBondContact SG-O 3.24Å; C367-S387 VanDerWaalsContact SG-O 3.37Å
368	P	73.4	Confident	62.2	Low	78 Å²	78	95.8 Å²	95.8	51%	0.506	52%	0.521	S	S	.	.	S	Bend	trans	-67.4	-4.9	177.4	-20	32.4	0	0	0	115.2	P370 L388	P368-P370 WeakPolarHBondContact O-CD 3.24Å; P368-L388 HydrophobicContact CB-CD1 4.33Å; P368-L388 HydrophobicContact CB-CD2 3.87Å; P368-L388 HydrophobicContact CB-CG 3.98Å; P368-L388 HydrophobicContact CG-CD2 4.36Å; P368-L388 HydrophobicContact CG-CG 4.09Å
369	T	67.2	Low	63.7	Low	7 Å²	7	94 Å²	94	4%	0.043	51%	0.508	C	S	.	.	S	Bend	trans	-71.3	118.6	175.3	-57.3	0	0	0	0	110.3	C367 G371 C372 L388 C391 H393 V397	C367-T369 PolarHBondContact O-N 2.91Å; C367-T369 VanDerWaalsContact O-N 3.09Å; C367-T369 PolarHBondContact SG-OG1 3.02Å; T369-G371 PolarHBondContact O-N 2.95Å; T369-C372 HydrophobicContact CG2-CB 4.1Å; T369-C372 VanDerWaalsContact O-CB 3.32Å; T369-C372 WeakPolarHBondContact O-CB 3.46Å; T369-C372 PolarHBondContact O-N 3.16Å; T369-C372 VanDerWaalsContact O-N 3.08Å; T369-L388 WeakPolarHBondContact OG1-CD2 3.26Å; T369-C391 PolarHBondContact OG1-SG 2.85Å; T369-H393 HydrophobicContact CG2-CB 4.06Å; T369-V397 HydrophobicContact CG2-CG2 4.07Å
370	P	70.5	Confident	65.6	Low	88 Å²	88	85.1 Å²	85.1	57%	0.571	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	134.2	178.2	-24.4	35	0	0	0	112.1	P368 C372 I401	P368-P370 WeakPolarHBondContact O-CD 3.24Å; P370-C372 VanDerWaalsContact C-N 3.26Å; P370-C372 PolarHBondContact O-N 2.72Å; P370-I401 HydrophobicContact CG-CD1 4.22Å
371	G	68.4	Low	67.4	Low	93 Å²	93	85.5 Å²	85.5	96%	0.959	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	5.4	-177.5	0	0	0	0	0	115.1	T369	T369-G371 PolarHBondContact O-N 2.95Å
372	C	81.9	Confident	68.7	Low	12 Å²	12	84.8 Å²	84.8	8%	0.081	48%	0.478	C	S	.	.			trans	-94.8	125.1	171.4	-166.9	0	0	0	0	111	C367 T369 P370 G374 H385	C367-C372 HydrophobicContact CB-CB 4.41Å; T369-C372 HydrophobicContact CG2-CB 4.1Å; T369-C372 VanDerWaalsContact O-CB 3.32Å; T369-C372 WeakPolarHBondContact O-CB 3.46Å; T369-C372 PolarHBondContact O-N 3.16Å; T369-C372 VanDerWaalsContact O-N 3.08Å; P370-C372 VanDerWaalsContact C-N 3.26Å; P370-C372 PolarHBondContact O-N 2.72Å; C372-G374 PolarHBondContact SG-N 3.37Å; C372-G374 VanDerWaalsContact SG-N 3.43Å; C372-H385 PolarHBondContact SG-CE1 3.16Å; C372-H385 PolarHBondContact SG-NE2 3.4Å
373	D	79.4	Confident	70.5	Confident	96 Å²	96	81.5 Å²	81.5	51%	0.513	48%	0.475	S	S	.	.			trans	-71.6	-20.8	171.5	63.3	-17.2	0	0	0	112.9	T375	D373-T375 VanDerWaalsContact CG-OG1 3.23Å; D373-T375 PolarHBondContact OD1-N 2.88Å; D373-T375 WeakPolarHBondContact OD2-CB 3.4Å; D373-T375 PolarHBondContact OD2-OG1 2.85Å
374	G	77.2	Confident	72.3	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	45%	0.449	C	S	.	.			trans	97.4	2.8	-173.8	0	0	0	0	0	113.7	C372 H384 H385	C372-G374 PolarHBondContact SG-N 3.37Å; C372-G374 VanDerWaalsContact SG-N 3.43Å; G374-H384 CarbonylContact O-C 3.41Å; G374-H384 WeakPolarHBondContact O-CA 3.35Å; G374-H384 PolarHBondContact O-ND1 2.99Å; G374-H385 VanDerWaalsContact CA-CE1 3.46Å; G374-H385 WeakPolarHBondContact CA-CE1 3.32Å; G374-H385 WeakPolarHBondContact CA-O 3.33Å; G374-H385 PolarHBondContact O-CE1 2.93Å; G374-H385 PolarHBondContact O-N 3.23Å; G374-H385 PolarHBondContact O-ND1 3.49Å
375	T	79.8	Confident	74.1	Confident	85 Å²	85	71.6 Å²	71.6	52%	0.521	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-72.2	148.7	-176.4	-59.6	0	0	0	0	111.7	D373 H385	D373-T375 VanDerWaalsContact CG-OG1 3.23Å; D373-T375 PolarHBondContact OD1-N 2.88Å; D373-T375 WeakPolarHBondContact OD2-CB 3.4Å; D373-T375 PolarHBondContact OD2-OG1 2.85Å; T375-H385 PolarHBondContact O-CE1 3.21Å; T375-H385 PolarHBondContact O-ND1 3.36Å
376	G	75.4	Confident	75.4	Confident	24 Å²	24	71.3 Å²	71.3	25%	0.247	42%	0.42	C	S	.	.	S	Bend	trans	66.4	-168.8	-173.4	0	0	0	0	0	113.5	Y382 P383 H384 H385	G376-Y382 CarbonylContact C-O 3.24Å; G376-Y382 VanDerWaalsContact C-O 3.22Å; G376-P383 WeakPolarHBondContact CA-O 3.33Å; G376-P383 PolarHBondContact N-O 3.48Å; G376-H384 CarbonylContact O-C 3.12Å; G376-H384 VanDerWaalsContact O-C 3.27Å; G376-H384 WeakPolarHBondContact O-CA 3.29Å; G376-H385 WeakPolarHBondContact O-CB 3.31Å; G376-H385 PolarHBondContact O-N 3.11Å; G376-H385 VanDerWaalsContact O-N 3.08Å; G376-H385 PolarHBondContact O-ND1 2.83Å
377	H	84.6	Confident	75.6	Confident	45 Å²	45	67.1 Å²	67.1	21%	0.208	41%	0.408	C	S	.	.			trans	-152.5	152.4	173.5	-174	-95.4	0	0	0	108.5	T379 G380 Y382 H385 G390	H377-T379 PolarHBondContact ND1-N 2.86Å; H377-T379 PolarHBondContact ND1-OG1 3.12Å; H377-T379 PolarHBondContact O-N 3.32Å; H377-G380 PolarHBondContact O-N 2.04Å; H377-Y382 WeakPolarHBondContact CB-O 3.48Å; H377-Y382 PolarHBondContact N-O 3.38Å; H377-Y382 AromaticContact ND1-CD2 3.97Å; H377-H385 HydrophobicContact CB-CB 4.37Å; H377-G390 CarbonylContact C-O 3.52Å; H377-G390 WeakPolarHBondContact CA-O 3.44Å; H377-G390 VanDerWaalsContact CD2-CA 3.48Å; H377-G390 WeakPolarHBondContact CD2-CA 3.44Å; H377-G390 VanDerWaalsContact NE2-CA 3.25Å; H377-G390 WeakPolarHBondContact NE2-CA 3.33Å
378	V	79.3	Confident	75.4	Confident	86 Å²	86	69.2 Å²	69.2	52%	0.521	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-22.2	-176.6	72.1	0	0	0	0	113.9	S389 G390	V378-S389 WeakPolarHBondContact CG1-O 3.38Å; V378-G390 PolarHBondContact N-O 3.31Å
379	T	72.9	Confident	75.4	Confident	79 Å²	79	70 Å²	70	49%	0.485	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-6.6	174.9	62.6	0	0	0	0	114.2	H377 L381	H377-T379 PolarHBondContact ND1-N 2.86Å; H377-T379 PolarHBondContact ND1-OG1 3.12Å; H377-T379 PolarHBondContact O-N 3.32Å; T379-L381 PolarHBondContact O-N 3.23Å; T379-L381 PolarHBondContact OG1-N 3.01Å
380	G	72.6	Confident	75.6	Confident	65 Å²	65	69.7 Å²	69.7	67%	0.67	42%	0.423	S	S	*	.	S	Bend	trans	70.1	-12.4	-172.6	0	0	0	0	0	115.8	H377 Y382	H377-G380 PolarHBondContact O-N 2.04Å; G380-Y382 PolarHBondContact O-N 2.84Å
381	L	71	Confident	76.1	Confident	139 Å²	139	65.6 Å²	65.6	73%	0.728	40%	0.397	S	S	*	.	S	Bend	trans	-79.4	-11	-173.6	-60.6	178.7	0	0	0	114.9	T379	T379-L381 PolarHBondContact O-N 3.23Å; T379-L381 PolarHBondContact OG1-N 3.01Å
382	Y	67.9	Low	76.5	Confident	144 Å²	144	64 Å²	64	57%	0.565	37%	0.369	S	S	*	.			trans	-130.2	138.5	-177.9	-58.6	-72	0	0	0	110.9	G376 H377 G380 H384	G376-Y382 CarbonylContact C-O 3.24Å; G376-Y382 VanDerWaalsContact C-O 3.22Å; H377-Y382 WeakPolarHBondContact CB-O 3.48Å; H377-Y382 PolarHBondContact N-O 3.38Å; H377-Y382 AromaticContact ND1-CD2 3.97Å; G380-Y382 PolarHBondContact O-N 2.84Å; Y382-H384 VanDerWaalsContact C-N 3.28Å; Y382-H384 PolarHBondContact O-N 3.17Å
383	P	73.4	Confident	76	Confident	111 Å²	111	68 Å²	68	72%	0.721	39%	0.387	S	S	*	.	S	Bend	trans	-77.9	-9.8	-175.7	31.8	-36.7	0	0	0	114	G376	G376-P383 WeakPolarHBondContact CA-O 3.33Å; G376-P383 PolarHBondContact N-O 3.48Å
384	H	83.2	Confident	75.4	Confident	78 Å²	78	68.2 Å²	68.2	36%	0.361	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-152.5	137.3	-176	-172.9	18.5	0	0	0	110.1	G374 G376 Y382 R386	G374-H384 CarbonylContact O-C 3.41Å; G374-H384 WeakPolarHBondContact O-CA 3.35Å; G374-H384 PolarHBondContact O-ND1 2.99Å; G376-H384 CarbonylContact O-C 3.12Å; G376-H384 VanDerWaalsContact O-C 3.27Å; G376-H384 WeakPolarHBondContact O-CA 3.29Å; Y382-H384 VanDerWaalsContact C-N 3.28Å; Y382-H384 PolarHBondContact O-N 3.17Å; H384-R386 PolarHBondContact NE2-NE 3.43Å; H384-R386 PolarHBondContact NE2-NH2 3.47Å
385	H	82.9	Confident	74.5	Confident	4 Å²	4	75.2 Å²	75.2	2%	0.019	43%	0.426	C	S	.	.			trans	-124.7	147.8	175.5	70.9	-82.1	0	0	0	110.8	C367 C372 G374 T375 G376 H377 C391 P392	C367-H385 VanDerWaalsContact SG-CD2 3.59Å; C372-H385 PolarHBondContact SG-CE1 3.16Å; C372-H385 PolarHBondContact SG-NE2 3.4Å; G374-H385 VanDerWaalsContact CA-CE1 3.46Å; G374-H385 WeakPolarHBondContact CA-CE1 3.32Å; G374-H385 WeakPolarHBondContact CA-O 3.33Å; G374-H385 PolarHBondContact O-CE1 2.93Å; G374-H385 PolarHBondContact O-N 3.23Å; G374-H385 PolarHBondContact O-ND1 3.49Å; T375-H385 PolarHBondContact O-CE1 3.21Å; T375-H385 PolarHBondContact O-ND1 3.36Å; G376-H385 WeakPolarHBondContact O-CB 3.31Å; G376-H385 PolarHBondContact O-N 3.11Å; G376-H385 VanDerWaalsContact O-N 3.08Å; G376-H385 PolarHBondContact O-ND1 2.83Å; H377-H385 HydrophobicContact CB-CB 4.37Å; H385-C391 VanDerWaalsContact CD2-CA 3.46Å; H385-C391 WeakPolarHBondContact CD2-CA 3.39Å; H385-C391 WeakPolarHBondContact NE2-CA 3.24Å; H385-C391 PolarHBondContact NE2-SG 2.83Å; H385-P392 WeakPolarHBondContact CE1-CD 3.43Å
386	R	82	Confident	73.5	Confident	121 Å²	121	81.8 Å²	81.8	46%	0.457	44%	0.441	S	S	.	.			trans	-123	1.1	-177.5	-61.5	-177.7	174.6	-152	-17.6	113.5	D364 I365 H384	D364-R386 IonicContact OD1-CZ 2.82Å; D364-R386 IonicContact OD1-NH1 2.67Å; D364-R386 IonicContact OD1-NH2 2.81Å; D364-R386 PolarHBondContact OD1-NH2 3.47Å; I365-R386 WeakPolarHBondContact O-CG 3.46Å; H384-R386 PolarHBondContact NE2-NE 3.43Å; H384-R386 PolarHBondContact NE2-NH2 3.47Å
387	S	71.9	Confident	72.3	Confident	46 Å²	46	82.4 Å²	82.4	32%	0.322	44%	0.44	S	S	.	.	S	Bend	trans	-125.6	158.7	-176.8	65.9	0	0	0	0	112.2	C367 S389 G390 C391	C367-S387 PolarHBondContact SG-O 3.24Å; C367-S387 VanDerWaalsContact SG-O 3.37Å; S387-S389 PolarHBondContact O-N 3.37Å; S387-S389 PolarHBondContact OG-OG 2.8Å; S387-G390 PolarHBondContact O-N 2.77Å; S387-G390 PolarHBondContact OG-N 2.83Å; S387-C391 PolarHBondContact O-N 2.95Å
388	L	69.3	Low	70.8	Confident	52 Å²	52	83.3 Å²	83.3	27%	0.272	45%	0.45	S	S	.	.	S	Bend	trans	-63.9	-28.8	171.4	-66.4	177.1	0	0	0	112.8	P368 T369 G390 C391 L405	P368-L388 HydrophobicContact CB-CD1 4.33Å; P368-L388 HydrophobicContact CB-CD2 3.87Å; P368-L388 HydrophobicContact CB-CG 3.98Å; P368-L388 HydrophobicContact CG-CD2 4.36Å; P368-L388 HydrophobicContact CG-CG 4.09Å; T369-L388 WeakPolarHBondContact OG1-CD2 3.26Å; L388-G390 VanDerWaalsContact C-N 3.34Å; L388-C391 PolarHBondContact O-N 2.94Å; L388-L405 HydrophobicContact CD1-CD1 3.77Å
389	S	71.9	Confident	69.6	Low	95 Å²	95	84 Å²	84	66%	0.664	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-32.2	176.9	52.1	0	0	0	0	112.9	V378 S387	V378-S389 WeakPolarHBondContact CG1-O 3.38Å; S387-S389 PolarHBondContact O-N 3.37Å; S387-S389 PolarHBondContact OG-OG 2.8Å
390	G	71.7	Confident	68.8	Low	0 Å²	0	86.4 Å²	86.4	0%	0	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-0.5	178	0	0	0	0	0	114.9	H377 V378 S387 L388	H377-G390 CarbonylContact C-O 3.52Å; H377-G390 WeakPolarHBondContact CA-O 3.44Å; H377-G390 VanDerWaalsContact CD2-CA 3.48Å; H377-G390 WeakPolarHBondContact CD2-CA 3.44Å; H377-G390 VanDerWaalsContact NE2-CA 3.25Å; H377-G390 WeakPolarHBondContact NE2-CA 3.33Å; V378-G390 PolarHBondContact N-O 3.31Å; S387-G390 PolarHBondContact O-N 2.77Å; S387-G390 PolarHBondContact OG-N 2.83Å; L388-G390 VanDerWaalsContact C-N 3.34Å
391	C	81.7	Confident	68.1	Low	2 Å²	2	86.3 Å²	86.3	1%	0.014	45%	0.445	C	S	.	.			trans	-83.4	122.1	-167.1	-170.3	0	0	0	0	113.5	T369 H385 S387 L388 H393 K394	T369-C391 PolarHBondContact OG1-SG 2.85Å; H385-C391 VanDerWaalsContact CD2-CA 3.46Å; H385-C391 WeakPolarHBondContact CD2-CA 3.39Å; H385-C391 WeakPolarHBondContact NE2-CA 3.24Å; H385-C391 PolarHBondContact NE2-SG 2.83Å; S387-C391 PolarHBondContact O-N 2.95Å; L388-C391 PolarHBondContact O-N 2.94Å; C391-H393 PolarHBondContact O-N 3.21Å; C391-H393 PolarHBondContact SG-N 3.09Å; C391-H393 VanDerWaalsContact SG-N 3.41Å; C391-K394 HydrophobicContact CB-CB 4.36Å; C391-K394 WeakPolarHBondContact O-CB 3.4Å; C391-K394 PolarHBondContact O-N 2.84Å
392	P	76.4	Confident	67.1	Low	60 Å²	60	86.4 Å²	86.4	39%	0.39	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-21.2	173.8	29.9	-32.8	0	0	0	112.6	H385	H385-P392 WeakPolarHBondContact CE1-CD 3.43Å
393	H	72.4	Confident	66.4	Low	97 Å²	97	82.1 Å²	82.1	45%	0.449	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	3.2	178.2	-65	-72.3	0	0	0	114.5	T369 C391 V395 R396	T369-H393 HydrophobicContact CG2-CB 4.06Å; C391-H393 PolarHBondContact O-N 3.21Å; C391-H393 PolarHBondContact SG-N 3.09Å; C391-H393 VanDerWaalsContact SG-N 3.41Å; H393-V395 PolarHBondContact O-N 3.45Å; H393-R396 PolarHBondContact O-N 2.86Å
394	K	66.1	Low	65.5	Low	100 Å²	100	81.9 Å²	81.9	44%	0.435	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-51.5	-29.2	-175.5	-167.2	-168.8	179.4	-164.8	0	114.3	C391 R396	C391-K394 HydrophobicContact CB-CB 4.36Å; C391-K394 WeakPolarHBondContact O-CB 3.4Å; C391-K394 PolarHBondContact O-N 2.84Å; K394-R396 VanDerWaalsContact C-N 3.28Å; K394-R396 PolarHBondContact O-N 2.61Å
395	V	58.1	Low	64.1	Low	147 Å²	147	81.3 Å²	81.3	89%	0.891	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-76.9	-8.5	-175.9	-169.9	0	0	0	0	113.3	H393	H393-V395 PolarHBondContact O-N 3.45Å
396	R	57.9	Low	62.5	Low	223 Å²	223	83.8 Å²	83.8	84%	0.842	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-103.3	17.6	-175.3	-150.3	175.2	-174.3	158.6	2.4	114.5	H393 K394	H393-R396 PolarHBondContact O-N 2.86Å; K394-R396 VanDerWaalsContact C-N 3.28Å; K394-R396 PolarHBondContact O-N 2.61Å
397	V	51.7	Low	61	Low	36 Å²	36	84.7 Å²	84.7	22%	0.218	46%	0.459	C	S	.	.			trans	-94.9	124.9	-176.6	179.9	0	0	0	0	110.5	T369 I401	T369-V397 HydrophobicContact CG2-CG2 4.07Å; V397-I401 HydrophobicContact CG1-CB 3.69Å; V397-I401 HydrophobicContact CG1-CD1 4.35Å; V397-I401 HydrophobicContact CG1-CG2 3.71Å
398	P	52.5	Low	59.9	Low	65 Å²	65	86.8 Å²	86.8	42%	0.422	46%	0.463	S	S	.	.			trans	-61.6	151.6	176.6	-26.6	36.4	0	0	0	114.3	E400 I401	P398-E400 VanDerWaalsContact C-N 3.25Å; P398-E400 WeakPolarHBondContact CB-OE2 3.24Å; P398-E400 PolarHBondContact O-N 2.97Å; P398-I401 PolarHBondContact O-N 3.42Å
399	P	55	Low	58.8	Low	101 Å²	101	90.7 Å²	90.7	66%	0.656	48%	0.48	S	S	*	.	H	α-helix	trans	-57.8	-32.2	-173.8	-25.1	35.2	0	0	0	114.8	I401 Y402 A403	P399-I401 VanDerWaalsContact C-N 3.28Å; P399-I401 PolarHBondContact O-N 2.95Å; P399-Y402 WeakPolarHBondContact O-CA 3.42Å; P399-Y402 WeakPolarHBondContact O-CB 3.35Å; P399-Y402 PolarHBondContact O-N 3.03Å; P399-A403 PolarHBondContact O-N 3.22Å; P399-A403 VanDerWaalsContact O-N 3.08Å
400	E	54.9	Low	57.6	Low	128 Å²	128	91.6 Å²	91.6	60%	0.598	48%	0.478	S	S	*	.	H	α-helix	trans	-63.6	-35.7	-177.4	-52.9	77	-169.8	0	0	111.3	P398 Y402 A403 V404	P398-E400 VanDerWaalsContact C-N 3.25Å; P398-E400 WeakPolarHBondContact CB-OE2 3.24Å; P398-E400 PolarHBondContact O-N 2.97Å; E400-Y402 VanDerWaalsContact C-N 3.34Å; E400-A403 PolarHBondContact O-N 3.34Å; E400-V404 WeakPolarHBondContact O-CG2 3.25Å; E400-V404 PolarHBondContact O-N 2.82Å; E400-V404 VanDerWaalsContact O-N 3.12Å
401	I	57.3	Low	56.6	Low	63 Å²	63	96.1 Å²	96.1	32%	0.323	51%	0.505	S	S	.	.	H	α-helix	trans	-71.7	-33	176.1	-60.5	-177.9	0	0	0	110.4	P370 V397 P398 P399 A403 V404 L405	P370-I401 HydrophobicContact CG-CD1 4.22Å; V397-I401 HydrophobicContact CG1-CB 3.69Å; V397-I401 HydrophobicContact CG1-CD1 4.35Å; V397-I401 HydrophobicContact CG1-CG2 3.71Å; P398-I401 PolarHBondContact O-N 3.42Å; P399-I401 VanDerWaalsContact C-N 3.28Å; P399-I401 PolarHBondContact O-N 2.95Å; I401-A403 VanDerWaalsContact C-N 3.32Å; I401-A403 PolarHBondContact O-N 2.81Å; I401-V404 PolarHBondContact O-N 3.38Å; I401-L405 HydrophobicContact CG2-CD1 3.98Å; I401-L405 HydrophobicContact CG2-CG 4.44Å; I401-L405 WeakPolarHBondContact O-CB 3.34Å; I401-L405 VanDerWaalsContact O-CG 3.31Å; I401-L405 WeakPolarHBondContact O-CG 3.48Å; I401-L405 PolarHBondContact O-N 2.81Å
402	Y	51.9	Low	55.3	Low	141 Å²	141	100.1 Å²	100.1	55%	0.553	53%	0.526	S	S	*	.	H	α-helix	trans	-66	-35.6	174.2	-139.3	-80.1	0	0	0	111.5	P399 E400 L405 A406	P399-Y402 WeakPolarHBondContact O-CA 3.42Å; P399-Y402 WeakPolarHBondContact O-CB 3.35Å; P399-Y402 PolarHBondContact O-N 3.03Å; E400-Y402 VanDerWaalsContact C-N 3.34Å; Y402-L405 PolarHBondContact O-N 2.84Å; Y402-A406 WeakPolarHBondContact O-CB 3.2Å; Y402-A406 PolarHBondContact O-N 2.81Å
403	A	53	Low	54.9	Low	55 Å²	55	102.2 Å²	102.2	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-67	-43.5	173.4	0	0	0	0	0	112.7	P399 E400 I401 L405 A406 M407	P399-A403 PolarHBondContact O-N 3.22Å; P399-A403 VanDerWaalsContact O-N 3.08Å; E400-A403 PolarHBondContact O-N 3.34Å; I401-A403 VanDerWaalsContact C-N 3.32Å; I401-A403 PolarHBondContact O-N 2.81Å; A403-L405 VanDerWaalsContact C-N 3.3Å; A403-L405 PolarHBondContact O-N 3.26Å; A403-A406 PolarHBondContact O-N 3.13Å; A403-M407 PolarHBondContact O-N 2.77Å
404	V	53.2	Low	55.1	Low	105 Å²	105	97.9 Å²	97.9	64%	0.636	51%	0.509	S	S	*	.	H	α-helix	trans	-62.2	-37.7	174.6	173.8	0	0	0	0	111.5	E400 I401	E400-V404 WeakPolarHBondContact O-CG2 3.25Å; E400-V404 PolarHBondContact O-N 2.82Å; E400-V404 VanDerWaalsContact O-N 3.12Å; I401-V404 PolarHBondContact O-N 3.38Å
405	L	53.7	Low	55.7	Low	66 Å²	66	97.5 Å²	97.5	35%	0.346	52%	0.518	S	S	.	.	H	α-helix	trans	-75.4	-30	176.5	-70.4	170.5	0	0	0	113.3	L388 I401 Y402 A403 M407 H408	L388-L405 HydrophobicContact CD1-CD1 3.77Å; I401-L405 HydrophobicContact CG2-CD1 3.98Å; I401-L405 HydrophobicContact CG2-CG 4.44Å; I401-L405 WeakPolarHBondContact O-CB 3.34Å; I401-L405 VanDerWaalsContact O-CG 3.31Å; I401-L405 WeakPolarHBondContact O-CG 3.48Å; I401-L405 PolarHBondContact O-N 2.81Å; Y402-L405 PolarHBondContact O-N 2.84Å; A403-L405 VanDerWaalsContact C-N 3.3Å; A403-L405 PolarHBondContact O-N 3.26Å; L405-M407 VanDerWaalsContact C-N 3.27Å; L405-M407 PolarHBondContact O-N 2.83Å; L405-H408 WeakPolarHBondContact O-CA 3.44Å; L405-H408 VanDerWaalsContact O-CB 3.3Å; L405-H408 WeakPolarHBondContact O-CB 3.46Å; L405-H408 PolarHBondContact O-N 3.42Å
406	A	50	Low	56.6	Low	56 Å²	56	91.3 Å²	91.3	46%	0.463	48%	0.48	S	S	.	.	H	α-helix	trans	-62	-35.7	172.6	0	0	0	0	0	111.8	Y402 A403 H408 E409	Y402-A406 WeakPolarHBondContact O-CB 3.2Å; Y402-A406 PolarHBondContact O-N 2.81Å; A403-A406 PolarHBondContact O-N 3.13Å; A406-H408 PolarHBondContact O-N 3.04Å; A406-E409 PolarHBondContact O-N 2.84Å
407	M	49.7	Very low	57.6	Low	140 Å²	140	86.4 Å²	86.4	69%	0.69	48%	0.477	S	S	*	.	H	α-helix	trans	-63.7	-25.6	171.8	-57.5	-156.2	-167.4	0	0	112.8	A403 L405 E409 N410	A403-M407 PolarHBondContact O-N 2.77Å; L405-M407 VanDerWaalsContact C-N 3.27Å; L405-M407 PolarHBondContact O-N 2.83Å; M407-E409 VanDerWaalsContact C-N 3.33Å; M407-E409 PolarHBondContact O-N 3.39Å; M407-N410 PolarHBondContact O-N 2.85Å
408	H	49.9	Very low	58.6	Low	90 Å²	90	88.5 Å²	88.5	42%	0.417	51%	0.505	S	S	.	.	H	α-helix	trans	-78.1	-11.5	179	-162.7	-74.9	0	0	0	113.6	L405 A406 N410 V411 L412	L405-H408 WeakPolarHBondContact O-CA 3.44Å; L405-H408 VanDerWaalsContact O-CB 3.3Å; L405-H408 WeakPolarHBondContact O-CB 3.46Å; L405-H408 PolarHBondContact O-N 3.42Å; A406-H408 PolarHBondContact O-N 3.04Å; H408-N410 PolarHBondContact O-N 2.87Å; H408-V411 PolarHBondContact O-N 3.22Å; H408-V411 VanDerWaalsContact O-N 3.1Å; H408-L412 PolarHBondContact O-N 2.96Å
409	E	45.3	Very low	60.1	Low	134 Å²	134	86 Å²	86	63%	0.626	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-23.6	169.6	-67.5	-150.8	139.2	0	0	112.7	A406 M407 K413	A406-E409 PolarHBondContact O-N 2.84Å; M407-E409 VanDerWaalsContact C-N 3.33Å; M407-E409 PolarHBondContact O-N 3.39Å; E409-K413 WeakPolarHBondContact O-CE 3.42Å
410	N	48.1	Very low	61.2	Low	114 Å²	114	86.5 Å²	86.5	61%	0.61	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-19.1	173.5	-66.5	-32.4	0	0	0	112.9	M407 H408 K413	M407-N410 PolarHBondContact O-N 2.85Å; H408-N410 PolarHBondContact O-N 2.87Å; N410-K413 PolarHBondContact OD1-NZ 3.21Å
411	V	50.6	Low	62.4	Low	96 Å²	96	80.9 Å²	80.9	58%	0.582	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-15	177.7	-174.4	0	0	0	0	112	H408	H408-V411 PolarHBondContact O-N 3.22Å; H408-V411 VanDerWaalsContact O-N 3.1Å
412	L	54.5	Low	63.5	Low	85 Å²	85	86.8 Å²	86.8	45%	0.445	49%	0.485	S	S	.	.	S	Bend	trans	-85.1	-7.8	176.7	-71.6	170.8	0	0	0	114.1	H408	H408-L412 PolarHBondContact O-N 2.96Å
413	K	67.8	Low	64.7	Low	104 Å²	104	81.5 Å²	81.5	45%	0.452	47%	0.474	S	S	.	.	S	Bend	trans	-94.3	152.6	175.2	-62.7	162.8	-167.2	162.3	0	109.4	E409 N410	E409-K413 WeakPolarHBondContact O-CE 3.42Å; N410-K413 PolarHBondContact OD1-NZ 3.21Å
414	C	76.1	Confident	66.4	Low	6 Å²	6	81.5 Å²	81.5	4%	0.041	47%	0.465	C	S	.	.			trans	-53.3	129.8	165.2	32.2	0	0	0	0	109.9	T416 C419 G421 H432	C414-T416 PolarHBondContact O-N 3.39Å; C414-C419 HydrophobicContact CB-CB 3.98Å; C414-C419 WeakPolarHBondContact CB-SG 3.23Å; C414-C419 WeakPolarHBondContact SG-CB 3.29Å; C414-C419 PolarHBondContact SG-O 3.48Å; C414-C419 CovalentContact SG-SG 2.03Å; C414-C419 PolarHBondContact SG-SG 2.97Å; C414-G421 VanDerWaalsContact SG-CA 3.53Å; C414-G421 PolarHBondContact SG-N 3.3Å; C414-H432 WeakPolarHBondContact CB-NE2 3.4Å; C414-H432 PolarHBondContact SG-NE2 3.08Å
415	P	79.3	Confident	67.9	Low	93 Å²	93	80.3 Å²	80.3	60%	0.604	46%	0.457	S	S	*	.	S	Bend	trans	-74.3	6.7	-178.9	29.3	-34.2	0	0	0	113.8	L435	P415-L435 HydrophobicContact CG-CD2 3.84Å; P415-L435 HydrophobicContact CG-CG 3.94Å
416	T	77.2	Confident	69	Low	17 Å²	17	80.8 Å²	80.8	10%	0.104	46%	0.46	C	S	.	.	S	Bend	trans	-71.4	124.9	169.2	-37.8	0	0	0	0	109.5	C414 G418 C419 L435 C438 I440 A441	C414-T416 PolarHBondContact O-N 3.39Å; T416-G418 PolarHBondContact O-N 3.18Å; T416-C419 HydrophobicContact CG2-CB 4.42Å; T416-C419 WeakPolarHBondContact O-CB 3.49Å; T416-C419 PolarHBondContact O-N 3.48Å; T416-L435 WeakPolarHBondContact OG1-CD2 3.25Å; T416-C438 PolarHBondContact OG1-SG 2.88Å; T416-I440 HydrophobicContact CG2-CB 4.22Å; T416-I440 HydrophobicContact CG2-CG2 3.91Å; T416-A441 HydrophobicContact CG2-CB 3.91Å
417	P	77.3	Confident	70.1	Confident	120 Å²	120	83.9 Å²	83.9	78%	0.779	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	141.2	174	-26.8	36	0	0	0	112.2	C419	P417-C419 PolarHBondContact O-N 3Å
418	G	74.4	Confident	71.3	Confident	79 Å²	79	84.2 Å²	84.2	81%	0.814	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	-3.9	-177.8	0	0	0	0	0	116	T416	T416-G418 PolarHBondContact O-N 3.18Å
419	C	82.7	Confident	72.8	Confident	14 Å²	14	87.7 Å²	87.7	10%	0.095	49%	0.493	C	S	.	.			trans	-84	135.7	-176.3	175	0	0	0	0	113.5	C414 T416 P417 H432 C438 I440	C414-C419 HydrophobicContact CB-CB 3.98Å; C414-C419 WeakPolarHBondContact CB-SG 3.23Å; C414-C419 WeakPolarHBondContact SG-CB 3.29Å; C414-C419 PolarHBondContact SG-O 3.48Å; C414-C419 CovalentContact SG-SG 2.03Å; C414-C419 PolarHBondContact SG-SG 2.97Å; T416-C419 HydrophobicContact CG2-CB 4.42Å; T416-C419 WeakPolarHBondContact O-CB 3.49Å; T416-C419 PolarHBondContact O-N 3.48Å; P417-C419 PolarHBondContact O-N 3Å; C419-H432 VanDerWaalsContact SG-CE1 3.54Å; C419-H432 PolarHBondContact SG-NE2 2.7Å; C419-C438 PolarHBondContact SG-SG 2.74Å; C419-I440 HydrophobicContact CB-CD1 3.97Å
420	T	79.4	Confident	74.4	Confident	110 Å²	110	86 Å²	86	68%	0.675	50%	0.496	S	S	*	.			trans	-100.5	2.7	-176.3	58.9	0	0	0	0	114.6	R422	T420-R422 PolarHBondContact O-N 3.36Å
421	G	79.3	Confident	76.1	Confident	10 Å²	10	84.7 Å²	84.7	10%	0.103	49%	0.492	C	S	.	.	S	Bend	trans	75.6	1.2	-177.9	0	0	0	0	0	114.9	C414 T431 H432	C414-G421 VanDerWaalsContact SG-CA 3.53Å; C414-G421 PolarHBondContact SG-N 3.3Å; G421-T431 CarbonylContact O-C 3.2Å; G421-T431 WeakPolarHBondContact O-CA 3.32Å; G421-T431 WeakPolarHBondContact O-CB 3.3Å; G421-H432 WeakPolarHBondContact CA-O 3.41Å; G421-H432 PolarHBondContact O-N 3.18Å
422	R	80.5	Confident	77.7	Confident	187 Å²	187	80.5 Å²	80.5	71%	0.706	47%	0.466	S	S	*	.	B	Isolated β-bridge	trans	-87.4	156	175.1	-65.3	-170.1	176.6	-151	1.7	111.9	T420 H432	T420-R422 PolarHBondContact O-N 3.36Å; R422-H432 PolarHBondContact O-CE1 3.37Å; R422-H432 VanDerWaalsContact O-CE1 3.27Å; R422-H432 PolarHBondContact O-ND1 3.23Å
423	G	77.6	Confident	79.2	Confident	31 Å²	31	84.7 Å²	84.7	32%	0.32	48%	0.476	S	S	.	.	S	Bend	trans	70.2	176.8	-169.2	0	0	0	0	0	112.6	S430 T431 H432	G423-S430 WeakPolarHBondContact CA-O 3.43Å; G423-S430 PolarHBondContact N-O 3.13Å; G423-T431 CarbonylContact O-C 3.54Å; G423-T431 VanDerWaalsContact O-C 3.27Å; G423-T431 VanDerWaalsContact O-CA 3.27Å; G423-T431 WeakPolarHBondContact O-CA 3.37Å; G423-H432 PolarHBondContact O-N 2.87Å; G423-H432 PolarHBondContact O-ND1 2.97Å
424	H	88.4	Confident	79.8	Confident	54 Å²	54	82.2 Å²	82.2	25%	0.25	47%	0.472	C	S	.	.			trans	-152.8	158.9	167.4	-164.8	-72.1	0	0	0	108.7	N426 R429 H432 G437	H424-N426 PolarHBondContact ND1-N 3.18Å; H424-N426 VanDerWaalsContact ND1-N 3.13Å; H424-N426 PolarHBondContact O-N 2.8Å; H424-R429 HydrophobicContact CB-CB 3.81Å; H424-R429 WeakPolarHBondContact CB-O 3.36Å; H424-H432 HydrophobicContact CB-CB 4.49Å; H424-G437 CarbonylContact C-O 3.58Å; H424-G437 VanDerWaalsContact CA-O 3.22Å; H424-G437 WeakPolarHBondContact CA-O 3.41Å
425	V	84.1	Confident	79.9	Confident	80 Å²	80	86.6 Å²	86.6	49%	0.485	49%	0.494	S	S	.	.	S	Bend	trans	-63.2	-5.1	169.6	178.3	0	0	0	0	113.1	G437 C438 A442	V425-G437 PolarHBondContact N-O 3.34Å; V425-C438 VanDerWaalsContact CG2-C 3.45Å; V425-C438 WeakPolarHBondContact CG2-O 3.32Å; V425-A442 HydrophobicContact CG2-CB 3.73Å
426	N	76.7	Confident	80	Confident	76 Å²	76	87 Å²	87	41%	0.406	50%	0.499	S	S	.	.	S	Bend	trans	-128.1	120	179	176.4	-23.7	0	0	0	107.6	H424 N428 R429	H424-N426 PolarHBondContact ND1-N 3.18Å; H424-N426 VanDerWaalsContact ND1-N 3.13Å; H424-N426 PolarHBondContact O-N 2.8Å; N426-N428 PolarHBondContact O-N 3.33Å; N426-N428 WeakPolarHBondContact OD1-CB 3.36Å; N426-N428 PolarHBondContact OD1-N 3.35Å; N426-R429 PolarHBondContact O-N 2.85Å
427	S	73.9	Confident	80.1	Confident	122 Å²	122	86.1 Å²	86.1	85%	0.853	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-26.7	-176.1	-50.7	0	0	0	0	114.2	R429	S427-R429 PolarHBondContact O-N 3.33Å
428	N	73.9	Confident	80.6	Confident	146 Å²	146	80.4 Å²	80.4	78%	0.781	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	6.2	-178.8	-60.5	-2.5	0	0	0	113.2	N426	N426-N428 PolarHBondContact O-N 3.33Å; N426-N428 WeakPolarHBondContact OD1-CB 3.36Å; N426-N428 PolarHBondContact OD1-N 3.35Å
429	R	82.1	Confident	80.9	Confident	164 Å²	164	79.2 Å²	79.2	62%	0.619	44%	0.435	S	S	*	.			trans	-137.6	129.9	177.4	-62.3	-174.8	-175	-82.4	-1.5	111.5	H424 N426 S427	H424-R429 HydrophobicContact CB-CB 3.81Å; H424-R429 WeakPolarHBondContact CB-O 3.36Å; N426-R429 PolarHBondContact O-N 2.85Å; S427-R429 PolarHBondContact O-N 3.33Å
430	S	79.1	Confident	80.9	Confident	99 Å²	99	82.2 Å²	82.2	69%	0.692	45%	0.449	S	S	*	.	S	Bend	trans	-92.1	-7	-175.9	56.1	0	0	0	0	115.3	G423	G423-S430 WeakPolarHBondContact CA-O 3.43Å; G423-S430 PolarHBondContact N-O 3.13Å
431	T	84.4	Confident	81	Confident	85 Å²	85	78 Å²	78	52%	0.521	43%	0.426	S	S	.	.	B	Isolated β-bridge	trans	-147.4	154.4	179.4	58.5	0	0	0	0	111.4	G421 G423	G421-T431 CarbonylContact O-C 3.2Å; G421-T431 WeakPolarHBondContact O-CA 3.32Å; G421-T431 WeakPolarHBondContact O-CB 3.3Å; G423-T431 CarbonylContact O-C 3.54Å; G423-T431 VanDerWaalsContact O-C 3.27Å; G423-T431 VanDerWaalsContact O-CA 3.27Å; G423-T431 WeakPolarHBondContact O-CA 3.37Å
432	H	84.2	Confident	81.1	Confident	9 Å²	9	79.3 Å²	79.3	4%	0.042	44%	0.435	C	S	.	.			trans	-142	163.6	177.9	68.6	-80.5	0	0	0	111.6	C414 C419 G421 R422 G423 H424 G437 C438	C414-H432 WeakPolarHBondContact CB-NE2 3.4Å; C414-H432 PolarHBondContact SG-NE2 3.08Å; C419-H432 VanDerWaalsContact SG-CE1 3.54Å; C419-H432 PolarHBondContact SG-NE2 2.7Å; G421-H432 WeakPolarHBondContact CA-O 3.41Å; G421-H432 PolarHBondContact O-N 3.18Å; R422-H432 PolarHBondContact O-CE1 3.37Å; R422-H432 VanDerWaalsContact O-CE1 3.27Å; R422-H432 PolarHBondContact O-ND1 3.23Å; G423-H432 PolarHBondContact O-N 2.87Å; G423-H432 PolarHBondContact O-ND1 2.97Å; H424-H432 HydrophobicContact CB-CB 4.49Å; H432-G437 WeakPolarHBondContact CB-O 3.44Å; H432-G437 VanDerWaalsContact CG-O 3.3Å; H432-C438 WeakPolarHBondContact CD2-CA 3.37Å; H432-C438 VanDerWaalsContact CD2-CB 3.5Å; H432-C438 WeakPolarHBondContact CD2-CB 3.24Å; H432-C438 WeakPolarHBondContact NE2-CA 3.13Å; H432-C438 VanDerWaalsContact NE2-CB 3.31Å; H432-C438 WeakPolarHBondContact NE2-CB 3.44Å; H432-C438 PolarHBondContact NE2-SG 2.91Å
433	R	85.6	Confident	80.9	Confident	173 Å²	173	73.1 Å²	73.1	65%	0.653	42%	0.424	S	S	*	.			trans	-134.2	-11.4	178.1	-59	-174.8	-174	-172.2	-0.7	114.3
434	S	79.8	Confident	80.6	Confident	52 Å²	52	75.5 Å²	75.5	36%	0.364	43%	0.432	S	S	.	.	S	Bend	trans	-108.9	159.9	178.4	59.6	0	0	0	0	111.5	S436 G437 C438	S434-S436 PolarHBondContact O-N 3.16Å; S434-S436 PolarHBondContact OG-OG 2.85Å; S434-G437 PolarHBondContact O-N 2.77Å; S434-G437 PolarHBondContact OG-N 2.69Å; S434-C438 PolarHBondContact O-N 3.41Å
435	L	78.9	Confident	79.7	Confident	97 Å²	97	81.7 Å²	81.7	51%	0.508	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-56.2	-38.7	170.5	-63.4	177.2	0	0	0	112	P415 T416 G437 C438 A441	P415-L435 HydrophobicContact CG-CD2 3.84Å; P415-L435 HydrophobicContact CG-CG 3.94Å; T416-L435 WeakPolarHBondContact OG1-CD2 3.25Å; L435-G437 VanDerWaalsContact C-N 3.26Å; L435-G437 PolarHBondContact O-N 3.08Å; L435-C438 WeakPolarHBondContact O-CB 3.49Å; L435-C438 PolarHBondContact O-N 3.33Å; L435-A441 HydrophobicContact CD2-CB 4.21Å
436	S	79.7	Confident	78.3	Confident	101 Å²	101	84 Å²	84	71%	0.706	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-63.9	-25.2	179.3	52.4	0	0	0	0	114.5	S434	S434-S436 PolarHBondContact O-N 3.16Å; S434-S436 PolarHBondContact OG-OG 2.85Å
437	G	80.4	Confident	77	Confident	0 Å²	0	84.6 Å²	84.6	0%	0	48%	0.483	C	S	.	.	G	3₁₀ helix	trans	-94.7	-4.7	173.7	0	0	0	0	0	113.8	H424 V425 H432 S434 L435 P439	H424-G437 CarbonylContact C-O 3.58Å; H424-G437 VanDerWaalsContact CA-O 3.22Å; H424-G437 WeakPolarHBondContact CA-O 3.41Å; V425-G437 PolarHBondContact N-O 3.34Å; H432-G437 WeakPolarHBondContact CB-O 3.44Å; H432-G437 VanDerWaalsContact CG-O 3.3Å; S434-G437 PolarHBondContact O-N 2.77Å; S434-G437 PolarHBondContact OG-N 2.69Å; L435-G437 VanDerWaalsContact C-N 3.26Å; L435-G437 PolarHBondContact O-N 3.08Å; G437-P439 WeakPolarHBondContact O-CD 3.35Å
438	C	87.7	Confident	75.2	Confident	0 Å²	0	86.3 Å²	86.3	0%	0	48%	0.475	C	S	.	.			trans	-88.9	115.5	-168.3	-174.8	0	0	0	0	112.7	T416 C419 V425 H432 S434 L435 I440 A441 A442	T416-C438 PolarHBondContact OG1-SG 2.88Å; C419-C438 PolarHBondContact SG-SG 2.74Å; V425-C438 VanDerWaalsContact CG2-C 3.45Å; V425-C438 WeakPolarHBondContact CG2-O 3.32Å; H432-C438 WeakPolarHBondContact CD2-CA 3.37Å; H432-C438 VanDerWaalsContact CD2-CB 3.5Å; H432-C438 WeakPolarHBondContact CD2-CB 3.24Å; H432-C438 WeakPolarHBondContact NE2-CA 3.13Å; H432-C438 VanDerWaalsContact NE2-CB 3.31Å; H432-C438 WeakPolarHBondContact NE2-CB 3.44Å; H432-C438 PolarHBondContact NE2-SG 2.91Å; S434-C438 PolarHBondContact O-N 3.41Å; L435-C438 WeakPolarHBondContact O-CB 3.49Å; L435-C438 PolarHBondContact O-N 3.33Å; C438-I440 VanDerWaalsContact C-N 3.27Å; C438-I440 PolarHBondContact O-N 3.26Å; C438-A441 HydrophobicContact CB-CB 3.81Å; C438-A441 PolarHBondContact O-N 2.92Å; C438-A441 PolarHBondContact SG-N 3.5Å; C438-A442 WeakPolarHBondContact O-CB 3.49Å; C438-A442 PolarHBondContact O-N 3.25Å
439	P	81.5	Confident	73.3	Confident	54 Å²	54	85.5 Å²	85.5	35%	0.351	48%	0.477	S	S	.	.	H	α-helix	trans	-64	-32.6	179.6	25.8	-33.1	0	0	0	112.4	G437 A442 A443	G437-P439 WeakPolarHBondContact O-CD 3.35Å; P439-A442 PolarHBondContact O-N 3.32Å; P439-A443 WeakPolarHBondContact O-CB 3.34Å; P439-A443 PolarHBondContact O-N 2.94Å
440	I	81.4	Confident	70.8	Confident	76 Å²	76	86.5 Å²	86.5	39%	0.39	49%	0.489	S	S	.	.	H	α-helix	trans	-67	-45.2	176.6	-59.4	166.4	0	0	0	110.6	T416 C419 C438 A442 A443 V444	T416-I440 HydrophobicContact CG2-CB 4.22Å; T416-I440 HydrophobicContact CG2-CG2 3.91Å; C419-I440 HydrophobicContact CB-CD1 3.97Å; C438-I440 VanDerWaalsContact C-N 3.27Å; C438-I440 PolarHBondContact O-N 3.26Å; I440-A442 VanDerWaalsContact C-N 3.35Å; I440-A443 PolarHBondContact O-N 2.97Å; I440-V444 WeakPolarHBondContact O-CG2 3.42Å; I440-V444 PolarHBondContact O-N 2.86Å; I440-V444 VanDerWaalsContact O-N 3.13Å
441	A	82	Confident	68.4	Low	23 Å²	23	89.1 Å²	89.1	19%	0.19	50%	0.495	C	S	.	.	H	α-helix	trans	-69.4	-33.4	177.7	0	0	0	0	0	112.4	T416 L435 C438 K445	T416-A441 HydrophobicContact CG2-CB 3.91Å; L435-A441 HydrophobicContact CD2-CB 4.21Å; C438-A441 HydrophobicContact CB-CB 3.81Å; C438-A441 PolarHBondContact O-N 2.92Å; C438-A441 PolarHBondContact SG-N 3.5Å; A441-K445 WeakPolarHBondContact O-CB 3.44Å; A441-K445 PolarHBondContact O-N 3.43Å
442	A	80.8	Confident	66	Low	36 Å²	36	92 Å²	92	30%	0.298	50%	0.503	S	S	.	.	H	α-helix	trans	-63	-51.9	173.5	0	0	0	0	0	110.9	V425 C438 P439 I440 V444 K445 V446	V425-A442 HydrophobicContact CG2-CB 3.73Å; C438-A442 WeakPolarHBondContact O-CB 3.49Å; C438-A442 PolarHBondContact O-N 3.25Å; P439-A442 PolarHBondContact O-N 3.32Å; I440-A442 VanDerWaalsContact C-N 3.35Å; A442-V444 PolarHBondContact O-N 2.91Å; A442-K445 WeakPolarHBondContact O-CA 3.29Å; A442-K445 WeakPolarHBondContact O-CB 3.46Å; A442-K445 PolarHBondContact O-N 2.84Å; A442-V446 VanDerWaalsContact O-CG2 3.28Å; A442-V446 WeakPolarHBondContact O-CG2 3.23Å; A442-V446 PolarHBondContact O-N 3.18Å; A442-V446 VanDerWaalsContact O-N 3.14Å
443	A	76.8	Confident	63.5	Low	58 Å²	58	95.9 Å²	95.9	48%	0.479	53%	0.531	S	S	.	.	H	α-helix	trans	-55.3	-48.7	178.3	0	0	0	0	0	112.4	P439 I440 K445 V446 S447	P439-A443 WeakPolarHBondContact O-CB 3.34Å; P439-A443 PolarHBondContact O-N 2.94Å; I440-A443 PolarHBondContact O-N 2.97Å; A443-K445 PolarHBondContact O-N 2.84Å; A443-K445 VanDerWaalsContact O-N 3.17Å; A443-V446 PolarHBondContact O-N 3.43Å; A443-V446 VanDerWaalsContact O-N 3.07Å; A443-S447 PolarHBondContact O-N 2.79Å; A443-S447 VanDerWaalsContact O-N 3.08Å; A443-S447 PolarHBondContact O-OG 3.18Å
444	V	70.7	Confident	60.9	Low	80 Å²	80	93.8 Å²	93.8	49%	0.485	53%	0.532	S	S	.	.	H	α-helix	trans	-62.7	-21.5	177.2	173	0	0	0	0	113	I440 A442	I440-V444 WeakPolarHBondContact O-CG2 3.42Å; I440-V444 PolarHBondContact O-N 2.86Å; I440-V444 VanDerWaalsContact O-N 3.13Å; A442-V444 PolarHBondContact O-N 2.91Å
445	K	69.1	Low	58.6	Low	184 Å²	184	100.3 Å²	100.3	80%	0.8	55%	0.554	S	S	*	*	H	α-helix	trans	-86.4	-23.2	175.7	-165.7	175.6	179.8	-172.6	0	113.4	A441 A442 A443	A441-K445 WeakPolarHBondContact O-CB 3.44Å; A441-K445 PolarHBondContact O-N 3.43Å; A442-K445 WeakPolarHBondContact O-CA 3.29Å; A442-K445 WeakPolarHBondContact O-CB 3.46Å; A442-K445 PolarHBondContact O-N 2.84Å; A443-K445 PolarHBondContact O-N 2.84Å; A443-K445 VanDerWaalsContact O-N 3.17Å
446	V	55.5	Low	55.8	Low	129 Å²	129	101.5 Å²	101.5	78%	0.782	57%	0.569	S	S	*	*	H	α-helix	trans	-84	-26.4	171.4	-148.9	0	0	0	0	111.6	A442 A443 K448	A442-V446 VanDerWaalsContact O-CG2 3.28Å; A442-V446 WeakPolarHBondContact O-CG2 3.23Å; A442-V446 PolarHBondContact O-N 3.18Å; A442-V446 VanDerWaalsContact O-N 3.14Å; A443-V446 PolarHBondContact O-N 3.43Å; A443-V446 VanDerWaalsContact O-N 3.07Å; V446-K448 VanDerWaalsContact C-N 3.31Å; V446-K448 PolarHBondContact O-N 3.05Å
447	S	50.3	Low	53.4	Low	89 Å²	89	107 Å²	107	62%	0.622	57%	0.574	S	S	*	*	S	Bend	trans	-89.8	31.2	-175.9	73.7	0	0	0	0	114.6	A443	A443-S447 PolarHBondContact O-N 2.79Å; A443-S447 VanDerWaalsContact O-N 3.08Å; A443-S447 PolarHBondContact O-OG 3.18Å
448	K	34.3	Very low	50.8	Low	158 Å²	158	115.4 Å²	115.4	69%	0.687	61%	0.613	S	S	*	*			trans	-135.5	123.9	173.6	-76.6	-166.6	173.2	-166.6	0	110.9	V446	V446-K448 VanDerWaalsContact C-N 3.31Å; V446-K448 PolarHBondContact O-N 3.05Å
449	P	34.5	Very low	48	Very low	128 Å²	128	120.5 Å²	120.5	83%	0.831	64%	0.644	S	S	*	*			trans	-66.3	151.2	164.5	30.7	-33.7	0	0	0	109.8
450	Q	29.9	Very low	46.1	Very low	185 Å²	185	123.8 Å²	123.8	86%	0.864	67%	0.666	S	S	*	*			trans	-89.6	116.6	174	179.7	177.3	-9	0	0	109.2
451	D	29.5	Very low	43.4	Very low	154 Å²	154	127.7 Å²	127.7	82%	0.824	69%	0.687	S	S	*	*			trans	-137.5	144.7	167.8	-167.9	14.4	0	0	0	109.4
452	E	33	Very low	41	Very low	147 Å²	147	136.8 Å²	136.8	69%	0.687	72%	0.717	S	S	*	*			trans	-146.1	132.4	-169.5	-86.4	-91.9	-166	0	0	106.5
453	S	32.1	Very low	38.6	Very low	90 Å²	90	140.1 Å²	140.1	63%	0.629	74%	0.738	S	S	*	*			cis	-169.8	-166.6	24.6	-158.8	0	0	0	0	112.4
454	L	31.8	Very low	37.5	Very low	128 Å²	128	142.3 Å²	142.3	67%	0.67	75%	0.747	S	S	*	*			trans	87.4	102.7	158.4	-51.7	-171.5	0	0	0	121.9
455	K	29.8	Very low	35.8	Very low	189 Å²	189	150.1 Å²	150.1	82%	0.822	77%	0.768	S	S	*	*				63.5	118.4	124.3	-64.1	168.4	-179.4	163.1	0	121.1
456	C	21.8	Very low	33.8	Very low	122 Å²	122	145 Å²	145	82%	0.824	76%	0.76	S	S	*	*				-148	162.7	111.6	-156.3	0	0	0	0	111.7
457	R	27.7	Very low	32.7	Very low	217 Å²	217	146.1 Å²	146.1	82%	0.819	76%	0.76	S	S	*	*			trans	-145.9	130.7	-179.3	174.2	-160.5	-177.1	-142.2	2.8	108.4
458	Q	27.1	Very low	31.6	Very low	177 Å²	177	146.8 Å²	146.8	83%	0.827	76%	0.764	S	S	*	*			trans	-138.8	132.1	166.7	-68.6	-162.2	16.1	0	0	113.4
459	T	29.2	Very low	31.7	Very low	106 Å²	106	146 Å²	146	65%	0.65	77%	0.767	S	S	*	*			trans	-153.3	116.4	163	49.3	0	0	0	0	107.2
460	P	41.9	Very low	31.5	Very low	124 Å²	124	146.9 Å²	146.9	81%	0.805	76%	0.763	S	S	*	*			trans	-84	160.2	168	36.8	-34.6	0	0	0	110
461	D	24.5	Very low	31.6	Very low	157 Å²	157	146.5 Å²	146.5	84%	0.84	76%	0.759	S	S	*	*			cis	-154.8	178.9	6.4	-159.8	-1.4	0	0	0	111.7
462	R	30.8	Very low	31.6	Very low	215 Å²	215	148.7 Å²	148.7	81%	0.811	76%	0.761	S	S	*	*			trans	115.9	65	139.4	-146.2	170.9	-165.3	166.4	6.6	121.2
463	S	29.9	Very low	31.2	Very low	106 Å²	106	149.7 Å²	149.7	74%	0.741	76%	0.763	S	S	*	*				79.8	157.7	125.9	79.1	0	0	0	0	122.3
464	P	54.5	Low	31	Very low	103 Å²	103	152.2 Å²	152.2	67%	0.669	77%	0.765	S	S	*	*			trans	-140.9	179.8	-150.7	44.6	-26.3	0	0	0	118.4
465	R	34.2	Very low	30.6	Very low	245 Å²	245	153 Å²	153	93%	0.925	77%	0.767	S	S	*	*			trans	149	155.5	152.3	-88.8	173.7	-87.5	-153.6	-1.2	111
466	A	27.4	Very low	30.2	Very low	76 Å²	76	149.6 Å²	149.6	63%	0.628	76%	0.758	S	S	*	*			cis	-163.8	136.7	-8.9	0	0	0	0	0	109.8
467	I	31.9	Very low	30.4	Very low	153 Å²	153	151 Å²	151	79%	0.785	75%	0.752	S	S	*	*				90.9	120.4	99.9	-67.5	175.5	0	0	0	118
468	S	28.8	Very low	30.3	Very low	102 Å²	102	147.9 Å²	147.9	71%	0.713	75%	0.751	S	S	*	*			trans	60.4	158.5	152.3	-66.4	0	0	0	0	121.2
469	L	34.7	Very low	30.3	Very low	142 Å²	142	147.5 Å²	147.5	74%	0.743	76%	0.755	S	S	*	*			cis	-159.3	-174	-16.1	-101.9	167.2	0	0	0	106.1
470	I	31.7	Very low	30	Very low	146 Å²	146	153.2 Å²	153.2	75%	0.749	77%	0.766	S	S	*	*			cis	-153.8	153	7.4	-140.9	153.8	0	0	0	105
471	K	31.3	Very low	29.2	Very low	178 Å²	178	158.3 Å²	158.3	77%	0.774	77%	0.769	S	S	*	*			cis	103.4	75.9	17.1	-160.4	-165.5	173.4	-179.4	0	117.3
472	K	29.3	Very low	29.3	Very low	199 Å²	199	157.8 Å²	157.8	87%	0.865	77%	0.766	S	S	*	*			trans	-174	127.5	143.7	-98.4	166.5	-175.5	-172.4	0	108.6
473	F	24.2	Very low	28.9	Very low	168 Å²	168	152.5 Å²	152.5	74%	0.737	76%	0.762	S	S	*	*				58.6	128.5	66.4	-86.6	-115.5	0	0	0	112.9
474	E	27.8	Very low	28.6	Very low	144 Å²	144	156.2 Å²	156.2	67%	0.673	77%	0.767	S	S	*	*			cis	-167.9	176.3	-8.3	-135.4	171.6	-159.3	0	0	106.9
475	M	23.8	Very low	28.2	Very low	143 Å²	143	156.3 Å²	156.3	70%	0.704	77%	0.768	S	S	*	*			cis	-150.4	-168.3	6	-161.7	27.1	173.1	0	0	105.7
476	N	22.7	Very low	27.7	Very low	119 Å²	119	150.8 Å²	150.8	64%	0.636	76%	0.761	S	S	*	*			cis	-157.9	154.5	17.4	-152.7	-11.6	0	0	0	110.7
477	Q	26.1	Very low	27.8	Very low	150 Å²	150	151.9 Å²	151.9	70%	0.701	77%	0.77	S	S	*	*			trans	57.3	103.8	163.9	-53.8	-160	50.8	0	0	124
478	L	25.7	Very low	27.4	Very low	152 Å²	152	149 Å²	149	80%	0.796	77%	0.769	S	S	*	*				63.9	105.7	124.4	-60.1	174.7	0	0	0	122.4
479	N	25.1	Very low	27.3	Very low	169 Å²	169	152.3 Å²	152.3	90%	0.904	78%	0.777	S	S	*	*			trans	-155.1	164.8	140.2	-127	-65.4	0	0	0	112.7
480	Y	24.8	Very low	27.2	Very low	226 Å²	226	154.1 Å²	154.1	89%	0.886	78%	0.782	S	S	*	*			trans	-76.6	130.9	-168.6	-98	-110.7	0	0	0	115.5
481	R	23.4	Very low	26.8	Very low	232 Å²	232	153.8 Å²	153.8	88%	0.875	79%	0.787	S	S	*	*			trans	-164.3	163.8	134.9	-123.2	-172	176.5	-170.9	0.6	116.5
482	L	28.1	Very low	26.6	Very low	146 Å²	146	150 Å²	150	76%	0.764	78%	0.783	S	S	*	*			trans	-41	151.2	178.9	-83.7	57.8	0	0	0	118.5
483	S	22.7	Very low	26.4	Very low	104 Å²	104	147.8 Å²	147.8	73%	0.727	78%	0.78	S	S	*	*				113.6	127.4	129.6	72.1	0	0	0	0	121
484	H	22.7	Very low	26.4	Very low	183 Å²	183	145.1 Å²	145.1	85%	0.847	78%	0.778	S	S	*	*			trans	74.9	163.8	148.4	-86.2	74.7	0	0	0	117.8
485	P	46.4	Very low	26.6	Very low	106 Å²	106	147.9 Å²	147.9	69%	0.688	79%	0.787	S	S	*	*			trans	-133.1	-157.5	-130.7	37.4	-15.1	0	0	0	115.5
486	V	23.6	Very low	26.9	Very low	129 Å²	129	149.9 Å²	149.9	78%	0.782	80%	0.795	S	S	*	*			trans	102	101.8	160.7	-172.5	0	0	0	0	118.4
487	A	29	Very low	27.2	Very low	98 Å²	98	150.8 Å²	150.8	81%	0.81	80%	0.797	S	S	*	*			trans	41	123.5	133.8	0	0	0	0	0	123.7
488	A	24.5	Very low	27.2	Very low	93 Å²	93	149.8 Å²	149.8	77%	0.769	80%	0.796	S	S	*	*			trans	-158.9	149.6	142.9	0	0	0	0	0	107.4
489	L	25.5	Very low	27.6	Very low	171 Å²	171	152.3 Å²	152.3	90%	0.895	80%	0.801	S	S	*	*			cis	-152.9	163.2	-7.5	-119.2	170.3	0	0	0	109.3
490	Q	32.3	Very low	27.8	Very low	181 Å²	181	152.4 Å²	152.4	85%	0.846	79%	0.79	S	S	*	*			trans	-94.3	135.1	177.7	-66.6	177.6	-56.8	0	0	112.8
491	T	24.4	Very low	27.8	Very low	138 Å²	138	145 Å²	145	85%	0.847	77%	0.771	S	S	*	*			trans	-167.8	143.3	148.7	34.4	0	0	0	0	107.8
492	S	26.4	Very low	28	Very low	99 Å²	99	144.5 Å²	144.5	69%	0.692	77%	0.769	S	S	*	*			cis	-168.1	163.9	-4.7	48.4	0	0	0	0	111.2
493	L	24.2	Very low	27.9	Very low	153 Å²	153	144.6 Å²	144.6	80%	0.801	77%	0.769	S	S	*	*			trans	7	143	141.6	-93.9	78.1	0	0	0	118.6
494	T	25.5	Very low	28.4	Very low	112 Å²	112	149.8 Å²	149.8	69%	0.687	77%	0.773	S	S	*	*			cis	-166.2	171.4	20.7	-16.3	0	0	0	0	111.6
495	K	32.5	Very low	28.6	Very low	201 Å²	201	149.8 Å²	149.8	87%	0.874	77%	0.771	S	S	*	*			trans	76.5	143.3	176	-50.6	170.6	-173.6	177.2	0	112.8
496	E	29.4	Very low	27.9	Very low	186 Å²	186	149.9 Å²	149.9	87%	0.869	77%	0.765	S	S	*	*			cis	-128.3	145.5	6.6	-166.6	166.3	158.2	0	0	111.4
497	M	28.1	Very low	28.2	Very low	137 Å²	137	155.1 Å²	155.1	68%	0.675	77%	0.773	S	S	*	*			trans	-117.9	107.6	171.8	-75.4	-130	73.6	0	0	108.9	Y500	M497-Y500 HydrophobicContact CE-CE2 3.88Å; M497-Y500 HydrophobicContact SD-CE2 4.4Å
498	D	26	Very low	28.6	Very low	129 Å²	129	155.1 Å²	155.1	69%	0.69	77%	0.773	S	S	*	*			trans	-170.2	102.6	138.5	-109	-23.6	0	0	0	114.2
499	K	34.7	Very low	29.1	Very low	205 Å²	205	154.2 Å²	154.2	89%	0.891	76%	0.761	S	S	*	*				-170.5	70.7	127	-98.2	149.3	-167.7	166.7	0	112.3
500	Y	28.8	Very low	29.5	Very low	171 Å²	171	154.5 Å²	154.5	67%	0.671	76%	0.755	S	S	*	*			trans	-40	150.8	137.8	-76.2	-79.6	0	0	0	111.2	M497	M497-Y500 HydrophobicContact CE-CE2 3.88Å; M497-Y500 HydrophobicContact SD-CE2 4.4Å
501	S	25	Very low	29.7	Very low	71 Å²	71	154.4 Å²	154.4	50%	0.497	76%	0.761	S	S	.	*			cis	-177.7	167.3	-0.9	55.5	0	0	0	0	112.1
502	R	28.2	Very low	30.4	Very low	221 Å²	221	151.7 Å²	151.7	83%	0.834	75%	0.752	S	S	*	*			trans	67.2	156.4	154.8	-66.7	158.6	-168.8	174.4	5.3	114.8
503	I	26.4	Very low	31	Very low	149 Å²	149	154.8 Å²	154.8	76%	0.764	76%	0.756	S	S	*	*			cis	-144.5	175.1	-8	-121.4	159.4	0	0	0	108.8
504	R	33.6	Very low	31.6	Very low	212 Å²	212	153.7 Å²	153.7	80%	0.8	76%	0.755	S	S	*	*			trans	-40.4	151.8	-179	-55.7	-178.3	-176.6	-170	2	115.9
505	F	27	Very low	32	Very low	183 Å²	183	158.5 Å²	158.5	80%	0.803	77%	0.767	S	S	*	*			trans	-140.9	137.6	148.4	-131.7	-92.7	0	0	0	110.3
506	D	31.5	Very low	32.1	Very low	108 Å²	108	151.3 Å²	151.3	58%	0.578	75%	0.75	S	S	*	*			trans	-93.6	142	-179.5	-76.1	-69.5	0	0	0	111.2	A508	D506-A508 PolarHBondContact O-N 3.35Å
507	Y	29.9	Very low	32.1	Very low	239 Å²	239	152.2 Å²	152.2	94%	0.937	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	23.7	175.3	-160.1	-102.9	0	0	0	112.8
508	A	37	Very low	32	Very low	98 Å²	98	154.2 Å²	154.2	81%	0.81	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	7	-178.8	0	0	0	0	0	113.1	D506	D506-A508 PolarHBondContact O-N 3.35Å
509	S	34.2	Very low	32.3	Very low	75 Å²	75	153.7 Å²	153.7	52%	0.524	76%	0.762	S	S	.	*	S	Bend	trans	-150.1	52.7	-165.7	60	0	0	0	0	113.6
510	F	33.6	Very low	31.9	Very low	177 Å²	177	151.6 Å²	151.6	78%	0.776	76%	0.76	S	S	*	*	S	Bend	trans	-132.9	-17	171.8	-157.9	-96.9	0	0	0	115.2	A512	F510-A512 PolarHBondContact O-N 2.83Å
511	D	38	Very low	31.7	Very low	178 Å²	178	151.5 Å²	151.5	95%	0.952	77%	0.77	S	S	*	*	S	Bend	trans	-89	16.6	179.2	-149.9	28.6	0	0	0	113.5
512	A	38.9	Very low	31.7	Very low	82 Å²	82	151 Å²	151	68%	0.678	78%	0.775	S	S	*	*	S	Bend	trans	-132	140.6	170.5	0	0	0	0	0	109.9	F510	F510-A512 PolarHBondContact O-N 2.83Å
513	Q	38.1	Very low	31.6	Very low	164 Å²	164	146.5 Å²	146.5	77%	0.766	77%	0.773	S	S	*	*	S	Bend	trans	77.5	44.5	166.1	-151.4	169.8	0.7	0	0	119
514	V	37.9	Very low	31.4	Very low	130 Å²	130	146.3 Å²	146.3	79%	0.788	77%	0.773	S	S	*	*	S	Bend	trans	-106	-12.2	141.6	-179.4	0	0	0	0	112.4
515	F	33.6	Very low	31.1	Very low	213 Å²	213	144.7 Å²	144.7	93%	0.934	78%	0.775	S	S	*	*	S	Bend	trans	-114.7	97.5	152.2	-72.9	-70.2	0	0	0	109.4
516	G	35	Very low	30.9	Very low	49 Å²	49	142.7 Å²	142.7	51%	0.505	77%	0.773	S	S	.	*			trans	-141.8	122.2	172.7	0	0	0	0	0	111.1
517	K	27.8	Very low	30.6	Very low	206 Å²	206	146.6 Å²	146.6	90%	0.896	79%	0.788	S	S	*	*			trans	-138.8	108.9	155.6	-82.3	-155.6	173.6	-171.8	0	111.1
518	Q	27.8	Very low	30.2	Very low	179 Å²	179	143.2 Å²	143.2	84%	0.836	78%	0.78	S	S	*	*			trans	71.8	114.3	145.4	-158.7	163.8	7.9	0	0	119.3
519	P	31.9	Very low	29.5	Very low	117 Å²	117	145.9 Å²	145.9	76%	0.76	78%	0.778	S	S	*	*			trans	-95.7	172.6	164.8	38.7	-33.8	0	0	0	112.5
520	L	25.1	Very low	29.1	Very low	161 Å²	161	149 Å²	149	84%	0.843	79%	0.788	S	S	*	*			trans	-138	165.5	160.8	-144.1	75.4	0	0	0	110.1
521	L	25.6	Very low	28.4	Very low	170 Å²	170	149.5 Å²	149.5	89%	0.89	79%	0.792	S	S	*	*			trans	-54.4	159.1	-177.3	-78.3	54.2	0	0	0	113.4
522	G	23.8	Very low	27.9	Very low	59 Å²	59	151.5 Å²	151.5	61%	0.608	79%	0.788	S	S	*	*			cis	147.4	-173.8	4.8	0	0	0	0	0	111.6
523	T	26.6	Very low	28.3	Very low	128 Å²	128	152.6 Å²	152.6	79%	0.785	79%	0.788	S	S	*	*			trans	76.1	121.6	-177	73.8	0	0	0	0	114.8
524	N	23.4	Very low	27.4	Very low	144 Å²	144	152 Å²	152	77%	0.77	79%	0.791	S	S	*	*				76.7	143.3	86.8	-54.2	-22.4	0	0	0	112.7
525	Q	26.2	Very low	26.7	Very low	178 Å²	178	150.8 Å²	150.8	83%	0.832	79%	0.788	S	S	*	*			cis	-153.6	175.2	13.3	-151.4	165.1	5.9	0	0	112
526	D	22.5	Very low	27.1	Very low	142 Å²	142	145.6 Å²	145.6	76%	0.759	78%	0.775	S	S	*	*			trans	-68	165.3	178.1	-41	-102.5	0	0	0	114.9
527	Q	25.2	Very low	26.6	Very low	190 Å²	190	151.8 Å²	151.8	89%	0.888	79%	0.791	S	S	*	*				169	165.8	100.7	-164.7	149.7	49.4	0	0	114
528	E	23	Very low	26.4	Very low	167 Å²	167	150.1 Å²	150.1	78%	0.78	79%	0.786	S	S	*	*			trans	-90.2	148	-172.3	-59.3	170.8	81.3	0	0	115.7
529	M	21.1	Very low	26.2	Very low	154 Å²	154	151 Å²	151	76%	0.759	78%	0.784	S	S	*	*				57.7	129.6	125.5	-166.8	161	164.7	0	0	123.1
530	L	25.8	Very low	25.8	Very low	140 Å²	140	150.9 Å²	150.9	73%	0.733	79%	0.785	S	S	*	*			trans	65.8	118.8	156.2	-78.1	173.1	0	0	0	120.6
531	Q	19.9	Very low	25.8	Very low	188 Å²	188	146.6 Å²	146.6	88%	0.879	78%	0.781	S	S	*	*				-176.3	147.5	103.1	-101.4	174.9	-9.7	0	0	115.5
532	Y	26	Very low	25.7	Very low	221 Å²	221	146.1 Å²	146.1	87%	0.867	78%	0.777	S	S	*	*			trans	-103.7	172.2	151.7	-115.5	-110.7	0	0	0	106.4
533	P	47.3	Very low	25.8	Very low	104 Å²	104	151.6 Å²	151.6	68%	0.675	79%	0.792	S	S	*	*			cis	-135	-170.3	8.7	44.8	-27.8	0	0	0	114.3
534	D	20.3	Very low	25.6	Very low	153 Å²	153	149.2 Å²	149.2	82%	0.818	79%	0.793	S	S	*	*				-177.1	-171.8	104.1	-139.1	-37.8	0	0	0	113
535	S	22.4	Very low	25.7	Very low	103 Å²	103	147 Å²	147	72%	0.72	79%	0.794	S	S	*	*			trans	-136.6	-154.3	-165	-126.9	0	0	0	0	112.2
536	P	41.5	Very low	25.7	Very low	105 Å²	105	144.6 Å²	144.6	68%	0.682	80%	0.797	S	S	*	*			cis	-132.8	175.2	-46.9	38.1	-23.3	0	0	0	114.4
537	Q	25.5	Very low	25.7	Very low	179 Å²	179	142.1 Å²	142.1	84%	0.836	81%	0.805	S	S	*	*			trans	-179.4	125.9	146.7	-99.6	159.8	25.1	0	0	110.3
538	Q	24.3	Very low	25.6	Very low	170 Å²	170	136.5 Å²	136.5	79%	0.794	80%	0.798	S	S	*	*				69.5	132.8	76.8	-64.8	-153.1	-16.4	0	0	115.4
539	Y	22.7	Very low	25.6	Very low	198 Å²	198	135.1 Å²	135.1	78%	0.776	81%	0.806	S	S	*	*			cis	-161.1	174.8	-2.8	-145.8	-102.5	0	0	0	113.3
540	S	23.9	Very low	25.9	Very low	114 Å²	114	134.4 Å²	134.4	80%	0.797	81%	0.809	S	S	*	*			trans	73.2	142.3	166.5	-56.8	0	0	0	0	119.8
541	G	24.1	Very low	27.1	Very low	72 Å²	72	132.7 Å²	132.7	74%	0.742	81%	0.807	S	S	*	*			cis	173.5	134.9	-12.5	0	0	0	0	0	117.1
542	I	24.8	Very low	27.3	Very low	159 Å²	159	130.9 Å²	130.9	82%	0.815	80%	0.802	S	S	*	*			trans	71.6	109.5	149.6	-54.8	-177.6	0	0	0	122.6
543	L	26.6	Very low	27.2	Very low	175 Å²	175	125.9 Å²	125.9	92%	0.916	80%	0.799	S	S	*	*			trans	33.9	140.9	135.2	-57.8	172.5	0	0	0	124.8
544	G	22.2	Very low	26.2	Very low	78 Å²	78	124.4 Å²	124.4	80%	0.804	80%	0.803	S	S	*	*			trans	-168.3	145.2	153.8	0	0	0	0	0	111.6
545	A	25	Very low	26.6	Very low	98 Å²	98	124.8 Å²	124.8	81%	0.81	80%	0.8	S	S	*	*			trans	-152.2	155.6	-171.7	0	0	0	0	0	116.2
546	S	25.2	Very low	26.7	Very low	126 Å²	126	128.3 Å²	128.3	88%	0.881	81%	0.805	S	S	*	*			trans	56.6	110.7	151	-61	0	0	0	0	122.8
547	G	23.1	Very low	26.1	Very low	90 Å²	90	128.3 Å²	128.3	93%	0.928	81%	0.807	S	S	*	*				104.4	155.9	124.8	0	0	0	0	0	119.8
548	G	23	Very low	27	Very low	73 Å²	73	125.5 Å²	125.5	75%	0.753	80%	0.804	S	S	*	*			trans	129.1	84.1	154.7	0	0	0	0	0	120.2
549	C	23.7	Very low	28.1	Very low	138 Å²	138	122.8 Å²	122.8	93%	0.932	80%	0.801	S	S	*	*			trans	61.5	161.3	139.3	-63.8	0	0	0	0	124.3
550	V	27.6	Very low	28.1	Very low	138 Å²	138	118.7 Å²	118.7	84%	0.836	80%	0.801	S	S	*	*			trans	-121.1	-171	174.9	-119.1	0	0	0	0	107.4
551	P	49.8	Very low	28.5	Very low	105 Å²	105	120.9 Å²	120.9	68%	0.682	80%	0.799	S	S	*	*			cis	-136	-166.9	-8.4	28.3	-3	0	0	0	114.4
552	I	24.3	Very low	28.5	Very low	150 Å²	150	124.9 Å²	124.9	77%	0.769	80%	0.796	S	S	*	*				163.9	142.6	121.3	-85.7	165.5	0	0	0	114.8
553	S	25.3	Very low	28.7	Very low	115 Å²	115	125.9 Å²	125.9	80%	0.804	80%	0.795	S	S	*	*			trans	24.1	157	159.7	-58.8	0	0	0	0	123.5
554	G	24.3	Very low	28.6	Very low	74 Å²	74	125.3 Å²	125.3	76%	0.763	79%	0.785	S	S	*	*			cis	169.1	-165.2	8.9	0	0	0	0	0	109
555	Q	30.2	Very low	28.9	Very low	161 Å²	161	128.4 Å²	128.4	75%	0.752	78%	0.779	S	S	*	*			cis	-171.4	159.3	-19.4	-146.1	175.3	1.4	0	0	110.8
556	H	24.2	Very low	29	Very low	177 Å²	177	130.8 Å²	130.8	82%	0.819	78%	0.778	S	S	*	*			trans	80.8	160.4	157.1	-68	-62.4	0	0	0	125.5
557	S	28.9	Very low	29.2	Very low	104 Å²	104	130.4 Å²	130.4	73%	0.727	78%	0.775	S	S	*	*			trans	-179.1	-174.8	-175.7	-71.6	0	0	0	0	107.8
558	P	44.6	Very low	29.8	Very low	120 Å²	120	132.2 Å²	132.2	78%	0.779	76%	0.763	S	S	*	*			cis	-122.5	-115	-4.7	29.2	-2.3	0	0	0	111.2
559	P	46	Very low	30.4	Very low	114 Å²	114	138.8 Å²	138.8	74%	0.74	77%	0.774	S	S	*	*			cis	-136.3	162.7	-41.5	35.1	-15.2	0	0	0	118.3
560	S	24.5	Very low	30.9	Very low	111 Å²	111	135.7 Å²	135.7	78%	0.776	76%	0.758	S	S	*	*			trans	-168	111.7	153.8	-176.7	0	0	0	0	110.5
561	Q	31	Very low	31.3	Very low	160 Å²	160	135 Å²	135	75%	0.748	75%	0.754	S	S	*	*				53.9	132.7	81.8	-53	-163.6	5.1	0	0	114.8
562	F	25.5	Very low	30.7	Very low	157 Å²	157	135.2 Å²	135.2	69%	0.689	76%	0.764	S	S	*	*			cis	-150.6	146	34.8	-123	-100.9	0	0	0	113.9
563	K	27.8	Very low	31	Very low	180 Å²	180	132.5 Å²	132.5	78%	0.783	77%	0.765	S	S	*	*			trans	32.9	148.4	148	-68.6	-173.9	-170.4	178.6	0	122.8
564	K	25.6	Very low	31.5	Very low	162 Å²	162	133.5 Å²	133.5	70%	0.704	77%	0.766	S	S	*	*			cis	-169.5	125.3	-5.9	171	-178	-175.9	-157.8	0	112.8
565	E	26.8	Very low	31.9	Very low	144 Å²	144	135 Å²	135	67%	0.673	77%	0.771	S	S	*	*			trans	65.9	151.5	139.4	-149.5	155.9	-103.6	0	0	124
566	D	28.8	Very low	32.1	Very low	148 Å²	148	131.8 Å²	131.8	79%	0.791	77%	0.772	S	S	*	*			trans	54.7	93.3	166.8	-68.6	-15.9	0	0	0	123
567	S	28.2	Very low	32.5	Very low	117 Å²	117	131 Å²	131	82%	0.818	77%	0.773	S	S	*	*				-172.8	178.7	122.7	-166.1	0	0	0	0	111.4
568	L	35.8	Very low	32.7	Very low	129 Å²	129	133.4 Å²	133.4	68%	0.675	78%	0.776	S	S	*	*			trans	72.7	40.7	166.3	-53.9	-179.4	0	0	0	119.4	A570	L568-A570 PolarHBondContact O-N 3.5Å
569	Q	35.3	Very low	32	Very low	211 Å²	211	135.3 Å²	135.3	99%	0.986	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	56.9	155.6	-163.8	162.5	10.6	0	0	111.4
570	A	33.8	Very low	31.1	Very low	72 Å²	72	138 Å²	138	60%	0.595	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.5	6.9	-169.5	0	0	0	0	0	115.1	L568	L568-A570 PolarHBondContact O-N 3.5Å
571	T	36.9	Very low	31.2	Very low	125 Å²	125	137.4 Å²	137.4	77%	0.767	78%	0.783	S	S	*	*	S	Bend	trans	-124.3	30.5	-169.9	41.1	0	0	0	0	113.9
572	A	36.8	Very low	31.1	Very low	108 Å²	108	135.7 Å²	135.7	89%	0.893	78%	0.784	S	S	*	*	S	Bend	trans	-130.3	13.5	179.9	0	0	0	0	0	114.7
573	A	31.5	Very low	31.3	Very low	94 Å²	94	138.9 Å²	138.9	78%	0.777	79%	0.791	S	S	*	*	S	Bend	trans	-122.8	-1.2	-172.9	0	0	0	0	0	115.2
574	T	34.9	Very low	31.4	Very low	136 Å²	136	140 Å²	140	83%	0.834	79%	0.792	S	S	*	*	S	Bend	trans	-124	51.5	-166.1	-37.9	0	0	0	0	112.4
575	A	33.8	Very low	31.7	Very low	105 Å²	105	143.2 Å²	143.2	87%	0.868	80%	0.799	S	S	*	*	S	Bend	trans	-142.1	25.6	-178.8	0	0	0	0	0	113.7
576	A	32.9	Very low	31.7	Very low	93 Å²	93	142.4 Å²	142.4	77%	0.769	79%	0.794	S	S	*	*	S	Bend	trans	-148.3	50.4	-173.1	0	0	0	0	0	114.1
577	I	33.3	Very low	31.4	Very low	162 Å²	162	140.5 Å²	140.5	83%	0.831	79%	0.792	S	S	*	*			trans	-158.5	151.7	164.1	-103.5	147.6	0	0	0	108
578	L	33.3	Very low	31.3	Very low	153 Å²	153	142.6 Å²	142.6	80%	0.801	79%	0.791	S	S	*	*			trans	69.7	89.6	-173.1	-51.5	-175.2	0	0	0	116.8
579	N	30.1	Very low	31.2	Very low	160 Å²	160	143.2 Å²	143.2	86%	0.856	79%	0.79	S	S	*	*				-166.9	118.5	107.4	-108.2	-74.2	0	0	0	111.8
580	L	27.1	Very low	30.8	Very low	171 Å²	171	138.2 Å²	138.2	90%	0.895	77%	0.774	S	S	*	*			trans	-152.2	144.3	164.9	-110.5	166.8	0	0	0	107.5
581	S	27.2	Very low	30.4	Very low	98 Å²	98	142.2 Å²	142.2	69%	0.685	78%	0.784	S	S	*	*	S	Bend	trans	72.4	122.4	-172.8	82.2	0	0	0	0	118.9
582	T	27.3	Very low	29.9	Very low	125 Å²	125	142 Å²	142	77%	0.767	79%	0.788	S	S	*	*			trans	47.2	103.6	142.3	55.5	0	0	0	0	119.9
583	R	30.2	Very low	29.4	Very low	224 Å²	224	140.1 Å²	140.1	85%	0.845	78%	0.778	S	S	*	*				-147.7	114.8	126.5	-139.1	169.8	-65.2	-117.4	1.8	113.1
584	Y	30	Very low	29	Very low	204 Å²	204	145 Å²	145	80%	0.8	79%	0.785	S	S	*	*			trans	-64.5	127.2	163.4	176.1	-97.4	0	0	0	109
585	R	32.5	Very low	28.5	Very low	228 Å²	228	142.6 Å²	142.6	86%	0.86	78%	0.779	S	S	*	*			trans	-143.1	123.3	160.8	-81.4	-152.4	-167	-97.2	12	110.6
586	K	26.7	Very low	28.2	Very low	127 Å²	127	146.1 Å²	146.1	55%	0.552	78%	0.782	S	S	*	*			trans	-90.4	130.4	166.2	168.5	-175.3	174.3	-178.4	0	107	D1016	K586-D1016 IonicContact NZ-OD1 2.73Å; K586-D1016 PolarHBondContact NZ-OD1 3.49Å; K586-D1016 IonicContact NZ-OD2 2.74Å
587	S	22.4	Very low	27.8	Very low	109 Å²	109	145.5 Å²	145.5	76%	0.762	78%	0.778	S	S	*	*			trans	-164.1	135.4	160	-158.9	0	0	0	0	110.8
588	M	25	Very low	27.5	Very low	161 Å²	161	144.5 Å²	144.5	79%	0.793	78%	0.779	S	S	*	*			trans	-84.7	-176.8	155.5	-71.8	167	46.5	0	0	107.4
589	E	33.4	Very low	27.2	Very low	142 Å²	142	142.2 Å²	142.2	66%	0.664	78%	0.776	S	S	*	*			cis	-141.4	-178.1	19.9	-49.3	-178.2	116.8	0	0	109.4
590	T	27.5	Very low	26.9	Very low	106 Å²	106	140.7 Å²	140.7	65%	0.65	77%	0.772	S	S	*	*			cis	-154.9	158	25.8	5.2	0	0	0	0	113.2
591	I	26.3	Very low	27	Very low	156 Å²	156	141 Å²	141	80%	0.8	77%	0.767	S	S	*	*			trans	63	102.7	150.7	-59.9	158.4	0	0	0	118.9
592	S	25.3	Very low	27.2	Very low	121 Å²	121	144 Å²	144	85%	0.846	78%	0.775	S	S	*	*				164.1	144.1	107.2	-169.1	0	0	0	0	112.8
593	G	25.8	Very low	27.3	Very low	67 Å²	67	146.6 Å²	146.6	69%	0.691	78%	0.78	S	S	*	*			trans	103.4	45.9	148.6	0	0	0	0	0	121.5
594	Q	23.7	Very low	27.4	Very low	197 Å²	197	142.8 Å²	142.8	92%	0.921	78%	0.776	S	S	*	*			trans	46.2	132.8	133.2	-175.2	167.1	4.8	0	0	123.1
595	A	24.6	Very low	27.9	Very low	85 Å²	85	139 Å²	139	70%	0.702	77%	0.769	S	S	*	*			trans	86.7	98.8	150.5	0	0	0	0	0	122.2
596	L	26.9	Very low	28.3	Very low	179 Å²	179	136 Å²	136	94%	0.937	76%	0.764	S	S	*	*				68.9	130.5	120.8	-137.3	75.1	0	0	0	120.9
597	A	26.2	Very low	29.2	Very low	81 Å²	81	134.2 Å²	134.2	67%	0.669	76%	0.764	S	S	*	*			trans	-107.2	162	169.6	0	0	0	0	0	111.4
598	T	25.4	Very low	30.8	Very low	140 Å²	140	133.1 Å²	133.1	86%	0.859	75%	0.749	S	S	*	*				-177.6	142.2	120.4	23.1	0	0	0	0	114.4
599	S	28.1	Very low	32.1	Very low	105 Å²	105	135.1 Å²	135.1	73%	0.734	76%	0.757	S	S	*	*			trans	21.4	124.7	146.5	-163.9	0	0	0	0	121.9
600	T	24	Very low	32.9	Very low	128 Å²	128	135.1 Å²	135.1	79%	0.785	76%	0.761	S	S	*	*				-165	122.5	123.9	13.4	0	0	0	0	107
601	K	29.3	Very low	34.2	Very low	178 Å²	178	132.8 Å²	132.8	77%	0.774	76%	0.759	S	S	*	*				97	141.5	69.9	-169.8	177.1	-174.2	-179.2	0	110.5	M603	K601-M603 PolarHBondContact O-N 3.05Å
602	D	31.5	Very low	35.3	Very low	161 Å²	161	129.9 Å²	129.9	86%	0.861	75%	0.748	S	S	*	*			trans	-53.4	132.8	-167.2	-57.4	-85.9	0	0	0	114.3
603	M	28.1	Very low	36.2	Very low	179 Å²	179	129 Å²	129	88%	0.882	73%	0.734	S	S	*	*			trans	-95.4	109.9	161.8	-69.5	-150.9	73.5	0	0	109.2	K601 I605	K601-M603 PolarHBondContact O-N 3.05Å; M603-I605 PolarHBondContact O-N 3.35Å
604	L	32.4	Very low	36.7	Very low	145 Å²	145	132.1 Å²	132.1	76%	0.759	73%	0.734	S	S	*	*			trans	-62.1	130.4	171.4	-175.8	67.1	0	0	0	109.4	E606	L604-E606 HydrophobicContact CD2-CG 4.39Å; L604-E606 PolarHBondContact O-N 2.87Å
605	I	41.1	Very low	37.3	Very low	125 Å²	125	130 Å²	130	64%	0.641	73%	0.728	S	S	*	*			trans	-84.7	103.9	168.6	-59.5	175.6	0	0	0	106.9	M603 L613	M603-I605 PolarHBondContact O-N 3.35Å; I605-L613 HydrophobicContact CG2-CD1 4.15Å; I605-L613 HydrophobicContact CG2-CD2 3.71Å
606	E	40.4	Very low	37.8	Very low	165 Å²	165	130.3 Å²	130.3	77%	0.771	73%	0.725	S	S	*	*			trans	-72.2	142.2	168.3	-66.8	-175.3	158.2	0	0	109.8	L604 L613	L604-E606 HydrophobicContact CD2-CG 4.39Å; L604-E606 PolarHBondContact O-N 2.87Å; E606-L613 WeakPolarHBondContact O-CD2 3.26Å
607	V	45.3	Very low	38.2	Very low	88 Å²	88	130.6 Å²	130.6	53%	0.533	72%	0.724	S	S	.	*			trans	-125.3	137.6	179.1	-171	0	0	0	0	106.7	L613	V607-L613 HydrophobicContact CG2-CD2 4.27Å
608	D	55.9	Low	38.4	Very low	87 Å²	87	136.4 Å²	136.4	47%	0.465	73%	0.734	S	S	.	*			trans	-70.4	164.5	176.7	71.8	-6.1	0	0	0	112.3	N610 G611 T612	D608-N610 PolarHBondContact O-N 3.47Å; D608-N610 PolarHBondContact OD1-N 2.89Å; D608-G611 PolarHBondContact O-N 3.17Å; D608-G611 PolarHBondContact OD1-N 3.05Å; D608-T612 PolarHBondContact OD1-N 2.79Å
609	E	54.1	Low	38.6	Very low	202 Å²	202	139 Å²	139	94%	0.944	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-5.1	-177.2	-60.5	179.2	-126.3	0	0	113.3
610	N	49.5	Very low	38.4	Very low	142 Å²	142	139.7 Å²	139.7	76%	0.759	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	0.1	177.9	-67.9	100.5	0	0	0	113.9	D608	D608-N610 PolarHBondContact O-N 3.47Å; D608-N610 PolarHBondContact OD1-N 2.89Å
611	G	53.9	Low	38.4	Very low	58 Å²	58	142 Å²	142	60%	0.598	74%	0.736	S	S	*	*			trans	77.7	30	169	0	0	0	0	0	115.7	D608	D608-G611 PolarHBondContact O-N 3.17Å; D608-G611 PolarHBondContact OD1-N 3.05Å
612	T	49.3	Very low	38.1	Very low	94 Å²	94	139.5 Å²	139.5	58%	0.577	73%	0.728	S	S	*	*			trans	-120.1	126.8	-178.6	-59.4	0	0	0	0	112.4	D608	D608-T612 PolarHBondContact OD1-N 2.79Å
613	L	44.5	Very low	37.7	Very low	104 Å²	104	138.7 Å²	138.7	55%	0.545	72%	0.723	S	S	.	*			trans	-95.6	105.4	172	-69.5	172	0	0	0	110.2	I605 E606 V607	I605-L613 HydrophobicContact CG2-CD1 4.15Å; I605-L613 HydrophobicContact CG2-CD2 3.71Å; E606-L613 WeakPolarHBondContact O-CD2 3.26Å; V607-L613 HydrophobicContact CG2-CD2 4.27Å
614	D	35.8	Very low	37.5	Very low	131 Å²	131	133.7 Å²	133.7	70%	0.701	72%	0.718	S	S	*	*			trans	-77.9	134.9	170.4	-174.4	17.3	0	0	0	111.2	S616	D614-S616 WeakPolarHBondContact OD1-CB 3.11Å; D614-S616 PolarHBondContact OD1-N 2.89Å
615	L	37	Very low	37.2	Very low	153 Å²	153	137 Å²	137	80%	0.801	73%	0.726	S	S	*	*			trans	-132	43.4	176.5	-69	176.8	0	0	0	111.1	M617	L615-M617 PolarHBondContact O-N 3.5Å
616	S	36.3	Very low	36.3	Very low	91 Å²	91	135.6 Å²	135.6	64%	0.636	73%	0.733	S	S	*	*			trans	-63.8	86.3	175.6	-167.3	0	0	0	0	112.9	D614 K618	D614-S616 WeakPolarHBondContact OD1-CB 3.11Å; D614-S616 PolarHBondContact OD1-N 2.89Å; S616-K618 VanDerWaalsContact C-N 3.32Å; S616-K618 PolarHBondContact O-N 3.39Å
617	M	33.9	Very low	35.5	Very low	185 Å²	185	139.4 Å²	139.4	91%	0.911	74%	0.74	S	S	*	*			trans	-66.4	76.5	179.9	-78.5	-70.5	-70.9	0	0	113.4	L615	L615-M617 PolarHBondContact O-N 3.5Å
618	K	30.2	Very low	34.4	Very low	203 Å²	203	138.7 Å²	138.7	88%	0.883	74%	0.743	S	S	*	*			trans	-91.3	109.7	178.6	-160.8	169.6	-176.1	176.9	0	112.3	S616	S616-K618 VanDerWaalsContact C-N 3.32Å; S616-K618 PolarHBondContact O-N 3.39Å
619	K	29.7	Very low	33	Very low	194 Å²	194	144 Å²	144	84%	0.843	76%	0.763	S	S	*	*			trans	-85.7	129.2	-175.1	174.1	-173.2	-178.2	-179.2	0	112.8
620	C	24.1	Very low	31.5	Very low	121 Å²	121	140.6 Å²	140.6	82%	0.818	76%	0.756	S	S	*	*			trans	-176.2	116.4	136.6	-106.2	0	0	0	0	116.6
621	K	23.9	Very low	30.7	Very low	175 Å²	175	139 Å²	139	76%	0.761	75%	0.753	S	S	*	*				30.8	132.9	126.5	-138.5	-165.4	-178.2	-149.5	0	122.8
622	E	22.8	Very low	29.2	Very low	126 Å²	126	140.8 Å²	140.8	59%	0.589	76%	0.757	S	S	*	*			trans	87.9	128.4	139.8	-106.1	-176.5	111.1	0	0	124.2
623	N	22.9	Very low	28	Very low	144 Å²	144	142.6 Å²	142.6	77%	0.77	76%	0.763	S	S	*	*			trans	66.2	139.5	150.1	-57.4	-32.4	0	0	0	121.5
624	G	25.1	Very low	26.9	Very low	75 Å²	75	145.1 Å²	145.1	77%	0.773	77%	0.771	S	S	*	*			trans	-163.9	-52.5	177.3	0	0	0	0	0	122.4
625	K	24.7	Very low	26.4	Very low	215 Å²	215	145.7 Å²	145.7	94%	0.935	77%	0.77	S	S	*	*			trans	67.1	159.2	-177.5	-65.1	178.4	173.1	174.8	0	119.4
626	A	23.1	Very low	25.7	Very low	94 Å²	94	145.1 Å²	145.1	78%	0.777	77%	0.767	S	S	*	*			trans	76.9	120.2	162.2	0	0	0	0	0	118.1
627	R	23.7	Very low	25.9	Very low	245 Å²	245	146.4 Å²	146.4	93%	0.925	77%	0.773	S	S	*	*				76.1	132.8	76.5	-125.7	-161.9	173.4	176.5	-2.1	111.2
628	A	23	Very low	26.5	Very low	73 Å²	73	142.8 Å²	142.8	60%	0.603	76%	0.763	S	S	*	*			cis	-163.7	175.3	18	0	0	0	0	0	114
629	K	25.3	Very low	26.9	Very low	199 Å²	199	138.1 Å²	138.1	87%	0.865	75%	0.754	S	S	*	*			trans	76.5	101.6	150	-70.7	177.3	178	-174	0	121.1
630	T	22.6	Very low	26.7	Very low	131 Å²	131	137 Å²	137	80%	0.804	75%	0.752	S	S	*	*				-56.9	173.6	128.6	41.4	0	0	0	0	111.7
631	P	32.3	Very low	26.8	Very low	109 Å²	109	136.4 Å²	136.4	71%	0.708	75%	0.749	S	S	*	*			cis	-150.8	-167	32.8	44.6	-22.4	0	0	0	118.8
632	S	23.1	Very low	27	Very low	95 Å²	95	132.4 Å²	132.4	66%	0.664	75%	0.748	S	S	*	*			trans	79	144.5	150.2	-65.7	0	0	0	0	119.5
633	D	23.4	Very low	27.3	Very low	132 Å²	132	134.7 Å²	134.7	71%	0.706	76%	0.764	S	S	*	*			cis	-162.5	168.9	-14.5	-108.7	-39.8	0	0	0	111.6
634	E	22.4	Very low	27.7	Very low	156 Å²	156	131.4 Å²	131.4	73%	0.729	76%	0.757	S	S	*	*			trans	41.5	147.6	148.1	-71.6	-155.7	-101.7	0	0	122.6
635	Q	23.8	Very low	27.8	Very low	143 Å²	143	138.1 Å²	138.1	67%	0.668	76%	0.764	S	S	*	*			cis	-157.8	-178.8	3.9	-156.8	26.6	-83.2	0	0	111.6
636	L	23.8	Very low	27.8	Very low	142 Å²	142	131.8 Å²	131.8	74%	0.743	76%	0.761	S	S	*	*			trans	-124.5	-170	168	-65.8	171.4	0	0	0	110
637	P	39.2	Very low	28	Very low	117 Å²	117	131.2 Å²	131.2	76%	0.76	76%	0.763	S	S	*	*			cis	-115.7	-95	-36.5	16.3	5.2	0	0	0	118.3
638	P	48	Very low	28.1	Very low	109 Å²	109	124.4 Å²	124.4	71%	0.708	75%	0.753	S	S	*	*			trans	-120.6	-156.8	-132.5	43.8	-25	0	0	0	113.8
639	P	38.8	Very low	28.3	Very low	106 Å²	106	128.3 Å²	128.3	69%	0.688	76%	0.763	S	S	*	*			cis	-145.3	-177.6	3.1	45	-23.8	0	0	0	119.8
640	E	24.8	Very low	28.5	Very low	171 Å²	171	125.8 Å²	125.8	80%	0.799	76%	0.759	S	S	*	*			trans	60.4	113.2	138.9	-79.5	171.6	173.3	0	0	127.1
641	S	26.2	Very low	28.7	Very low	108 Å²	108	127.6 Å²	127.6	76%	0.755	76%	0.761	S	S	*	*				90	123.8	116.5	81.3	0	0	0	0	125.7
642	A	28	Very low	28.4	Very low	90 Å²	90	125.3 Å²	125.3	74%	0.744	76%	0.758	S	S	*	*				85.2	131.8	124.7	0	0	0	0	0	126.5
643	L	28.4	Very low	29.6	Very low	175 Å²	175	126.7 Å²	126.7	92%	0.916	77%	0.765	S	S	*	*			trans	72	153.3	148.3	-107.2	66.6	0	0	0	120.1
644	A	31	Very low	29.9	Very low	75 Å²	75	124.3 Å²	124.3	62%	0.62	76%	0.763	S	S	*	*			cis	-157.3	175.5	5	0	0	0	0	0	114.4
645	K	27.6	Very low	30	Very low	215 Å²	215	126.5 Å²	126.5	94%	0.935	77%	0.771	S	S	*	*			trans	84.7	137	167.6	-53.6	176.4	-177.7	177.2	0	117.4
646	G	25.9	Very low	30.1	Very low	83 Å²	83	130.5 Å²	130.5	86%	0.856	78%	0.781	S	S	*	*			cis	156.4	130.4	-14.1	0	0	0	0	0	115.2
647	G	26.4	Very low	30.8	Very low	81 Å²	81	132.1 Å²	132.1	84%	0.835	79%	0.785	S	S	*	*			trans	124.8	142	168.9	0	0	0	0	0	115.7
648	S	26	Very low	30.9	Very low	102 Å²	102	131.7 Å²	131.7	71%	0.713	78%	0.783	S	S	*	*				172	105.6	-59.8	171.4	0	0	0	0	111.3
649	L	26.4	Very low	29.9	Very low	156 Å²	156	134.6 Å²	134.6	82%	0.817	79%	0.791	S	S	*	*			trans	-174.4	114.5	150.9	-121.9	68.6	0	0	0	104.8
650	L	29.5	Very low	29.4	Very low	146 Å²	146	134.3 Å²	134.3	76%	0.764	79%	0.791	S	S	*	*				56.7	125.5	72.8	-53.8	176.2	0	0	0	110.9
651	I	27	Very low	29.4	Very low	168 Å²	168	133.8 Å²	133.8	86%	0.862	79%	0.793	S	S	*	*			cis	-145.4	160.9	27.3	-64.8	172.9	0	0	0	111.1
652	G	25.7	Very low	29.5	Very low	62 Å²	62	139.4 Å²	139.4	64%	0.639	80%	0.798	S	S	*	*			trans	-142.9	-162.7	157.1	0	0	0	0	0	109.7
653	P	50.2	Low	29.5	Very low	123 Å²	123	144.5 Å²	144.5	80%	0.799	81%	0.806	S	S	*	*			cis	-134.5	-169.4	-9.9	43.2	-26.4	0	0	0	113.6
654	A	28.1	Very low	29.4	Very low	82 Å²	82	141.2 Å²	141.2	68%	0.678	79%	0.794	S	S	*	*			trans	66.1	143.9	157.4	0	0	0	0	0	120.8
655	F	25.8	Very low	29.4	Very low	203 Å²	203	149 Å²	149	89%	0.89	81%	0.807	S	S	*	*				-171.8	-177.9	112.9	-100.8	-66.8	0	0	0	111.4
656	Y	26.4	Very low	29.3	Very low	227 Å²	227	147.6 Å²	147.6	89%	0.89	80%	0.804	S	S	*	*			trans	-87.1	157.1	-155.2	-112.2	-114.1	0	0	0	117.1
657	Q	36.4	Very low	29.2	Very low	175 Å²	175	151.1 Å²	151.1	82%	0.818	80%	0.803	S	S	*	*			trans	-69.1	161.6	158.5	-146.9	149.9	-24.1	0	0	109
658	P	42.6	Very low	29.1	Very low	109 Å²	109	152.7 Å²	152.7	71%	0.708	80%	0.802	S	S	*	*			cis	-149.4	-176	33.8	45.1	-24.7	0	0	0	118.1
659	L	26.9	Very low	29.2	Very low	169 Å²	169	155.2 Å²	155.2	89%	0.885	81%	0.805	S	S	*	*				-167	165.9	125.7	-103.8	169.9	0	0	0	110.8
660	C	27.4	Very low	29.5	Very low	101 Å²	101	153.8 Å²	153.8	68%	0.682	81%	0.805	S	S	*	*			trans	-88.5	179.8	177.2	-66.2	0	0	0	0	112.4
661	D	24.7	Very low	29.4	Very low	159 Å²	159	152 Å²	152	85%	0.85	80%	0.8	S	S	*	*			trans	69.7	114.4	158.6	-48	-35.8	0	0	0	118.5
662	R	28.1	Very low	29.4	Very low	226 Å²	226	150.4 Å²	150.4	85%	0.853	79%	0.793	S	S	*	*				-166	94.9	108.2	-172.1	158.3	66.1	-154.3	3.5	112.2	T664	R662-T664 WeakPolarHBondContact CG-OG1 3.38Å
663	E	29.5	Very low	29.3	Very low	197 Å²	197	156.2 Å²	156.2	92%	0.921	80%	0.801	S	S	*	*			trans	-82.4	107.2	157.7	-72.5	-178.4	175.5	0	0	108.8
664	T	25.2	Very low	28.2	Very low	107 Å²	107	155 Å²	155	66%	0.656	80%	0.796	S	S	*	*			trans	-161	144.7	164.8	-23.2	0	0	0	0	110.5	R662	R662-T664 WeakPolarHBondContact CG-OG1 3.38Å
665	W	31	Very low	28	Very low	239 Å²	239	160.5 Å²	160.5	91%	0.905	81%	0.805	S	S	*	*			trans	111.2	63.8	171.8	-64	15.8	0	0	0	116.5
666	E	25.4	Very low	28	Very low	184 Å²	184	154.7 Å²	154.7	86%	0.86	79%	0.794	S	S	*	*	S	Bend		-104.2	163.5	126.1	-77.3	-163.7	133.1	0	0	108.9
667	N	24.5	Very low	28.1	Very low	158 Å²	158	152.8 Å²	152.8	85%	0.845	79%	0.793	S	S	*	*			trans	64.8	86.2	177.5	-61	-19.7	0	0	0	117.8
668	S	25.1	Very low	27.4	Very low	114 Å²	114	150.1 Å²	150.1	80%	0.797	79%	0.789	S	S	*	*			trans	-157	129	132.6	-9.9	0	0	0	0	111.6
669	I	27.8	Very low	26.7	Very low	155 Å²	155	152 Å²	152	80%	0.795	79%	0.792	S	S	*	*			trans	-93.8	128.1	165.9	-59	170.8	0	0	0	107.4	V671	I669-V671 HydrophobicContact CG2-CG2 4Å
670	P	31.7	Very low	26.5	Very low	125 Å²	125	151.4 Å²	151.4	81%	0.812	79%	0.785	S	S	*	*			trans	-86.4	130.9	169.7	32.7	-30.7	0	0	0	111
671	V	27.1	Very low	26.2	Very low	109 Å²	109	152 Å²	152	66%	0.661	78%	0.781	S	S	*	*			trans	-127.1	129.7	-179.9	177.2	0	0	0	0	110.9	I669	I669-V671 HydrophobicContact CG2-CG2 4Å
672	N	27.8	Very low	26.2	Very low	134 Å²	134	151.7 Å²	151.7	72%	0.717	77%	0.772	S	S	*	*			trans	64.6	157.4	170.4	-77.9	-40.4	0	0	0	117.3
673	F	23.5	Very low	26	Very low	184 Å²	184	147.4 Å²	147.4	81%	0.807	76%	0.762	S	S	*	*			cis	-128	-164.1	13.9	-58.5	-99.6	0	0	0	110.3
674	S	28	Very low	25.8	Very low	99 Å²	99	146.7 Å²	146.7	69%	0.692	76%	0.758	S	S	*	*			cis	-164.5	151.8	8.5	-149.2	0	0	0	0	115.4
675	K	24	Very low	25.8	Very low	196 Å²	196	148.3 Å²	148.3	85%	0.852	76%	0.763	S	S	*	*			trans	78.1	131.8	137.1	-114	178.4	179.9	174.5	0	125.2
676	A	24.5	Very low	25.6	Very low	82 Å²	82	145.8 Å²	145.8	68%	0.678	76%	0.755	S	S	*	*			trans	75.5	140.4	144.9	0	0	0	0	0	118.2
677	H	28.2	Very low	25.6	Very low	186 Å²	186	143.7 Å²	143.7	86%	0.861	75%	0.749	S	S	*	*			cis	-134.8	-171	28.5	-119	-91.8	0	0	0	114.8
678	V	22.8	Very low	25.7	Very low	120 Å²	120	144.9 Å²	144.9	73%	0.727	75%	0.75	S	S	*	*			trans	-134.4	140.6	-170.6	-169.9	0	0	0	0	111.1
679	L	26.9	Very low	25.7	Very low	148 Å²	148	146.1 Å²	146.1	78%	0.775	75%	0.752	S	S	*	*			trans	152.1	142	131.5	-81.4	173	0	0	0	116.6
680	Q	23.4	Very low	25.5	Very low	156 Å²	156	143.9 Å²	143.9	73%	0.729	75%	0.75	S	S	*	*			trans	74.9	124.3	145.5	-78.6	-166.8	-87.1	0	0	126
681	D	21.5	Very low	25.3	Very low	113 Å²	113	144.2 Å²	144.2	60%	0.604	75%	0.745	S	S	*	*				59.2	114.1	128.1	-74.9	-51.7	0	0	0	124.7
682	K	24.3	Very low	25.3	Very low	153 Å²	153	146.6 Å²	146.6	67%	0.665	75%	0.749	S	S	*	*				69.5	148.2	118	-78.5	178.3	154.4	-131.7	0	125
683	E	23.2	Very low	25.2	Very low	136 Å²	136	147 Å²	147	64%	0.636	75%	0.751	S	S	*	*			trans	73.6	106.8	143.7	-76.5	156.8	-179.5	0	0	121
684	E	25.4	Very low	25.3	Very low	182 Å²	182	145 Å²	145	85%	0.85	74%	0.744	S	S	*	*				77.7	155.8	127.9	-63.3	-171.1	159.2	0	0	124
685	D	25.4	Very low	25.1	Very low	141 Å²	141	147.6 Å²	147.6	75%	0.754	75%	0.745	S	S	*	*			trans	98.3	166.2	156.9	-129.9	72.9	0	0	0	121.6
686	Y	27.4	Very low	25.5	Very low	187 Å²	187	149 Å²	149	73%	0.733	75%	0.746	S	S	*	*			trans	-100.9	164.9	-140.1	-75.4	-90.4	0	0	0	117.7
687	D	25.3	Very low	25.7	Very low	140 Å²	140	150.8 Å²	150.8	75%	0.749	75%	0.751	S	S	*	*			trans	47.2	135.9	148.3	-67	-14.3	0	0	0	119.7
688	Q	26.8	Very low	25.7	Very low	182 Å²	182	145.8 Å²	145.8	85%	0.85	75%	0.749	S	S	*	*				-173.1	168.9	66.9	-167.5	149.7	94.9	0	0	112.1
689	V	24.6	Very low	25.9	Very low	141 Å²	141	147.5 Å²	147.5	86%	0.855	76%	0.755	S	S	*	*			trans	-112.5	131.3	-173.5	-72.4	0	0	0	0	114.7
690	S	23.6	Very low	25.9	Very low	107 Å²	107	143.8 Å²	143.8	75%	0.748	75%	0.752	S	S	*	*			trans	-167.9	142	158	-158.2	0	0	0	0	107.4
691	L	28.6	Very low	25.9	Very low	133 Å²	133	140.5 Å²	140.5	70%	0.696	75%	0.746	S	S	*	*				55.2	124	56.6	-95.4	63.1	0	0	0	111.9
692	E	25.4	Very low	26.2	Very low	159 Å²	159	143 Å²	143	74%	0.743	76%	0.757	S	S	*	*			cis	-146.7	167.4	20.7	-141.7	93.2	-151.8	0	0	112.6
693	D	26.4	Very low	26.2	Very low	142 Å²	142	143.9 Å²	143.9	76%	0.759	77%	0.768	S	S	*	*			trans	19.7	169.5	145.7	-152.6	17.1	0	0	0	124.7
694	Q	25.9	Very low	26.5	Very low	142 Å²	142	142.1 Å²	142.1	66%	0.664	77%	0.77	S	S	*	*			trans	98.9	137.7	148.2	-104.8	174.6	36	0	0	123.2
695	H	24.4	Very low	26.9	Very low	153 Å²	153	139.3 Å²	139.3	71%	0.708	77%	0.767	S	S	*	*			trans	73.3	113.4	156.3	-64.9	119.4	0	0	0	122.6
696	Y	32.1	Very low	27	Very low	225 Å²	225	142.1 Å²	142.1	88%	0.882	77%	0.773	S	S	*	*			trans	-69.7	148.9	140.9	-106.1	-86.4	0	0	0	110.6
697	P	28.6	Very low	27.2	Very low	121 Å²	121	138.2 Å²	138.2	79%	0.786	78%	0.779	S	S	*	*			trans	-120.7	160.1	142.6	36.8	-29.4	0	0	0	111.9
698	G	28.7	Very low	27.4	Very low	80 Å²	80	141 Å²	141	83%	0.825	79%	0.785	S	S	*	*			trans	-165.5	125.2	170.5	0	0	0	0	0	112.7
699	D	26.4	Very low	27.6	Very low	157 Å²	157	138.9 Å²	138.9	84%	0.84	78%	0.778	S	S	*	*			trans	-168.8	152.7	164.2	-148.7	-3	0	0	0	104.8
700	G	26.1	Very low	27.8	Very low	69 Å²	69	139.4 Å²	139.4	71%	0.711	78%	0.776	S	S	*	*			cis	-178.7	-165.7	1	0	0	0	0	0	107.1
701	S	24.1	Very low	28.1	Very low	88 Å²	88	141.7 Å²	141.7	62%	0.615	78%	0.779	S	S	*	*			cis	-168.5	138	-17.3	-143.5	0	0	0	0	108.5
702	M	27.1	Very low	28.7	Very low	166 Å²	166	145.9 Å²	145.9	82%	0.818	79%	0.785	S	S	*	*			trans	65.1	166	169.6	-43.3	-60	167.3	0	0	116.1
703	L	25.6	Very low	28.7	Very low	171 Å²	171	145.5 Å²	145.5	90%	0.895	79%	0.788	S	S	*	*			cis	-132.8	166.5	6	-82.6	169.3	0	0	0	111.9
704	S	29.4	Very low	29.5	Very low	99 Å²	99	143 Å²	143	69%	0.692	78%	0.782	S	S	*	*			trans	-98	158	169.3	-171.1	0	0	0	0	111.2
705	P	32.4	Very low	30.3	Very low	122 Å²	122	146.1 Å²	146.1	79%	0.792	79%	0.793	S	S	*	*				-148.6	132	103	35.6	-18	0	0	0	117.5
706	K	27.3	Very low	31.1	Very low	201 Å²	201	148.1 Å²	148.1	87%	0.874	80%	0.8	S	S	*	*			trans	11.6	126.3	143.4	-60.9	167.9	-178.3	167.9	0	120.1
707	A	31.7	Very low	31.5	Very low	104 Å²	104	146.8 Å²	146.8	86%	0.86	80%	0.802	S	S	*	*			trans	-138.9	156.2	138.4	0	0	0	0	0	111.1
708	K	29.7	Very low	32.3	Very low	198 Å²	198	147.8 Å²	147.8	86%	0.861	80%	0.8	S	S	*	*			trans	-126.4	156.2	175.7	-75.1	-177.1	178.5	-176.5	0	106.5
709	L	32.5	Very low	33.8	Very low	138 Å²	138	149.9 Å²	149.9	72%	0.723	79%	0.791	S	S	*	*			cis	-162.6	-179.3	4.7	-124.2	170.1	0	0	0	108.2
710	L	27.7	Very low	35.7	Very low	153 Å²	153	146.6 Å²	146.6	80%	0.801	78%	0.781	S	S	*	*			trans	72.7	149.2	175	-40.6	-179.8	0	0	0	114.1
711	L	29.4	Very low	38	Very low	155 Å²	155	143.6 Å²	143.6	81%	0.812	75%	0.749	S	S	*	*			cis	-139.8	169.7	-0.6	-171.9	53.6	0	0	0	110.7
712	R	41	Very low	40.4	Very low	221 Å²	221	143.9 Å²	143.9	83%	0.834	75%	0.748	S	S	*	*			trans	-27.7	146.2	173.6	-82.3	-90.4	-176.4	139.5	-1.2	117.6
713	D	26.6	Very low	42.5	Very low	150 Å²	150	136.8 Å²	136.8	80%	0.802	72%	0.715	S	S	*	*			trans	-151.8	-174.6	130.4	-143.2	-18.7	0	0	0	114.6
714	S	43.4	Very low	44.8	Very low	89 Å²	89	134.9 Å²	134.9	62%	0.622	71%	0.713	S	S	*	*			trans	-126	139.2	-143.2	-47.3	0	0	0	0	113.3
715	K	42.7	Very low	46.6	Very low	208 Å²	208	134.1 Å²	134.1	90%	0.904	72%	0.72	S	S	*	*			trans	171.1	78.3	150.8	-101	167.8	-179.6	174.6	0	112.5
716	K	40.1	Very low	48.9	Very low	195 Å²	195	129.2 Å²	129.2	85%	0.848	69%	0.688	S	S	*	*			trans	-149.6	53.1	166	-68.5	-164.9	-178.4	177.3	0	112.9	L718	K716-L718 PolarHBondContact O-N 3.36Å
717	E	41.3	Very low	51.3	Low	198 Å²	198	125.5 Å²	125.5	93%	0.925	68%	0.678	S	S	*	*			trans	-68.1	110.9	164	-74.1	-159.4	120.4	0	0	109.7
718	L	46.3	Very low	53.4	Low	141 Å²	141	120.9 Å²	120.9	74%	0.738	64%	0.64	S	S	*	*			trans	-134.8	73.6	-179.9	-75.2	177.5	0	0	0	111.9	K716 S720	K716-L718 PolarHBondContact O-N 3.36Å; L718-S720 PolarHBondContact O-N 3Å
719	L	59.5	Low	55.4	Low	124 Å²	124	114.3 Å²	114.3	65%	0.649	62%	0.62	S	S	*	*			trans	56.6	45.7	145.6	-59.4	162.8	0	0	0	115.7
720	S	66.8	Low	57.2	Low	88 Å²	88	108.9 Å²	108.9	62%	0.615	60%	0.597	S	S	*	*			trans	-69.9	165.7	166.7	49.1	0	0	0	0	112	L718	L718-S720 PolarHBondContact O-N 3Å
721	C	72.6	Confident	59.6	Low	6 Å²	6	103.9 Å²	103.9	4%	0.041	57%	0.569	C	S	.	*			trans	-62.3	130.9	167.8	43.7	0	0	0	0	110.4	T723 C726 G728 H739	C721-T723 PolarHBondContact O-N 3.32Å; C721-C726 HydrophobicContact CB-CB 4.17Å; C721-C726 WeakPolarHBondContact CB-SG 3.3Å; C721-C726 WeakPolarHBondContact SG-CB 3.46Å; C721-C726 PolarHBondContact SG-O 3.32Å; C721-C726 VanDerWaalsContact SG-O 3.32Å; C721-C726 CovalentContact SG-SG 2.04Å; C721-C726 PolarHBondContact SG-SG 2.06Å; C721-G728 WeakPolarHBondContact SG-CA 3.41Å; C721-G728 PolarHBondContact SG-N 3.16Å; C721-H739 WeakPolarHBondContact CB-NE2 3.22Å
722	P	76.4	Confident	61.9	Low	94 Å²	94	99.6 Å²	99.6	61%	0.61	55%	0.55	S	S	*	.	S	Bend	trans	-79.8	46.6	176.1	34.4	-36.6	0	0	0	111.3	V742	P722-V742 HydrophobicContact CG-CG2 3.86Å
723	T	69.8	Low	63.3	Low	18 Å²	18	92.9 Å²	92.9	11%	0.11	53%	0.533	C	S	.	.	S	Bend	trans	-121.2	118.5	178.2	-60.7	0	0	0	0	106.9	C721 G725 C726 A748	C721-T723 PolarHBondContact O-N 3.32Å; T723-G725 PolarHBondContact O-N 3.4Å; T723-C726 HydrophobicContact CG2-CB 4.14Å; T723-C726 VanDerWaalsContact O-CB 3.23Å; T723-C726 WeakPolarHBondContact O-CB 3.22Å; T723-C726 PolarHBondContact O-N 3.23Å; T723-C726 VanDerWaalsContact O-N 3.09Å; T723-A748 HydrophobicContact CG2-CB 4.3Å
724	P	74	Confident	65.3	Low	131 Å²	131	89 Å²	89	85%	0.851	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	136	-179	-27	35.7	0	0	0	111.8	C726	P724-C726 PolarHBondContact O-N 3.42Å
725	G	66.6	Low	66.4	Low	82 Å²	82	90.3 Å²	90.3	85%	0.845	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	4.4	-177.6	0	0	0	0	0	115.7	T723	T723-G725 PolarHBondContact O-N 3.4Å
726	C	80.8	Confident	67.8	Low	19 Å²	19	87.2 Å²	87.2	13%	0.128	51%	0.512	C	S	.	.			trans	-90.5	133.6	173.5	166.2	0	0	0	0	111.5	C721 T723 P724 G728 H739 C745 L747	C721-C726 HydrophobicContact CB-CB 4.17Å; C721-C726 WeakPolarHBondContact CB-SG 3.3Å; C721-C726 WeakPolarHBondContact SG-CB 3.46Å; C721-C726 PolarHBondContact SG-O 3.32Å; C721-C726 VanDerWaalsContact SG-O 3.32Å; C721-C726 CovalentContact SG-SG 2.04Å; C721-C726 PolarHBondContact SG-SG 2.06Å; T723-C726 HydrophobicContact CG2-CB 4.14Å; T723-C726 VanDerWaalsContact O-CB 3.23Å; T723-C726 WeakPolarHBondContact O-CB 3.22Å; T723-C726 PolarHBondContact O-N 3.23Å; T723-C726 VanDerWaalsContact O-N 3.09Å; P724-C726 PolarHBondContact O-N 3.42Å; C726-G728 PolarHBondContact SG-N 3.22Å; C726-G728 VanDerWaalsContact SG-N 3.37Å; C726-H739 PolarHBondContact SG-CE1 2.87Å; C726-H739 PolarHBondContact SG-NE2 2.94Å; C726-C745 VanDerWaalsContact SG-SG 3.63Å; C726-L747 HydrophobicContact CB-CD1 4.13Å
727	D	77.9	Confident	69.4	Low	124 Å²	124	82 Å²	82	66%	0.663	51%	0.505	S	S	*	.			trans	-89	-4.7	179.3	67.7	-19.2	0	0	0	113.8	S729	D727-S729 VanDerWaalsContact C-N 3.3Å; D727-S729 WeakPolarHBondContact OD1-CB 3.21Å; D727-S729 PolarHBondContact OD1-N 3.31Å; D727-S729 WeakPolarHBondContact OD2-CB 2.97Å
728	G	75.6	Confident	71.3	Confident	6 Å²	6	75.7 Å²	75.7	6%	0.062	48%	0.483	C	S	.	.	S	Bend	trans	80.2	7.5	-174	0	0	0	0	0	113.9	C721 C726 S738 H739	C721-G728 WeakPolarHBondContact SG-CA 3.41Å; C721-G728 PolarHBondContact SG-N 3.16Å; C726-G728 PolarHBondContact SG-N 3.22Å; C726-G728 VanDerWaalsContact SG-N 3.37Å; G728-S738 CarbonylContact O-C 3.53Å; G728-S738 WeakPolarHBondContact O-CA 3.13Å; G728-S738 VanDerWaalsContact O-CB 3.24Å; G728-S738 WeakPolarHBondContact O-CB 3.22Å; G728-S738 PolarHBondContact O-OG 2.93Å; G728-H739 PolarHBondContact O-N 3.11Å
729	S	72.4	Confident	73	Confident	61 Å²	61	69.4 Å²	69.4	43%	0.427	45%	0.45	S	S	.	.	B	Isolated β-bridge	trans	-86.5	157.5	-178.8	-167.4	0	0	0	0	112.7	D727 H739	D727-S729 VanDerWaalsContact C-N 3.3Å; D727-S729 WeakPolarHBondContact OD1-CB 3.21Å; D727-S729 PolarHBondContact OD1-N 3.31Å; D727-S729 WeakPolarHBondContact OD2-CB 2.97Å; S729-H739 PolarHBondContact O-CE1 3.02Å; S729-H739 PolarHBondContact O-ND1 3.46Å
730	G	69.7	Low	74	Confident	24 Å²	24	71.9 Å²	71.9	25%	0.247	45%	0.451	C	S	.	.	S	Bend	trans	57.9	-169.2	-175.6	0	0	0	0	0	114	Y736 A737 S738 H739	G730-Y736 CarbonylContact C-O 3.52Å; G730-Y736 WeakPolarHBondContact CA-O 3.46Å; G730-A737 PolarHBondContact N-O 2.9Å; G730-S738 CarbonylContact O-C 3.58Å; G730-S738 VanDerWaalsContact O-CA 3.31Å; G730-S738 WeakPolarHBondContact O-CA 3.5Å; G730-H739 PolarHBondContact O-N 2.82Å; G730-H739 PolarHBondContact O-ND1 3.42Å
731	H	79.5	Confident	74.3	Confident	47 Å²	47	70.1 Å²	70.1	22%	0.218	44%	0.438	C	S	.	.			trans	-156.7	148.4	172.8	-171.7	-85.4	0	0	0	108.4	T733 G734 Y736 H739 G744	H731-T733 PolarHBondContact CE1-OG1 3.45Å; H731-T733 VanDerWaalsContact CE1-OG1 3.23Å; H731-T733 PolarHBondContact ND1-N 2.93Å; H731-T733 PolarHBondContact ND1-OG1 2.94Å; H731-T733 PolarHBondContact O-N 3.38Å; H731-G734 PolarHBondContact O-N 3.14Å; H731-Y736 HydrophobicContact CB-CD2 4.15Å; H731-Y736 AromaticContact CD2-CD2 3.98Å; H731-Y736 AromaticContact CG-CD2 3.79Å; H731-Y736 PolarHBondContact N-O 3.17Å; H731-Y736 AromaticContact ND1-CD2 3.88Å; H731-H739 HydrophobicContact CB-CB 4.47Å; H731-G744 CarbonylContact C-O 3.5Å; H731-G744 WeakPolarHBondContact CA-O 3.34Å; H731-G744 WeakPolarHBondContact NE2-CA 3.38Å
732	V	76.9	Confident	74.4	Confident	66 Å²	66	70.9 Å²	70.9	40%	0.4	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	7.3	179.1	73.1	0	0	0	0	115.5	G744 K753	V732-G744 WeakPolarHBondContact CB-O 3.49Å; V732-G744 WeakPolarHBondContact CG1-O 3.39Å; V732-G744 PolarHBondContact N-O 2.84Å; V732-K753 VanDerWaalsContact CG1-NZ 3.27Å
733	T	69.6	Low	74.1	Confident	80 Å²	80	70.2 Å²	70.2	49%	0.491	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	2	177.8	-36.2	0	0	0	0	111.6	H731 N735	H731-T733 PolarHBondContact CE1-OG1 3.45Å; H731-T733 VanDerWaalsContact CE1-OG1 3.23Å; H731-T733 PolarHBondContact ND1-N 2.93Å; H731-T733 PolarHBondContact ND1-OG1 2.94Å; H731-T733 PolarHBondContact O-N 3.38Å; T733-N735 PolarHBondContact O-N 2.92Å
734	G	70.3	Confident	74.2	Confident	67 Å²	67	69.4 Å²	69.4	69%	0.691	44%	0.436	S	S	*	.	S	Bend	trans	68.2	-24.5	-175.3	0	0	0	0	0	115.9	H731 Y736	H731-G734 PolarHBondContact O-N 3.14Å; G734-Y736 VanDerWaalsContact C-N 3.32Å; G734-Y736 PolarHBondContact O-N 2.93Å
735	N	66.1	Low	74.6	Confident	118 Å²	118	63.2 Å²	63.2	63%	0.631	40%	0.396	S	S	*	.	S	Bend	trans	-78.3	-3.6	-168.5	-67.5	-28.7	0	0	0	116.2	T733	T733-N735 PolarHBondContact O-N 2.92Å
736	Y	71.4	Confident	74.8	Confident	142 Å²	142	62.7 Å²	62.7	56%	0.557	38%	0.377	S	S	*	.			trans	-135.4	137.8	-179.6	-50.3	-84.1	0	0	0	110.1	G730 H731 G734 S738	G730-Y736 CarbonylContact C-O 3.52Å; G730-Y736 WeakPolarHBondContact CA-O 3.46Å; H731-Y736 HydrophobicContact CB-CD2 4.15Å; H731-Y736 AromaticContact CD2-CD2 3.98Å; H731-Y736 AromaticContact CG-CD2 3.79Å; H731-Y736 PolarHBondContact N-O 3.17Å; H731-Y736 AromaticContact ND1-CD2 3.88Å; G734-Y736 VanDerWaalsContact C-N 3.32Å; G734-Y736 PolarHBondContact O-N 2.93Å; Y736-S738 VanDerWaalsContact C-N 3.27Å; Y736-S738 PolarHBondContact O-N 2.88Å
737	A	74.8	Confident	74.2	Confident	86 Å²	86	67 Å²	67	71%	0.711	40%	0.398	S	S	*	.	S	Bend	trans	-79.9	-5	-178	0	0	0	0	0	114	G730	G730-A737 PolarHBondContact N-O 2.9Å
738	S	79.8	Confident	74.1	Confident	66 Å²	66	61.7 Å²	61.7	46%	0.462	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-156.5	154.6	178	172.1	0	0	0	0	110.5	G728 G730 Y736	G728-S738 CarbonylContact O-C 3.53Å; G728-S738 WeakPolarHBondContact O-CA 3.13Å; G728-S738 VanDerWaalsContact O-CB 3.24Å; G728-S738 WeakPolarHBondContact O-CB 3.22Å; G728-S738 PolarHBondContact O-OG 2.93Å; G730-S738 CarbonylContact O-C 3.58Å; G730-S738 VanDerWaalsContact O-CA 3.31Å; G730-S738 WeakPolarHBondContact O-CA 3.5Å; Y736-S738 VanDerWaalsContact C-N 3.27Å; Y736-S738 PolarHBondContact O-N 2.88Å
739	H	81.9	Confident	73.4	Confident	8 Å²	8	66.4 Å²	66.4	4%	0.037	40%	0.395	C	S	.	.			trans	-139.5	156.3	176.4	69	-79.6	0	0	0	110.1	C721 C726 G728 S729 G730 H731 C745 P746	C721-H739 WeakPolarHBondContact CB-NE2 3.22Å; C726-H739 PolarHBondContact SG-CE1 2.87Å; C726-H739 PolarHBondContact SG-NE2 2.94Å; G728-H739 PolarHBondContact O-N 3.11Å; S729-H739 PolarHBondContact O-CE1 3.02Å; S729-H739 PolarHBondContact O-ND1 3.46Å; G730-H739 PolarHBondContact O-N 2.82Å; G730-H739 PolarHBondContact O-ND1 3.42Å; H731-H739 HydrophobicContact CB-CB 4.47Å; H739-C745 WeakPolarHBondContact CD2-CA 3.33Å; H739-C745 VanDerWaalsContact NE2-CA 3.34Å; H739-C745 WeakPolarHBondContact NE2-CA 3.27Å; H739-C745 VanDerWaalsContact NE2-CB 3.28Å; H739-C745 WeakPolarHBondContact NE2-CB 3.44Å; H739-C745 PolarHBondContact NE2-SG 2.84Å; H739-P746 VanDerWaalsContact CE1-CD 3.41Å; H739-P746 WeakPolarHBondContact CE1-CD 3.46Å
740	R	82.1	Confident	72.8	Confident	177 Å²	177	72.2 Å²	72.2	67%	0.668	41%	0.413	S	S	*	.			trans	-128.9	11.2	-176.7	-59.1	-175.9	-177.8	172.3	-2.6	113.9
741	S	72.6	Confident	72.1	Confident	50 Å²	50	75.2 Å²	75.2	35%	0.35	43%	0.426	S	S	.	.	S	Bend	trans	-142	149.5	-177.8	65.9	0	0	0	0	111.2	S743 G744 C745	S741-S743 PolarHBondContact O-N 3.41Å; S741-S743 PolarHBondContact OG-OG 3.48Å; S741-G744 PolarHBondContact O-N 2.82Å; S741-C745 PolarHBondContact O-N 3.34Å; S741-C745 VanDerWaalsContact O-N 3.12Å
742	V	73.4	Confident	71	Confident	23 Å²	23	76.7 Å²	76.7	14%	0.139	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-51.2	-39.4	174.6	-172	0	0	0	0	111.3	P722 G744 C745 A748 L752	P722-V742 HydrophobicContact CG-CG2 3.86Å; V742-G744 VanDerWaalsContact C-N 3.3Å; V742-G744 PolarHBondContact O-N 2.67Å; V742-C745 WeakPolarHBondContact O-CB 3.32Å; V742-C745 PolarHBondContact O-N 3.12Å; V742-A748 HydrophobicContact CG1-CB 3.58Å; V742-A748 WeakPolarHBondContact O-CB 3.46Å; V742-L752 HydrophobicContact CG1-CD2 3.66Å; V742-L752 HydrophobicContact CG1-CG 4.13Å
743	S	71.7	Confident	70.1	Confident	79 Å²	79	77.5 Å²	77.5	55%	0.552	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-61.3	-32.7	179.3	49.2	0	0	0	0	114.2	S741 K753	S741-S743 PolarHBondContact O-N 3.41Å; S741-S743 PolarHBondContact OG-OG 3.48Å; S743-K753 PolarHBondContact O-NZ 2.78Å
744	G	71.7	Confident	69.3	Low	2 Å²	2	77.3 Å²	77.3	2%	0.021	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-93.8	-11	177	0	0	0	0	0	114.8	H731 V732 S741 V742	H731-G744 CarbonylContact C-O 3.5Å; H731-G744 WeakPolarHBondContact CA-O 3.34Å; H731-G744 WeakPolarHBondContact NE2-CA 3.38Å; V732-G744 WeakPolarHBondContact CB-O 3.49Å; V732-G744 WeakPolarHBondContact CG1-O 3.39Å; V732-G744 PolarHBondContact N-O 2.84Å; S741-G744 PolarHBondContact O-N 2.82Å; V742-G744 VanDerWaalsContact C-N 3.3Å; V742-G744 PolarHBondContact O-N 2.67Å
745	C	81.9	Confident	68.6	Low	1 Å²	1	79.9 Å²	79.9	1%	0.007	43%	0.433	C	S	.	.			trans	-71.2	135.2	-173.4	-173.3	0	0	0	0	112.8	C726 H739 S741 V742 L747 A748	C726-C745 VanDerWaalsContact SG-SG 3.63Å; H739-C745 WeakPolarHBondContact CD2-CA 3.33Å; H739-C745 VanDerWaalsContact NE2-CA 3.34Å; H739-C745 WeakPolarHBondContact NE2-CA 3.27Å; H739-C745 VanDerWaalsContact NE2-CB 3.28Å; H739-C745 WeakPolarHBondContact NE2-CB 3.44Å; H739-C745 PolarHBondContact NE2-SG 2.84Å; S741-C745 PolarHBondContact O-N 3.34Å; S741-C745 VanDerWaalsContact O-N 3.12Å; V742-C745 WeakPolarHBondContact O-CB 3.32Å; V742-C745 PolarHBondContact O-N 3.12Å; C745-L747 PolarHBondContact SG-N 3.21Å; C745-L747 VanDerWaalsContact SG-N 3.37Å; C745-A748 HydrophobicContact CB-CB 3.62Å; C745-A748 PolarHBondContact SG-N 2.92Å; C745-A748 VanDerWaalsContact SG-N 3.36Å
746	P	71.4	Confident	67.9	Low	71 Å²	71	81.1 Å²	81.1	46%	0.461	44%	0.437	S	S	.	.	S	Bend	trans	-78.6	-21.1	173	32.4	-33.7	0	0	0	113.1	H739	H739-P746 VanDerWaalsContact CE1-CD 3.41Å; H739-P746 WeakPolarHBondContact CE1-CD 3.46Å
747	L	67.6	Low	67	Low	109 Å²	109	76.9 Å²	76.9	57%	0.571	43%	0.431	S	S	*	.	S	Bend	trans	-95.7	-12.1	179.9	-65	169.7	0	0	0	113.4	C726 C745 D749	C726-L747 HydrophobicContact CB-CD1 4.13Å; C745-L747 PolarHBondContact SG-N 3.21Å; C745-L747 VanDerWaalsContact SG-N 3.37Å; L747-D749 PolarHBondContact O-N 3.46Å
748	A	75.3	Confident	65.3	Low	12 Å²	12	76.3 Å²	76.3	10%	0.099	43%	0.426	C	S	.	.	S	Bend	trans	-68.5	129	178.8	0	0	0	0	0	111.2	T723 V742 C745	T723-A748 HydrophobicContact CG2-CB 4.3Å; V742-A748 HydrophobicContact CG1-CB 3.58Å; V742-A748 WeakPolarHBondContact O-CB 3.46Å; C745-A748 HydrophobicContact CB-CB 3.62Å; C745-A748 PolarHBondContact SG-N 2.92Å; C745-A748 VanDerWaalsContact SG-N 3.36Å
749	D	61.4	Low	63.3	Low	105 Å²	105	80.4 Å²	80.4	56%	0.561	44%	0.443	S	S	*	.			trans	-63.5	145.3	-167.4	-152.6	-12	0	0	0	113	L747 T751 L752 K753	L747-D749 PolarHBondContact O-N 3.46Å; D749-T751 PolarHBondContact O-N 2.86Å; D749-L752 PolarHBondContact O-N 3.1Å; D749-K753 PolarHBondContact O-N 3.39Å
750	K	59.4	Low	61.6	Low	184 Å²	184	82.6 Å²	82.6	80%	0.8	46%	0.459	S	S	*	.	H	α-helix	trans	-60.8	-35.7	-173.6	-66.4	171.7	-174.9	166.3	0	111.1	S754	K750-S754 VanDerWaalsContact O-CB 3.27Å; K750-S754 WeakPolarHBondContact O-CB 3.35Å; K750-S754 PolarHBondContact O-N 2.86Å
751	T	55	Low	59.7	Low	86 Å²	86	82.9 Å²	82.9	53%	0.528	47%	0.468	S	S	.	.	H	α-helix	trans	-62.4	-47.5	172.6	35.5	0	0	0	0	112.6	D749 K753 S754 L755	D749-T751 PolarHBondContact O-N 2.86Å; T751-K753 PolarHBondContact O-N 3.48Å; T751-S754 CarbonylContact O-C 3.55Å; T751-S754 WeakPolarHBondContact O-CB 3.48Å; T751-S754 PolarHBondContact O-N 3.4Å; T751-S754 VanDerWaalsContact O-N 3.15Å; T751-L755 WeakPolarHBondContact O-CB 3.22Å; T751-L755 WeakPolarHBondContact O-CG 3.25Å; T751-L755 PolarHBondContact O-N 2.75Å
752	L	57.4	Low	58.5	Low	78 Å²	78	87.2 Å²	87.2	41%	0.408	48%	0.483	S	S	.	.	H	α-helix	trans	-65.7	-40.3	179.8	-173.9	61.4	0	0	0	111.6	V742 D749 S754 L755 M756	V742-L752 HydrophobicContact CG1-CD2 3.66Å; V742-L752 HydrophobicContact CG1-CG 4.13Å; D749-L752 PolarHBondContact O-N 3.1Å; L752-S754 VanDerWaalsContact C-N 3.32Å; L752-S754 PolarHBondContact O-N 3.28Å; L752-L755 PolarHBondContact O-N 2.78Å; L752-M756 PolarHBondContact O-N 2.81Å; L752-M756 VanDerWaalsContact O-N 3.09Å
753	K	57.8	Low	57.6	Low	83 Å²	83	90.3 Å²	90.3	36%	0.361	50%	0.498	S	S	.	.	H	α-helix	trans	-65.8	-34.4	172.8	-170	159.3	-178.3	155.4	0	112.5	V732 S743 D749 T751 A757	V732-K753 VanDerWaalsContact CG1-NZ 3.27Å; S743-K753 PolarHBondContact O-NZ 2.78Å; D749-K753 PolarHBondContact O-N 3.39Å; T751-K753 PolarHBondContact O-N 3.48Å; K753-A757 WeakPolarHBondContact O-CB 3.3Å; K753-A757 PolarHBondContact O-N 2.67Å
754	S	53.1	Low	57.3	Low	77 Å²	77	92 Å²	92	54%	0.538	50%	0.495	S	S	.	.	H	α-helix	trans	-72.1	-34.9	173.3	-164.8	0	0	0	0	112.6	K750 T751 L752 A757 A758	K750-S754 VanDerWaalsContact O-CB 3.27Å; K750-S754 WeakPolarHBondContact O-CB 3.35Å; K750-S754 PolarHBondContact O-N 2.86Å; T751-S754 CarbonylContact O-C 3.55Å; T751-S754 WeakPolarHBondContact O-CB 3.48Å; T751-S754 PolarHBondContact O-N 3.4Å; T751-S754 VanDerWaalsContact O-N 3.15Å; L752-S754 VanDerWaalsContact C-N 3.32Å; L752-S754 PolarHBondContact O-N 3.28Å; S754-A757 CarbonylContact O-C 3.49Å; S754-A757 PolarHBondContact O-N 3.09Å; S754-A758 WeakPolarHBondContact O-CB 3.37Å; S754-A758 PolarHBondContact O-N 3.42Å
755	L	54.3	Low	57.1	Low	121 Å²	121	92.1 Å²	92.1	63%	0.634	50%	0.496	S	S	*	.	H	α-helix	trans	-66.8	-45.1	176.7	-81.2	160.4	0	0	0	111.6	T751 L752 A757 A758	T751-L755 WeakPolarHBondContact O-CB 3.22Å; T751-L755 WeakPolarHBondContact O-CG 3.25Å; T751-L755 PolarHBondContact O-N 2.75Å; L752-L755 PolarHBondContact O-N 2.78Å; L755-A757 PolarHBondContact O-N 3.5Å; L755-A758 WeakPolarHBondContact O-CB 3.49Å; L755-A758 PolarHBondContact O-N 3.24Å; L755-A758 VanDerWaalsContact O-N 3.15Å
756	M	52.1	Low	56.6	Low	144 Å²	144	96.4 Å²	96.4	71%	0.709	52%	0.524	S	S	*	.	H	α-helix	trans	-68.4	-22.5	172.9	-74.2	-167.7	163.2	0	0	113.3	L752	L752-M756 PolarHBondContact O-N 2.81Å; L752-M756 VanDerWaalsContact O-N 3.09Å
757	A	52.5	Low	56.5	Low	52 Å²	52	94 Å²	94	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-82	-24.5	170.1	0	0	0	0	0	113.5	K753 S754 L755 N759 S760	K753-A757 WeakPolarHBondContact O-CB 3.3Å; K753-A757 PolarHBondContact O-N 2.67Å; S754-A757 CarbonylContact O-C 3.49Å; S754-A757 PolarHBondContact O-N 3.09Å; L755-A757 PolarHBondContact O-N 3.5Å; A757-N759 PolarHBondContact O-N 3.18Å; A757-S760 WeakPolarHBondContact O-CB 3.46Å; A757-S760 PolarHBondContact O-N 3.28Å; A757-S760 PolarHBondContact O-OG 3.43Å
758	A	39.7	Very low	56.6	Low	75 Å²	75	94.8 Å²	94.8	62%	0.62	52%	0.52	S	S	*	.	H	α-helix	trans	-70	-18.5	-177.3	0	0	0	0	0	113.5	S754 L755 S760	S754-A758 WeakPolarHBondContact O-CB 3.37Å; S754-A758 PolarHBondContact O-N 3.42Å; L755-A758 WeakPolarHBondContact O-CB 3.49Å; L755-A758 PolarHBondContact O-N 3.24Å; L755-A758 VanDerWaalsContact O-N 3.15Å; A758-S760 PolarHBondContact O-N 3.36Å
759	N	37.4	Very low	56.3	Low	152 Å²	152	97.4 Å²	97.4	81%	0.813	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	13.9	167.7	-154.2	7.7	0	0	0	113.1	A757	A757-N759 PolarHBondContact O-N 3.18Å
760	S	46	Very low	57.2	Low	53 Å²	53	93 Å²	93	37%	0.371	53%	0.525	S	S	.	.	S	Bend	trans	-94.9	105.7	156.5	66.3	0	0	0	0	109	A757 A758	A757-S760 WeakPolarHBondContact O-CB 3.46Å; A757-S760 PolarHBondContact O-N 3.28Å; A757-S760 PolarHBondContact O-OG 3.43Å; A758-S760 PolarHBondContact O-N 3.36Å
761	Q	41.7	Very low	58.1	Low	183 Å²	183	89 Å²	89	86%	0.855	51%	0.512	S	S	*	.			trans	-55	143.5	168.5	-70.1	-179.6	-10.8	0	0	109.5	L763	Q761-L763 PolarHBondContact O-N 3.17Å; Q761-L763 VanDerWaalsContact O-N 3.14Å
762	E	47.4	Very low	59	Low	141 Å²	141	85.4 Å²	85.4	66%	0.659	49%	0.492	S	S	*	.			trans	-44.1	111	-152	-54.8	-164.7	127.7	0	0	115.4	K764	E762-K764 HydrophobicContact CB-CD 4.18Å; E762-K764 HydrophobicContact CB-CG 4.14Å; E762-K764 VanDerWaalsContact CD-CE 3.42Å; E762-K764 PolarHBondContact O-N 3.36Å; E762-K764 VanDerWaalsContact OE1-CE 3.27Å; E762-K764 WeakPolarHBondContact OE1-CE 3.3Å; E762-K764 IonicContact OE1-NZ 2.7Å; E762-K764 PolarHBondContact OE1-NZ 3.05Å; E762-K764 WeakPolarHBondContact OE2-CD 3.34Å; E762-K764 VanDerWaalsContact OE2-CE 3.25Å; E762-K764 WeakPolarHBondContact OE2-CE 3.38Å; E762-K764 IonicContact OE2-NZ 3.26Å; E762-K764 PolarHBondContact OE2-NZ 3.08Å
763	L	54	Low	59.8	Low	89 Å²	89	84.8 Å²	84.8	47%	0.466	50%	0.495	S	S	.	.			trans	-74.1	39.1	174.4	-66.8	170.3	0	0	0	112.9	Q761	Q761-L763 PolarHBondContact O-N 3.17Å; Q761-L763 VanDerWaalsContact O-N 3.14Å
764	K	65.3	Low	60.5	Low	113 Å²	113	82.2 Å²	82.2	49%	0.491	49%	0.491	S	S	.	.			trans	-80.6	147.4	177.3	-70.6	176.2	-171.6	163.8	0	110.7	E762 P766	E762-K764 HydrophobicContact CB-CD 4.18Å; E762-K764 HydrophobicContact CB-CG 4.14Å; E762-K764 VanDerWaalsContact CD-CE 3.42Å; E762-K764 PolarHBondContact O-N 3.36Å; E762-K764 VanDerWaalsContact OE1-CE 3.27Å; E762-K764 WeakPolarHBondContact OE1-CE 3.3Å; E762-K764 IonicContact OE1-NZ 2.7Å; E762-K764 PolarHBondContact OE1-NZ 3.05Å; E762-K764 WeakPolarHBondContact OE2-CD 3.34Å; E762-K764 VanDerWaalsContact OE2-CE 3.25Å; E762-K764 WeakPolarHBondContact OE2-CE 3.38Å; E762-K764 IonicContact OE2-NZ 3.26Å; E762-K764 PolarHBondContact OE2-NZ 3.08Å; K764-P766 WeakPolarHBondContact O-CD 3.4Å
765	C	69.3	Low	61.8	Low	6 Å²	6	80.6 Å²	80.6	4%	0.041	48%	0.475	C	S	.	.			trans	-57.1	126	162.7	35.1	0	0	0	0	110.4	T767 C770 G772 H783 C789	C765-T767 PolarHBondContact O-N 3.5Å; C765-C770 HydrophobicContact CB-CB 4Å; C765-C770 WeakPolarHBondContact CB-SG 3.24Å; C765-C770 WeakPolarHBondContact SG-CB 3.37Å; C765-C770 CovalentContact SG-SG 2.04Å; C765-C770 PolarHBondContact SG-SG 3.13Å; C765-G772 VanDerWaalsContact SG-CA 3.51Å; C765-G772 PolarHBondContact SG-N 3.27Å; C765-H783 WeakPolarHBondContact CB-NE2 3.21Å; C765-C789 WeakPolarHBondContact CB-SG 3.21Å
766	P	70.2	Confident	62.9	Low	91 Å²	91	77.9 Å²	77.9	59%	0.591	46%	0.464	S	S	*	.	S	Bend	trans	-76.4	32.1	177.9	30.8	-34.1	0	0	0	113.1	K764 L786	K764-P766 WeakPolarHBondContact O-CD 3.4Å; P766-L786 HydrophobicContact CG-CD2 3.84Å; P766-L786 HydrophobicContact CG-CG 3.97Å
767	T	69.7	Low	63.8	Low	21 Å²	21	74.8 Å²	74.8	13%	0.129	45%	0.453	C	S	.	.	S	Bend	trans	-96.1	122.2	168.4	-66.4	0	0	0	0	107.9	C765 G769 C770 L786 C789 R791	C765-T767 PolarHBondContact O-N 3.5Å; T767-G769 PolarHBondContact O-N 3.35Å; T767-C770 HydrophobicContact CG2-CB 4.04Å; T767-C770 WeakPolarHBondContact O-CB 3.44Å; T767-C770 PolarHBondContact O-N 3.44Å; T767-L786 VanDerWaalsContact OG1-CD2 3.22Å; T767-L786 WeakPolarHBondContact OG1-CD2 3.35Å; T767-C789 PolarHBondContact OG1-SG 2.92Å; T767-C789 VanDerWaalsContact OG1-SG 3.35Å; T767-R791 HydrophobicContact CG2-CB 4.35Å
768	P	70.3	Confident	64.8	Low	125 Å²	125	75.2 Å²	75.2	81%	0.812	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	131.8	-178.8	-30.3	36.9	0	0	0	113.5	C770	P768-C770 PolarHBondContact O-N 2.86Å
769	G	68.1	Low	66.1	Low	66 Å²	66	78.2 Å²	78.2	68%	0.68	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	3.7	-177.9	0	0	0	0	0	115.8	T767 R791	T767-G769 PolarHBondContact O-N 3.35Å; G769-R791 PolarHBondContact O-NH1 3.25Å; G769-R791 PolarHBondContact O-NH2 3.49Å
770	C	80.7	Confident	67.6	Low	12 Å²	12	77.8 Å²	77.8	8%	0.081	46%	0.456	C	S	.	.			trans	-75.3	135.8	173.6	175.4	0	0	0	0	111.4	C765 T767 P768 H783	C765-C770 HydrophobicContact CB-CB 4Å; C765-C770 WeakPolarHBondContact CB-SG 3.24Å; C765-C770 WeakPolarHBondContact SG-CB 3.37Å; C765-C770 CovalentContact SG-SG 2.04Å; C765-C770 PolarHBondContact SG-SG 3.13Å; T767-C770 HydrophobicContact CG2-CB 4.04Å; T767-C770 WeakPolarHBondContact O-CB 3.44Å; T767-C770 PolarHBondContact O-N 3.44Å; P768-C770 PolarHBondContact O-N 2.86Å; C770-H783 VanDerWaalsContact SG-CE1 3.58Å; C770-H783 PolarHBondContact SG-NE2 3.31Å
771	D	77.4	Confident	69	Low	100 Å²	100	79.7 Å²	79.7	54%	0.535	48%	0.475	S	S	.	.			trans	-98.4	-5.7	-174.4	59.1	-63.9	0	0	0	113.6	S773 R791	D771-S773 VanDerWaalsContact C-N 3.35Å; D771-S773 WeakPolarHBondContact OD2-CB 3.46Å; D771-S773 PolarHBondContact OD2-N 2.92Å; D771-S773 PolarHBondContact OD2-OG 2.97Å; D771-R791 IonicContact OD1-NH1 3.84Å; D771-R791 PolarHBondContact OD1-NH1 2.98Å
772	G	74.5	Confident	70.8	Confident	11 Å²	11	74.3 Å²	74.3	11%	0.113	46%	0.458	C	S	.	.	S	Bend	trans	86.9	-5.4	-179.5	0	0	0	0	0	114.7	C765 S782 H783	C765-G772 VanDerWaalsContact SG-CA 3.51Å; C765-G772 PolarHBondContact SG-N 3.27Å; G772-S782 CarbonylContact O-C 3.6Å; G772-S782 WeakPolarHBondContact O-CA 3.22Å; G772-S782 VanDerWaalsContact O-CB 3.24Å; G772-S782 WeakPolarHBondContact O-CB 3.32Å; G772-H783 PolarHBondContact O-N 3.39Å; G772-H783 PolarHBondContact O-ND1 2.83Å
773	S	73.6	Confident	72.4	Confident	66 Å²	66	68 Å²	68	46%	0.462	43%	0.428	S	S	.	.	B	Isolated β-bridge	trans	-76.8	152.9	-179.2	-51.5	0	0	0	0	113.7	D771 H783	D771-S773 VanDerWaalsContact C-N 3.35Å; D771-S773 WeakPolarHBondContact OD2-CB 3.46Å; D771-S773 PolarHBondContact OD2-N 2.92Å; D771-S773 PolarHBondContact OD2-OG 2.97Å; S773-H783 PolarHBondContact O-CE1 3.05Å; S773-H783 PolarHBondContact O-ND1 3.38Å; S773-H783 VanDerWaalsContact O-ND1 3.16Å
774	G	72.6	Confident	73.8	Confident	28 Å²	28	71.4 Å²	71.4	29%	0.289	44%	0.435	S	S	.	.	S	Bend	trans	64.4	-170.7	-176.9	0	0	0	0	0	113.4	Y780 A781 S782 H783	G774-Y780 CarbonylContact C-O 3.47Å; G774-Y780 WeakPolarHBondContact CA-O 3.39Å; G774-A781 PolarHBondContact N-O 3.22Å; G774-S782 CarbonylContact O-C 3.6Å; G774-S782 VanDerWaalsContact O-CA 3.32Å; G774-S782 WeakPolarHBondContact O-CA 3.12Å; G774-H783 WeakPolarHBondContact O-CB 3.24Å; G774-H783 PolarHBondContact O-N 2.89Å; G774-H783 PolarHBondContact O-ND1 3.37Å
775	H	81.4	Confident	74	Confident	44 Å²	44	68.4 Å²	68.4	20%	0.204	43%	0.428	C	S	.	.			trans	-153.3	153.7	172.3	-172.5	-91.8	0	0	0	108.9	T777 G778 Y780 H783 G788	H775-T777 PolarHBondContact ND1-N 3.41Å; H775-T777 PolarHBondContact ND1-OG1 3.37Å; H775-T777 PolarHBondContact O-N 3.4Å; H775-G778 PolarHBondContact O-N 3.42Å; H775-Y780 HydrophobicContact CB-CD2 4.1Å; H775-Y780 HydrophobicContact CB-CG 4.5Å; H775-Y780 AromaticContact CG-CD2 3.75Å; H775-Y780 PolarHBondContact N-O 2.83Å; H775-Y780 AromaticContact ND1-CD2 3.75Å; H775-H783 HydrophobicContact CB-CB 4.38Å; H775-G788 CarbonylContact C-O 3.52Å; H775-G788 WeakPolarHBondContact CA-O 3.29Å; H775-G788 VanDerWaalsContact NE2-CA 3.27Å; H775-G788 WeakPolarHBondContact NE2-CA 3.31Å
776	V	78	Confident	74	Confident	64 Å²	64	72.9 Å²	72.9	39%	0.388	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-16.7	-177.1	73.7	0	0	0	0	114.3	S787 G788	V776-S787 WeakPolarHBondContact CG1-O 3.38Å; V776-G788 PolarHBondContact N-O 3.46Å
777	T	70.8	Confident	74.1	Confident	78 Å²	78	73.4 Å²	73.4	48%	0.479	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	2.2	175.3	58.6	0	0	0	0	114	H775 N779	H775-T777 PolarHBondContact ND1-N 3.41Å; H775-T777 PolarHBondContact ND1-OG1 3.37Å; H775-T777 PolarHBondContact O-N 3.4Å; T777-N779 PolarHBondContact O-N 2.82Å; T777-N779 PolarHBondContact O-OD1 3.24Å
778	G	72.2	Confident	74.1	Confident	62 Å²	62	72.4 Å²	72.4	64%	0.639	45%	0.451	S	S	*	.	S	Bend	trans	71.9	-27.8	-176.8	0	0	0	0	0	115.9	H775 Y780	H775-G778 PolarHBondContact O-N 3.42Å; G778-Y780 VanDerWaalsContact C-N 3.29Å; G778-Y780 PolarHBondContact O-N 3.31Å
779	N	67.2	Low	74.6	Confident	137 Å²	137	66.5 Å²	66.5	73%	0.733	41%	0.412	S	S	*	.	S	Bend	trans	-77.4	0.5	-168.3	-64.4	-12.1	0	0	0	116.2	T777	T777-N779 PolarHBondContact O-N 2.82Å; T777-N779 PolarHBondContact O-OD1 3.24Å
780	Y	69.8	Low	74.7	Confident	144 Å²	144	66 Å²	66	57%	0.565	40%	0.397	S	S	*	.			trans	-132.9	136.9	179.3	-51.9	-73.4	0	0	0	110.5	G774 H775 G778 S782	G774-Y780 CarbonylContact C-O 3.47Å; G774-Y780 WeakPolarHBondContact CA-O 3.39Å; H775-Y780 HydrophobicContact CB-CD2 4.1Å; H775-Y780 HydrophobicContact CB-CG 4.5Å; H775-Y780 AromaticContact CG-CD2 3.75Å; H775-Y780 PolarHBondContact N-O 2.83Å; H775-Y780 AromaticContact ND1-CD2 3.75Å; G778-Y780 VanDerWaalsContact C-N 3.29Å; G778-Y780 PolarHBondContact O-N 3.31Å; Y780-S782 PolarHBondContact O-N 2.86Å
781	A	75.3	Confident	74.1	Confident	92 Å²	92	71.1 Å²	71.1	76%	0.76	42%	0.415	S	S	*	.	S	Bend	trans	-71.9	-15.3	-178	0	0	0	0	0	113.9	G774	G774-A781 PolarHBondContact N-O 3.22Å
782	S	78.6	Confident	73.6	Confident	71 Å²	71	68.5 Å²	68.5	50%	0.497	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-151.1	162.7	175.7	60.6	0	0	0	0	112.8	G772 G774 Y780	G772-S782 CarbonylContact O-C 3.6Å; G772-S782 WeakPolarHBondContact O-CA 3.22Å; G772-S782 VanDerWaalsContact O-CB 3.24Å; G772-S782 WeakPolarHBondContact O-CB 3.32Å; G774-S782 CarbonylContact O-C 3.6Å; G774-S782 VanDerWaalsContact O-CA 3.32Å; G774-S782 WeakPolarHBondContact O-CA 3.12Å; Y780-S782 PolarHBondContact O-N 2.86Å
783	H	82.5	Confident	72.7	Confident	8 Å²	8	78.4 Å²	78.4	4%	0.037	44%	0.441	C	S	.	.			trans	-145	155.2	-180	68.8	-78.6	0	0	0	110.7	C765 C770 G772 S773 G774 H775 C789 P790	C765-H783 WeakPolarHBondContact CB-NE2 3.21Å; C770-H783 VanDerWaalsContact SG-CE1 3.58Å; C770-H783 PolarHBondContact SG-NE2 3.31Å; G772-H783 PolarHBondContact O-N 3.39Å; G772-H783 PolarHBondContact O-ND1 2.83Å; S773-H783 PolarHBondContact O-CE1 3.05Å; S773-H783 PolarHBondContact O-ND1 3.38Å; S773-H783 VanDerWaalsContact O-ND1 3.16Å; G774-H783 WeakPolarHBondContact O-CB 3.24Å; G774-H783 PolarHBondContact O-N 2.89Å; G774-H783 PolarHBondContact O-ND1 3.37Å; H775-H783 HydrophobicContact CB-CB 4.38Å; H783-C789 VanDerWaalsContact CD2-CA 3.47Å; H783-C789 WeakPolarHBondContact CD2-CA 3.44Å; H783-C789 PolarHBondContact CD2-SG 3.02Å; H783-C789 WeakPolarHBondContact NE2-CA 3.21Å; H783-C789 PolarHBondContact NE2-SG 3.37Å; H783-P790 VanDerWaalsContact CE1-CD 3.46Å; H783-P790 WeakPolarHBondContact CE1-CD 3.18Å
784	R	82.3	Confident	71.7	Confident	160 Å²	160	84.7 Å²	84.7	60%	0.604	46%	0.46	S	S	*	.			trans	-129.6	3	-174.1	-60.6	179.5	173.9	169.6	-3.1	114.1
785	S	69.7	Low	70.3	Confident	51 Å²	51	87 Å²	87	36%	0.357	48%	0.483	S	S	.	.	S	Bend	trans	-138.3	154.2	-173.5	62.7	0	0	0	0	111.7	S787 G788 C789	S785-S787 PolarHBondContact O-N 3.19Å; S785-S787 PolarHBondContact OG-OG 3.09Å; S785-G788 PolarHBondContact O-N 3.39Å; S785-C789 PolarHBondContact O-N 3.38Å; S785-C789 VanDerWaalsContact O-N 3.16Å; S785-C789 PolarHBondContact O-SG 3.41Å
786	L	70.1	Confident	69.1	Low	100 Å²	100	88.4 Å²	88.4	52%	0.524	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-55.2	-35.6	175.7	-61.9	-177.1	0	0	0	112.7	P766 T767 G788 C789	P766-L786 HydrophobicContact CG-CD2 3.84Å; P766-L786 HydrophobicContact CG-CG 3.97Å; T767-L786 VanDerWaalsContact OG1-CD2 3.22Å; T767-L786 WeakPolarHBondContact OG1-CD2 3.35Å; L786-G788 PolarHBondContact O-N 3.45Å; L786-C789 WeakPolarHBondContact O-CB 3.41Å; L786-C789 PolarHBondContact O-N 2.94Å
787	S	70.9	Confident	67.1	Low	101 Å²	101	93 Å²	93	71%	0.706	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-62.2	-27	175.8	49.7	0	0	0	0	114	V776 S785	V776-S787 WeakPolarHBondContact CG1-O 3.38Å; S785-S787 PolarHBondContact O-N 3.19Å; S785-S787 PolarHBondContact OG-OG 3.09Å
788	G	70	Confident	65.7	Low	0 Å²	0	98 Å²	98	0%	0	55%	0.546	C	S	.	.	G	3₁₀ helix	trans	-97.7	-9	175.8	0	0	0	0	0	114.7	H775 V776 S785 L786 P790	H775-G788 CarbonylContact C-O 3.52Å; H775-G788 WeakPolarHBondContact CA-O 3.29Å; H775-G788 VanDerWaalsContact NE2-CA 3.27Å; H775-G788 WeakPolarHBondContact NE2-CA 3.31Å; V776-G788 PolarHBondContact N-O 3.46Å; S785-G788 PolarHBondContact O-N 3.39Å; L786-G788 PolarHBondContact O-N 3.45Å; G788-P790 VanDerWaalsContact O-CD 3.31Å; G788-P790 WeakPolarHBondContact O-CD 3.28Å
789	C	80.6	Confident	63.9	Low	1 Å²	1	103.4 Å²	103.4	1%	0.007	56%	0.56	C	S	.	*			trans	-69.4	115.3	-173.3	-72	0	0	0	0	112.5	C765 T767 H783 S785 L786 R791 A792	C765-C789 WeakPolarHBondContact CB-SG 3.21Å; T767-C789 PolarHBondContact OG1-SG 2.92Å; T767-C789 VanDerWaalsContact OG1-SG 3.35Å; H783-C789 VanDerWaalsContact CD2-CA 3.47Å; H783-C789 WeakPolarHBondContact CD2-CA 3.44Å; H783-C789 PolarHBondContact CD2-SG 3.02Å; H783-C789 WeakPolarHBondContact NE2-CA 3.21Å; H783-C789 PolarHBondContact NE2-SG 3.37Å; S785-C789 PolarHBondContact O-N 3.38Å; S785-C789 VanDerWaalsContact O-N 3.16Å; S785-C789 PolarHBondContact O-SG 3.41Å; L786-C789 WeakPolarHBondContact O-CB 3.41Å; L786-C789 PolarHBondContact O-N 2.94Å; C789-R791 PolarHBondContact O-N 2.9Å; C789-A792 HydrophobicContact CB-CB 3.43Å; C789-A792 VanDerWaalsContact CB-CB 3.43Å; C789-A792 PolarHBondContact O-N 3.09Å
790	P	70.8	Confident	62.1	Low	56 Å²	56	103.3 Å²	103.3	36%	0.364	57%	0.565	S	S	.	*	S	Bend	trans	-66.3	-23.6	172.2	28.3	-32.8	0	0	0	112	H783 G788	H783-P790 VanDerWaalsContact CE1-CD 3.46Å; H783-P790 WeakPolarHBondContact CE1-CD 3.18Å; G788-P790 VanDerWaalsContact O-CD 3.31Å; G788-P790 WeakPolarHBondContact O-CD 3.28Å
791	R	67.9	Low	60.8	Low	120 Å²	120	102.6 Å²	102.6	45%	0.453	58%	0.577	S	S	.	*	S	Bend	trans	-87.5	-25.9	-178.4	-67.5	170	66.7	178.5	-6	113.9	T767 G769 D771 C789 R793 K794	T767-R791 HydrophobicContact CG2-CB 4.35Å; G769-R791 PolarHBondContact O-NH1 3.25Å; G769-R791 PolarHBondContact O-NH2 3.49Å; D771-R791 IonicContact OD1-NH1 3.84Å; D771-R791 PolarHBondContact OD1-NH1 2.98Å; C789-R791 PolarHBondContact O-N 2.9Å; R791-R793 PolarHBondContact O-N 3.41Å; R791-K794 PolarHBondContact O-N 3.28Å
792	A	67.7	Low	58.5	Low	44 Å²	44	105.8 Å²	105.8	36%	0.364	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.9	-20.9	-175.9	0	0	0	0	0	114.3	C789	C789-A792 HydrophobicContact CB-CB 3.43Å; C789-A792 VanDerWaalsContact CB-CB 3.43Å; C789-A792 PolarHBondContact O-N 3.09Å
793	R	55.8	Low	56.8	Low	219 Å²	219	111 Å²	111	83%	0.826	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	3.7	-178.8	-77.1	-175.1	166.8	-88.2	-0.8	114.9	R791	R791-R793 PolarHBondContact O-N 3.41Å
794	K	50.8	Low	54.5	Low	199 Å²	199	118.5 Å²	118.5	87%	0.865	64%	0.636	S	S	*	*	S	Bend	trans	-125	34.5	-175	-153.1	-176.1	177.7	-177.4	0	113.6	R791	R791-K794 PolarHBondContact O-N 3.28Å
795	G	43.7	Very low	52.3	Low	75 Å²	75	117.9 Å²	117.9	77%	0.773	65%	0.645	S	S	*	*			trans	-131.3	100.3	175	0	0	0	0	0	111.1
796	G	56.8	Low	51	Low	75 Å²	75	123.8 Å²	123.8	77%	0.773	66%	0.664	S	S	*	*			trans	-144.1	102.2	175.4	0	0	0	0	0	110.6
797	L	35.6	Very low	49.6	Very low	160 Å²	160	124.7 Å²	124.7	84%	0.838	67%	0.669	S	S	*	*			trans	-153.2	105.2	170.6	-155.3	74	0	0	0	112.4
798	K	41.5	Very low	48	Very low	182 Å²	182	128.3 Å²	128.3	79%	0.791	68%	0.675	S	S	*	*			trans	41.3	114.4	146.3	-57.9	-176.9	176.7	-174.2	0	120
799	L	34	Very low	46.7	Very low	177 Å²	177	136 Å²	136	93%	0.927	71%	0.711	S	S	*	*				-127.9	172.1	128	-79.6	-177.4	0	0	0	109.7
800	T	30.4	Very low	45	Very low	135 Å²	135	142 Å²	142	83%	0.828	74%	0.739	S	S	*	*			trans	-99.7	167.2	-155.5	38.3	0	0	0	0	115
801	P	41.4	Very low	44.4	Very low	128 Å²	128	145.2 Å²	145.2	83%	0.831	75%	0.752	S	S	*	*			trans	-91.7	161.7	-153.3	36	-37.3	0	0	0	115.4
802	N	27.4	Very low	44.3	Very low	159 Å²	159	145.5 Å²	145.5	85%	0.85	76%	0.757	S	S	*	*			trans	-130.7	157.9	151	-161.6	1.7	0	0	0	108.8
803	K	42.1	Very low	44.6	Very low	182 Å²	182	143.9 Å²	143.9	79%	0.791	74%	0.743	S	S	*	*			trans	-81.8	127.5	-172.8	-57.3	172.8	-177.3	176.5	0	110.9
804	D	34.5	Very low	45.5	Very low	164 Å²	164	138.3 Å²	138.3	88%	0.877	74%	0.735	S	S	*	*				-164.9	140.7	97.1	-90	-30.2	0	0	0	109.5
805	D	37.1	Very low	46.7	Very low	148 Å²	148	130 Å²	130	79%	0.791	70%	0.701	S	S	*	*			trans	-119.3	107.3	-161.1	-163.8	-33.1	0	0	0	111
806	K	42.8	Very low	48.2	Very low	174 Å²	174	134.1 Å²	134.1	76%	0.757	70%	0.703	S	S	*	*			trans	-155.8	123.5	176.7	-106.4	-89.2	171.3	-179.4	0	110.9
807	D	39.6	Very low	49	Very low	120 Å²	120	133.9 Å²	133.9	64%	0.642	70%	0.701	S	S	*	*			trans	69.5	43	164	-51.9	-41.9	0	0	0	117.3	Q809	D807-Q809 VanDerWaalsContact C-N 3.3Å; D807-Q809 PolarHBondContact O-N 2.96Å
808	E	37.3	Very low	51.2	Low	177 Å²	177	126.8 Å²	126.8	83%	0.827	67%	0.665	S	S	*	*			trans	-61.8	88.8	152.7	-89.5	-149.2	135.6	0	0	110.9	E810	E808-E810 PolarHBondContact O-N 2.86Å
809	Q	44.1	Very low	53	Low	162 Å²	162	123.8 Å²	123.8	76%	0.757	66%	0.657	S	S	*	*			trans	-90.7	78.2	162.2	-69.5	-170	6.6	0	0	110.4	D807 L811	D807-Q809 VanDerWaalsContact C-N 3.3Å; D807-Q809 PolarHBondContact O-N 2.96Å; Q809-L811 PolarHBondContact O-N 2.88Å; Q809-L811 VanDerWaalsContact O-N 3.08Å
810	E	44.3	Very low	55	Low	125 Å²	125	115.8 Å²	115.8	58%	0.584	62%	0.618	S	S	*	*			trans	-49.9	118.1	156.4	-82.2	-155.5	102.5	0	0	108.5	E808 K812	E808-E810 PolarHBondContact O-N 2.86Å; E810-K812 HydrophobicContact CB-CD 4.43Å; E810-K812 HydrophobicContact CB-CG 4.43Å; E810-K812 PolarHBondContact O-N 2.78Å; E810-K812 WeakPolarHBondContact OE2-CE 3.47Å; E810-K812 IonicContact OE2-NZ 2.64Å; E810-K812 PolarHBondContact OE2-NZ 3.41Å
811	L	57.9	Low	57.2	Low	125 Å²	125	114.9 Å²	114.9	65%	0.654	60%	0.604	S	S	*	*			trans	-71.1	66.8	-175.2	-64.9	173	0	0	0	112.4	Q809 R832	Q809-L811 PolarHBondContact O-N 2.88Å; Q809-L811 VanDerWaalsContact O-N 3.08Å; L811-R832 WeakPolarHBondContact O-CD 3.35Å; L811-R832 WeakPolarHBondContact O-CG 3.39Å; L811-R832 PolarHBondContact O-NH1 3.46Å
812	K	65.7	Low	58.8	Low	125 Å²	125	110 Å²	110	54%	0.543	58%	0.577	S	S	.	*			trans	-77.9	171.3	169.9	-70.5	167.9	-176.7	156.7	0	109.6	E810	E810-K812 HydrophobicContact CB-CD 4.43Å; E810-K812 HydrophobicContact CB-CG 4.43Å; E810-K812 PolarHBondContact O-N 2.78Å; E810-K812 WeakPolarHBondContact OE2-CE 3.47Å; E810-K812 IonicContact OE2-NZ 2.64Å; E810-K812 PolarHBondContact OE2-NZ 3.41Å
813	C	74.2	Confident	61.4	Low	11 Å²	11	104.7 Å²	104.7	7%	0.074	55%	0.547	C	S	.	.			trans	-68.5	131	179.9	-172.8	0	0	0	0	111.4	V815 C818 H831 S833 C837	C813-V815 PolarHBondContact O-N 2.73Å; C813-C818 HydrophobicContact CB-CB 4.35Å; C813-H831 VanDerWaalsContact CB-NE2 3.32Å; C813-H831 WeakPolarHBondContact CB-NE2 3.5Å; C813-H831 VanDerWaalsContact SG-CD2 3.5Å; C813-H831 PolarHBondContact SG-NE2 3.3Å; C813-S833 VanDerWaalsContact SG-C 3.56Å; C813-S833 PolarHBondContact SG-O 3.42Å; C813-C837 VanDerWaalsContact SG-CB 3.58Å
814	P	75.3	Confident	63.3	Low	101 Å²	101	100.3 Å²	100.3	66%	0.656	53%	0.532	S	S	*	.	S	Bend	trans	-74.8	24.4	-179.4	31.7	-37.2	0	0	0	114	A834	P814-A834 HydrophobicContact CG-CB 4.34Å
815	V	75.9	Confident	65.2	Low	25 Å²	25	95.8 Å²	95.8	15%	0.152	51%	0.513	C	S	.	.	S	Bend	trans	-102	116.4	177.3	175.1	0	0	0	0	107.7	C813 G817 C818 A834 C837 A840	C813-V815 PolarHBondContact O-N 2.73Å; V815-G817 PolarHBondContact O-N 3.3Å; V815-G817 VanDerWaalsContact O-N 3.17Å; V815-C818 HydrophobicContact CB-CB 3.66Å; V815-C818 HydrophobicContact CG1-CB 3.85Å; V815-C818 VanDerWaalsContact O-CB 3.24Å; V815-C818 WeakPolarHBondContact O-CB 3.48Å; V815-C818 PolarHBondContact O-N 2.94Å; V815-A834 HydrophobicContact CG2-CB 3.57Å; V815-C837 HydrophobicContact CB-CB 4.36Å; V815-C837 HydrophobicContact CG2-CB 3.98Å; V815-A840 HydrophobicContact CG1-CB 4.14Å; V815-A840 HydrophobicContact CG2-CB 3.87Å
816	I	74.1	Confident	66.9	Low	161 Å²	161	92 Å²	92	83%	0.826	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	120.8	-177.6	-57.6	173.8	0	0	0	109.7
817	G	73.8	Confident	68.2	Low	71 Å²	71	91.7 Å²	91.7	73%	0.732	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.7	10.2	-175.5	0	0	0	0	0	115.7	V815 L839	V815-G817 PolarHBondContact O-N 3.3Å; V815-G817 VanDerWaalsContact O-N 3.17Å; G817-L839 WeakPolarHBondContact O-CD1 3.12Å
818	C	82.4	Confident	69.5	Low	11 Å²	11	93.1 Å²	93.1	7%	0.074	50%	0.504	C	S	.	.			trans	-98.7	109.6	172.3	-154.2	0	0	0	0	109.6	C813 V815 G820 H831 C837 L839	C813-C818 HydrophobicContact CB-CB 4.35Å; V815-C818 HydrophobicContact CB-CB 3.66Å; V815-C818 HydrophobicContact CG1-CB 3.85Å; V815-C818 VanDerWaalsContact O-CB 3.24Å; V815-C818 WeakPolarHBondContact O-CB 3.48Å; V815-C818 PolarHBondContact O-N 2.94Å; C818-G820 PolarHBondContact O-N 3.43Å; C818-G820 VanDerWaalsContact O-N 3.16Å; C818-H831 PolarHBondContact SG-CE1 3.17Å; C818-H831 PolarHBondContact SG-NE2 3.42Å; C818-C837 HydrophobicContact CB-CB 4.41Å; C818-C837 WeakPolarHBondContact CB-SG 3.22Å; C818-C837 WeakPolarHBondContact SG-CB 3.4Å; C818-C837 CovalentContact SG-SG 2.06Å; C818-C837 PolarHBondContact SG-SG 3.49Å; C818-L839 HydrophobicContact CB-CD1 4.15Å
819	D	78.8	Confident	71.2	Confident	118 Å²	118	90.1 Å²	90.1	63%	0.631	50%	0.498	S	S	*	.			trans	-65.1	-11.4	-178.8	61.9	-6.7	0	0	0	114.6	Q821	D819-Q821 VanDerWaalsContact OD1-CB 3.31Å; D819-Q821 WeakPolarHBondContact OD1-CB 3.36Å; D819-Q821 PolarHBondContact OD1-N 3.47Å; D819-Q821 VanDerWaalsContact OD2-CB 3.31Å; D819-Q821 WeakPolarHBondContact OD2-CB 3.46Å
820	G	76.9	Confident	73	Confident	9 Å²	9	85.6 Å²	85.6	9%	0.093	49%	0.485	C	S	.	.	S	Bend	trans	89.1	1.5	-173.5	0	0	0	0	0	113.7	C818 S830 H831	C818-G820 PolarHBondContact O-N 3.43Å; C818-G820 VanDerWaalsContact O-N 3.16Å; G820-S830 CarbonylContact O-C 3.54Å; G820-S830 WeakPolarHBondContact O-CA 3.46Å; G820-S830 WeakPolarHBondContact O-CB 3.11Å; G820-H831 VanDerWaalsContact C-CE1 3.4Å; G820-H831 VanDerWaalsContact CA-CE1 3.44Å; G820-H831 WeakPolarHBondContact CA-CE1 3.31Å; G820-H831 PolarHBondContact O-N 2.89Å; G820-H831 PolarHBondContact O-ND1 3.39Å
821	Q	76.6	Confident	74.9	Confident	117 Å²	117	80.1 Å²	80.1	55%	0.547	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-84.4	153.7	179.2	-151.5	76.1	75.4	0	0	111.3	D819 T829 H831	D819-Q821 VanDerWaalsContact OD1-CB 3.31Å; D819-Q821 WeakPolarHBondContact OD1-CB 3.36Å; D819-Q821 PolarHBondContact OD1-N 3.47Å; D819-Q821 VanDerWaalsContact OD2-CB 3.31Å; D819-Q821 WeakPolarHBondContact OD2-CB 3.46Å; Q821-T829 PolarHBondContact NE2-O 2.81Å; Q821-H831 PolarHBondContact O-CE1 3.07Å; Q821-H831 VanDerWaalsContact O-CE1 3.23Å; Q821-H831 PolarHBondContact O-ND1 3.13Å
822	G	74.8	Confident	76	Confident	26 Å²	26	82.2 Å²	82.2	27%	0.268	46%	0.458	S	S	.	.	S	Bend	trans	64.1	-171.6	-174	0	0	0	0	0	114	Y828 T829 S830 H831	G822-Y828 CarbonylContact C-O 3.6Å; G822-T829 PolarHBondContact N-O 3.35Å; G822-S830 CarbonylContact O-C 3.13Å; G822-S830 VanDerWaalsContact O-CA 3.32Å; G822-S830 WeakPolarHBondContact O-CA 3.38Å; G822-H831 PolarHBondContact O-N 3.28Å; G822-H831 PolarHBondContact O-ND1 3.08Å
823	H	82.5	Confident	76.4	Confident	46 Å²	46	79.4 Å²	79.4	21%	0.213	46%	0.455	C	S	.	.			trans	-159.9	147.3	178	-177.2	-91.1	0	0	0	109.2	S825 G826 Y828 S836	H823-S825 PolarHBondContact ND1-N 2.83Å; H823-S825 PolarHBondContact O-N 3.39Å; H823-G826 PolarHBondContact O-N 2.74Å; H823-Y828 HydrophobicContact CB-CD2 4.39Å; H823-Y828 WeakPolarHBondContact CB-O 3.3Å; H823-Y828 AromaticContact CE1-CD2 3.93Å; H823-Y828 AromaticContact CG-CD2 3.86Å; H823-Y828 PolarHBondContact N-O 3.21Å; H823-Y828 AromaticContact ND1-CD2 3.72Å; H823-S836 WeakPolarHBondContact CA-O 3.07Å; H823-S836 WeakPolarHBondContact NE2-CB 3.46Å
824	I	80.4	Confident	76.3	Confident	91 Å²	91	81.1 Å²	81.1	47%	0.467	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-27	-177.3	58.5	162.8	0	0	0	115.1	G835 S836 C837 A841	I824-G835 VanDerWaalsContact CD1-O 3.3Å; I824-G835 WeakPolarHBondContact CD1-O 3.43Å; I824-S836 PolarHBondContact N-O 2.82Å; I824-S836 VanDerWaalsContact N-O 3.08Å; I824-C837 VanDerWaalsContact CG2-O 3.32Å; I824-C837 WeakPolarHBondContact CG2-O 3.31Å; I824-A841 HydrophobicContact CB-CB 4.48Å; I824-A841 HydrophobicContact CG2-CB 3.54Å
825	S	73.9	Confident	76.3	Confident	68 Å²	68	79.7 Å²	79.7	48%	0.476	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-3.5	178.9	-177.4	0	0	0	0	113.9	H823 K827	H823-S825 PolarHBondContact ND1-N 2.83Å; H823-S825 PolarHBondContact O-N 3.39Å; S825-K827 PolarHBondContact O-N 2.84Å
826	G	73.3	Confident	76.1	Confident	68 Å²	68	79.3 Å²	79.3	70%	0.701	47%	0.472	S	S	*	.	S	Bend	trans	68.7	-14.2	-174.9	0	0	0	0	0	116.4	H823 Y828	H823-G826 PolarHBondContact O-N 2.74Å; G826-Y828 PolarHBondContact O-N 3.34Å
827	K	70.3	Confident	76.6	Confident	169 Å²	169	71.7 Å²	71.7	74%	0.735	43%	0.432	S	S	*	.	S	Bend	trans	-82.6	-5.5	-173.2	-65.5	-178.2	-177.5	-175	0	115.9	S825	S825-K827 PolarHBondContact O-N 2.84Å
828	Y	66.6	Low	76.8	Confident	149 Å²	149	70.7 Å²	70.7	58%	0.584	41%	0.413	S	S	*	.			trans	-132.8	140.4	-178	-54.9	-73.5	0	0	0	110	G822 H823 G826 S830	G822-Y828 CarbonylContact C-O 3.6Å; H823-Y828 HydrophobicContact CB-CD2 4.39Å; H823-Y828 WeakPolarHBondContact CB-O 3.3Å; H823-Y828 AromaticContact CE1-CD2 3.93Å; H823-Y828 AromaticContact CG-CD2 3.86Å; H823-Y828 PolarHBondContact N-O 3.21Å; H823-Y828 AromaticContact ND1-CD2 3.72Å; G826-Y828 PolarHBondContact O-N 3.34Å; Y828-S830 VanDerWaalsContact C-N 3.31Å; Y828-S830 PolarHBondContact O-N 3.47Å
829	T	74.3	Confident	76.5	Confident	114 Å²	114	73.8 Å²	73.8	70%	0.699	43%	0.428	S	S	*	.	S	Bend	trans	-77.3	-15.3	-176	49.1	0	0	0	0	113.4	Q821 G822	Q821-T829 PolarHBondContact NE2-O 2.81Å; G822-T829 PolarHBondContact N-O 3.35Å
830	S	81.4	Confident	76.6	Confident	67 Å²	67	69.1 Å²	69.1	47%	0.469	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-150.5	166.1	176.3	59.4	0	0	0	0	112.6	G820 G822 Y828	G820-S830 CarbonylContact O-C 3.54Å; G820-S830 WeakPolarHBondContact O-CA 3.46Å; G820-S830 WeakPolarHBondContact O-CB 3.11Å; G822-S830 CarbonylContact O-C 3.13Å; G822-S830 VanDerWaalsContact O-CA 3.32Å; G822-S830 WeakPolarHBondContact O-CA 3.38Å; Y828-S830 VanDerWaalsContact C-N 3.31Å; Y828-S830 PolarHBondContact O-N 3.47Å
831	H	83.9	Confident	76.6	Confident	11 Å²	11	70.9 Å²	70.9	5%	0.051	42%	0.42	C	S	.	.			trans	-148.2	162.2	-179.8	69.7	-80.3	0	0	0	110.7	C813 C818 G820 Q821 G822 C837	C813-H831 VanDerWaalsContact CB-NE2 3.32Å; C813-H831 WeakPolarHBondContact CB-NE2 3.5Å; C813-H831 VanDerWaalsContact SG-CD2 3.5Å; C813-H831 PolarHBondContact SG-NE2 3.3Å; C818-H831 PolarHBondContact SG-CE1 3.17Å; C818-H831 PolarHBondContact SG-NE2 3.42Å; G820-H831 VanDerWaalsContact C-CE1 3.4Å; G820-H831 VanDerWaalsContact CA-CE1 3.44Å; G820-H831 WeakPolarHBondContact CA-CE1 3.31Å; G820-H831 PolarHBondContact O-N 2.89Å; G820-H831 PolarHBondContact O-ND1 3.39Å; Q821-H831 PolarHBondContact O-CE1 3.07Å; Q821-H831 VanDerWaalsContact O-CE1 3.23Å; Q821-H831 PolarHBondContact O-ND1 3.13Å; G822-H831 PolarHBondContact O-N 3.28Å; G822-H831 PolarHBondContact O-ND1 3.08Å; H831-C837 VanDerWaalsContact CD2-CA 3.44Å; H831-C837 WeakPolarHBondContact CD2-CA 3.42Å; H831-C837 VanDerWaalsContact NE2-CA 3.33Å; H831-C837 WeakPolarHBondContact NE2-CA 3.4Å; H831-C837 VanDerWaalsContact NE2-CB 3.26Å; H831-C837 WeakPolarHBondContact NE2-CB 3.37Å
832	R	80.9	Confident	76.4	Confident	168 Å²	168	71.1 Å²	71.1	63%	0.634	42%	0.419	S	S	*	.			trans	-131.8	8.3	-178.2	-63.2	-175.9	-178.6	-102.7	5.9	114.6	L811	L811-R832 WeakPolarHBondContact O-CD 3.35Å; L811-R832 WeakPolarHBondContact O-CG 3.39Å; L811-R832 PolarHBondContact O-NH1 3.46Å
833	S	73.4	Confident	76.2	Confident	67 Å²	67	77.8 Å²	77.8	47%	0.469	44%	0.436	S	S	.	.	S	Bend	trans	-135.7	147.5	-173.7	-45.9	0	0	0	0	111.3	C813 G835 S836 C837	C813-S833 VanDerWaalsContact SG-C 3.56Å; C813-S833 PolarHBondContact SG-O 3.42Å; S833-G835 VanDerWaalsContact C-N 3.31Å; S833-G835 PolarHBondContact O-N 3.27Å; S833-S836 WeakPolarHBondContact CB-OG 3.47Å; S833-S836 CarbonylContact O-C 3.27Å; S833-S836 PolarHBondContact O-N 3.48Å; S833-S836 PolarHBondContact O-OG 3.41Å; S833-C837 PolarHBondContact O-N 3.13Å; S833-C837 VanDerWaalsContact O-N 3.16Å
834	A	72.8	Confident	75.2	Confident	47 Å²	47	83 Å²	83	39%	0.388	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-58.1	-42.3	-177.6	0	0	0	0	0	112.8	P814 V815 S836 C837 A840	P814-A834 HydrophobicContact CG-CB 4.34Å; V815-A834 HydrophobicContact CG2-CB 3.57Å; A834-S836 PolarHBondContact O-N 3.05Å; A834-S836 VanDerWaalsContact O-N 3.11Å; A834-C837 PolarHBondContact O-N 3.25Å; A834-A840 WeakPolarHBondContact O-CB 3.21Å
835	G	75.1	Confident	74	Confident	70 Å²	70	86.8 Å²	86.8	72%	0.722	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-66.3	-5.9	175.2	0	0	0	0	0	115.3	I824 S833	I824-G835 VanDerWaalsContact CD1-O 3.3Å; I824-G835 WeakPolarHBondContact CD1-O 3.43Å; S833-G835 VanDerWaalsContact C-N 3.31Å; S833-G835 PolarHBondContact O-N 3.27Å
836	S	72	Confident	72.7	Confident	18 Å²	18	88.5 Å²	88.5	13%	0.126	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-117.2	-1.4	174.6	47.8	0	0	0	0	114.8	H823 I824 S833 A834	H823-S836 WeakPolarHBondContact CA-O 3.07Å; H823-S836 WeakPolarHBondContact NE2-CB 3.46Å; I824-S836 PolarHBondContact N-O 2.82Å; I824-S836 VanDerWaalsContact N-O 3.08Å; S833-S836 WeakPolarHBondContact CB-OG 3.47Å; S833-S836 CarbonylContact O-C 3.27Å; S833-S836 PolarHBondContact O-N 3.48Å; S833-S836 PolarHBondContact O-OG 3.41Å; A834-S836 PolarHBondContact O-N 3.05Å; A834-S836 VanDerWaalsContact O-N 3.11Å
837	C	84.3	Confident	71.2	Confident	0 Å²	0	90 Å²	90	0%	0	47%	0.474	C	S	.	.			trans	-75.9	124.3	175.1	171	0	0	0	0	112.3	C813 V815 C818 I824 H831 S833 A834 L839 A840 A841	C813-C837 VanDerWaalsContact SG-CB 3.58Å; V815-C837 HydrophobicContact CB-CB 4.36Å; V815-C837 HydrophobicContact CG2-CB 3.98Å; C818-C837 HydrophobicContact CB-CB 4.41Å; C818-C837 WeakPolarHBondContact CB-SG 3.22Å; C818-C837 WeakPolarHBondContact SG-CB 3.4Å; C818-C837 CovalentContact SG-SG 2.06Å; C818-C837 PolarHBondContact SG-SG 3.49Å; I824-C837 VanDerWaalsContact CG2-O 3.32Å; I824-C837 WeakPolarHBondContact CG2-O 3.31Å; H831-C837 VanDerWaalsContact CD2-CA 3.44Å; H831-C837 WeakPolarHBondContact CD2-CA 3.42Å; H831-C837 VanDerWaalsContact NE2-CA 3.33Å; H831-C837 WeakPolarHBondContact NE2-CA 3.4Å; H831-C837 VanDerWaalsContact NE2-CB 3.26Å; H831-C837 WeakPolarHBondContact NE2-CB 3.37Å; S833-C837 PolarHBondContact O-N 3.13Å; S833-C837 VanDerWaalsContact O-N 3.16Å; A834-C837 PolarHBondContact O-N 3.25Å; C837-L839 VanDerWaalsContact C-N 3.27Å; C837-L839 PolarHBondContact O-N 3.47Å; C837-L839 PolarHBondContact SG-N 3.33Å; C837-L839 VanDerWaalsContact SG-N 3.42Å; C837-A840 HydrophobicContact CB-CB 3.98Å; C837-A840 PolarHBondContact O-N 3.46Å; C837-A840 PolarHBondContact SG-N 2.98Å; C837-A840 VanDerWaalsContact SG-N 3.4Å; C837-A841 PolarHBondContact O-N 3.19Å; C837-A841 VanDerWaalsContact O-N 3.17Å
838	P	78.1	Confident	70	Confident	50 Å²	50	86.7 Å²	86.7	33%	0.325	47%	0.472	S	S	.	.	H	α-helix	trans	-63.1	-31.7	177.5	25.7	-32.7	0	0	0	112.7	K842	P838-K842 WeakPolarHBondContact O-CB 3.35Å; P838-K842 PolarHBondContact O-N 3.17Å
839	L	77	Confident	69.4	Low	76 Å²	76	86 Å²	86	40%	0.398	48%	0.477	S	S	.	.	H	α-helix	trans	-70.9	-33.3	177.1	-65.8	161.8	0	0	0	112.8	G817 C818 C837 R843	G817-L839 WeakPolarHBondContact O-CD1 3.12Å; C818-L839 HydrophobicContact CB-CD1 4.15Å; C837-L839 VanDerWaalsContact C-N 3.27Å; C837-L839 PolarHBondContact O-N 3.47Å; C837-L839 PolarHBondContact SG-N 3.33Å; C837-L839 VanDerWaalsContact SG-N 3.42Å; L839-R843 WeakPolarHBondContact O-CG 3.44Å; L839-R843 PolarHBondContact O-N 3.32Å
840	A	79.3	Confident	67.6	Low	20 Å²	20	88.4 Å²	88.4	17%	0.165	49%	0.485	C	S	.	.	H	α-helix	trans	-69.1	-44.6	173.5	0	0	0	0	0	111.5	V815 A834 C837 K842 R843 Q844	V815-A840 HydrophobicContact CG1-CB 4.14Å; V815-A840 HydrophobicContact CG2-CB 3.87Å; A834-A840 WeakPolarHBondContact O-CB 3.21Å; C837-A840 HydrophobicContact CB-CB 3.98Å; C837-A840 PolarHBondContact O-N 3.46Å; C837-A840 PolarHBondContact SG-N 2.98Å; C837-A840 VanDerWaalsContact SG-N 3.4Å; A840-K842 VanDerWaalsContact C-N 3.33Å; A840-K842 PolarHBondContact O-N 3.39Å; A840-R843 PolarHBondContact O-N 3.33Å; A840-Q844 VanDerWaalsContact O-CG 3.3Å; A840-Q844 WeakPolarHBondContact O-CG 3.19Å; A840-Q844 PolarHBondContact O-N 3.49Å
841	A	76.9	Confident	65.5	Low	46 Å²	46	88.7 Å²	88.7	38%	0.38	50%	0.499	S	S	.	.	H	α-helix	trans	-64	-36.7	174.7	0	0	0	0	0	112.5	I824 C837 K845	I824-A841 HydrophobicContact CB-CB 4.48Å; I824-A841 HydrophobicContact CG2-CB 3.54Å; C837-A841 PolarHBondContact O-N 3.19Å; C837-A841 VanDerWaalsContact O-N 3.17Å; A841-K845 PolarHBondContact O-N 2.03Å; A841-K845 VanDerWaalsContact O-N 3.09Å
842	K	73.6	Confident	63.3	Low	122 Å²	122	96.2 Å²	96.2	53%	0.53	54%	0.539	S	S	.	.	H	α-helix	trans	-61.1	-52.9	172.2	-169.8	-172	172.8	-160.7	0	110.5	P838 A840 Q844 K845 E846	P838-K842 WeakPolarHBondContact O-CB 3.35Å; P838-K842 PolarHBondContact O-N 3.17Å; A840-K842 VanDerWaalsContact C-N 3.33Å; A840-K842 PolarHBondContact O-N 3.39Å; K842-Q844 VanDerWaalsContact C-N 3.34Å; K842-Q844 PolarHBondContact O-N 3.12Å; K842-K845 PolarHBondContact O-N 2.97Å; K842-E846 WeakPolarHBondContact CE-OE1 3.34Å; K842-E846 WeakPolarHBondContact CE-OE2 3.45Å; K842-E846 IonicContact NZ-OE1 2.79Å; K842-E846 PolarHBondContact NZ-OE1 2.99Å; K842-E846 IonicContact NZ-OE2 3.83Å; K842-E846 WeakPolarHBondContact O-CB 3.46Å; K842-E846 PolarHBondContact O-N 2.97Å
843	R	70.2	Confident	61.2	Low	166 Å²	166	94 Å²	94	63%	0.626	55%	0.546	S	S	*	.	H	α-helix	trans	-55.7	-44.9	178.3	-75.5	174.6	177.5	-100.6	5	112.3	L839 A840 K845 E846 S847	L839-R843 WeakPolarHBondContact O-CG 3.44Å; L839-R843 PolarHBondContact O-N 3.32Å; A840-R843 PolarHBondContact O-N 3.33Å; R843-K845 VanDerWaalsContact C-N 3.33Å; R843-K845 PolarHBondContact O-N 3.28Å; R843-E846 PolarHBondContact O-N 3.1Å; R843-S847 PolarHBondContact O-N 3.06Å; R843-S847 PolarHBondContact O-OG 3.1Å; R843-S847 VanDerWaalsContact O-OG 3.09Å
844	Q	61.1	Low	59	Low	155 Å²	155	101 Å²	101	72%	0.724	57%	0.569	S	S	*	*	H	α-helix	trans	-58.4	-40.5	175.1	-72.4	-100.2	-73.1	0	0	113	A840 K842	A840-Q844 VanDerWaalsContact O-CG 3.3Å; A840-Q844 WeakPolarHBondContact O-CG 3.19Å; A840-Q844 PolarHBondContact O-N 3.49Å; K842-Q844 VanDerWaalsContact C-N 3.34Å; K842-Q844 PolarHBondContact O-N 3.12Å
845	K	56.3	Low	57.1	Low	171 Å²	171	102.9 Å²	102.9	74%	0.743	58%	0.584	S	S	*	*	H	α-helix	trans	-72.8	-32.6	176.9	-167.9	177.2	-179.7	-176.5	0	112.5	A841 K842 R843 S848	A841-K845 PolarHBondContact O-N 2.03Å; A841-K845 VanDerWaalsContact O-N 3.09Å; K842-K845 PolarHBondContact O-N 2.97Å; R843-K845 VanDerWaalsContact C-N 3.33Å; R843-K845 PolarHBondContact O-N 3.28Å; K845-S848 WeakPolarHBondContact O-CB 3.43Å; K845-S848 PolarHBondContact O-N 3.48Å; K845-S848 PolarHBondContact O-OG 3.13Å
846	E	45.8	Very low	55	Low	105 Å²	105	110.5 Å²	110.5	49%	0.491	59%	0.591	S	S	.	*	H	α-helix	trans	-75.7	-32.6	179.8	-151.6	150.1	-138.5	0	0	111.3	K842 R843 S848 I849	K842-E846 WeakPolarHBondContact CE-OE1 3.34Å; K842-E846 WeakPolarHBondContact CE-OE2 3.45Å; K842-E846 IonicContact NZ-OE1 2.79Å; K842-E846 PolarHBondContact NZ-OE1 2.99Å; K842-E846 IonicContact NZ-OE2 3.83Å; K842-E846 WeakPolarHBondContact O-CB 3.46Å; K842-E846 PolarHBondContact O-N 2.97Å; R843-E846 PolarHBondContact O-N 3.1Å; E846-S848 PolarHBondContact O-N 2.78Å; E846-I849 WeakPolarHBondContact O-CG1 3.39Å; E846-I849 PolarHBondContact O-N 3.36Å
847	S	42.2	Very low	53.1	Low	99 Å²	99	118.9 Å²	118.9	69%	0.692	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	0.2	169.5	-61	0	0	0	0	115.1	R843 I849	R843-S847 PolarHBondContact O-N 3.06Å; R843-S847 PolarHBondContact O-OG 3.1Å; R843-S847 VanDerWaalsContact O-OG 3.09Å; S847-I849 VanDerWaalsContact C-N 3.29Å
848	S	44.7	Very low	50.8	Low	99 Å²	99	123.3 Å²	123.3	69%	0.692	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-2.8	174.7	-60.1	0	0	0	0	113.8	K845 E846	K845-S848 WeakPolarHBondContact O-CB 3.43Å; K845-S848 PolarHBondContact O-N 3.48Å; K845-S848 PolarHBondContact O-OG 3.13Å; E846-S848 PolarHBondContact O-N 2.78Å
849	I	53.4	Low	48.2	Very low	136 Å²	136	128.2 Å²	128.2	70%	0.697	69%	0.685	S	S	*	*	S	Bend	trans	-109.3	74.7	175.3	55.9	146	0	0	0	112.7	E846 S847	E846-I849 WeakPolarHBondContact O-CG1 3.39Å; E846-I849 PolarHBondContact O-N 3.36Å; S847-I849 VanDerWaalsContact C-N 3.29Å
850	N	36.8	Very low	46.3	Very low	163 Å²	163	133.1 Å²	133.1	87%	0.872	70%	0.703	S	S	*	*	S	Bend	trans	174.6	113.7	136.7	-88.4	-24.7	0	0	0	112.5
851	G	37.4	Very low	44.7	Very low	73 Å²	73	141.5 Å²	141.5	75%	0.753	74%	0.739	S	S	*	*	S	Bend	trans	73	74.7	146.3	0	0	0	0	0	120.4
852	L	37.5	Very low	42.7	Very low	170 Å²	170	147.2 Å²	147.2	89%	0.89	76%	0.758	S	S	*	*				160.6	126.2	123.4	-86.9	163.8	0	0	0	111.7
853	P	37.7	Very low	41.6	Very low	122 Å²	122	146.3 Å²	146.3	79%	0.792	76%	0.759	S	S	*	*			trans	-93.4	115.9	-176	33.9	-31.7	0	0	0	113.4
854	F	26.5	Very low	41	Very low	213 Å²	213	142.3 Å²	142.3	93%	0.934	75%	0.754	S	S	*	*			trans	-86.1	122	163.2	-111.6	-89.9	0	0	0	110.6
855	A	34	Very low	41.1	Very low	86 Å²	86	139.2 Å²	139.2	71%	0.711	74%	0.739	S	S	*	*			trans	-89.7	115.8	-168.1	0	0	0	0	0	113.2
856	W	29.2	Very low	41.9	Very low	230 Å²	230	131.4 Å²	131.4	87%	0.871	71%	0.706	S	S	*	*			trans	-95.4	111.7	156.9	70.9	-72.4	0	0	0	108.6
857	K	33.4	Very low	43	Very low	195 Å²	195	131 Å²	131	85%	0.848	71%	0.713	S	S	*	*			trans	-84.7	117.5	176.2	-74.3	-169.7	177	-176.9	0	109.9	N859	K857-N859 PolarHBondContact O-N 3.15Å
858	A	35	Very low	44.2	Very low	92 Å²	92	128.5 Å²	128.5	76%	0.76	69%	0.692	S	S	*	*			trans	-67.2	126.3	159.9	0	0	0	0	0	109.2
859	N	25.2	Very low	45.2	Very low	154 Å²	154	130 Å²	130	82%	0.824	70%	0.699	S	S	*	*			trans	-124.5	158	164.7	-163.8	16.1	0	0	0	109.6	K857	K857-N859 PolarHBondContact O-N 3.15Å
860	K	37	Very low	45.9	Very low	178 Å²	178	127.2 Å²	127.2	77%	0.774	70%	0.703	S	S	*	*			trans	-87.6	147.6	-164.5	-58.8	177.7	-177	177.9	0	112.6
861	Q	44.1	Very low	47.9	Very low	197 Å²	197	119.7 Å²	119.7	92%	0.921	66%	0.664	S	S	*	*			trans	29.2	93.7	153	-68.1	177.1	-40.6	0	0	117.8
862	E	35.3	Very low	49.7	Very low	166 Å²	166	120.8 Å²	120.8	78%	0.776	65%	0.652	S	S	*	*			trans	-144.3	153.6	149.2	-155.2	158.5	-141.5	0	0	109.6
863	L	49.7	Very low	51.4	Low	103 Å²	103	113 Å²	113	54%	0.539	61%	0.614	S	S	.	*			trans	-75.9	157.1	-178.2	-102.1	65.2	0	0	0	111	H865	L863-H865 PolarHBondContact O-CD2 3.09Å; L863-H865 VanDerWaalsContact O-CD2 3.29Å; L863-H865 PolarHBondContact O-N 3.44Å
864	P	58.4	Low	53.1	Low	82 Å²	82	112 Å²	112	53%	0.532	60%	0.601	S	S	.	*			trans	-64.4	101.8	173.2	-17.1	29.8	0	0	0	110.4	R885	P864-R885 WeakPolarHBondContact O-CG 3.34Å
865	H	63.5	Low	55.3	Low	89 Å²	89	103.2 Å²	103.2	41%	0.412	57%	0.57	S	S	.	*			trans	-67.5	154.8	-178.8	-92.1	-96.6	0	0	0	112.5	L863 C871 N872	L863-H865 PolarHBondContact O-CD2 3.09Å; L863-H865 VanDerWaalsContact O-CD2 3.29Å; L863-H865 PolarHBondContact O-N 3.44Å; H865-C871 PolarHBondContact ND1-O 3.3Å; H865-N872 PolarHBondContact CE1-O 3.38Å; H865-N872 VanDerWaalsContact CE1-O 3.24Å
866	C	71.9	Confident	57.6	Low	7 Å²	7	100.8 Å²	100.8	5%	0.047	54%	0.544	C	S	.	.			trans	-62.7	137.6	169.2	-173.9	0	0	0	0	110.1	L868 C871 H884 S886 C890	C866-L868 PolarHBondContact O-N 3.18Å; C866-C871 HydrophobicContact CB-CB 4.25Å; C866-H884 WeakPolarHBondContact CB-NE2 3.43Å; C866-S886 VanDerWaalsContact SG-C 3.55Å; C866-S886 PolarHBondContact SG-O 3.03Å; C866-S886 VanDerWaalsContact SG-O 3.35Å; C866-C890 HydrophobicContact CB-CB 4.48Å; C866-C890 VanDerWaalsContact SG-CB 3.55Å
867	P	70.8	Confident	59.9	Low	98 Å²	98	91.4 Å²	91.4	64%	0.636	52%	0.516	S	S	*	.	S	Bend	trans	-73.1	24	-179	30.5	-36.8	0	0	0	114.6	L887	P867-L887 HydrophobicContact CG-CD2 3.93Å; P867-L887 HydrophobicContact CG-CG 3.96Å
868	L	66.4	Low	61.7	Low	46 Å²	46	87.8 Å²	87.8	24%	0.241	51%	0.506	C	S	.	.	S	Bend	trans	-96.6	121.3	170.8	-102.7	160.7	0	0	0	109.8	C866 G870 C871 L887 C890 N893	C866-L868 PolarHBondContact O-N 3.18Å; L868-G870 PolarHBondContact O-N 3Å; L868-G870 VanDerWaalsContact O-N 3.15Å; L868-C871 HydrophobicContact CB-CB 3.67Å; L868-C871 PolarHBondContact O-N 3Å; L868-L887 HydrophobicContact CB-CD2 4.29Å; L868-L887 HydrophobicContact CD1-CD2 3.67Å; L868-L887 HydrophobicContact CG-CD2 3.58Å; L868-C890 HydrophobicContact CD1-CB 4.01Å; L868-N893 HydrophobicContact CD1-CB 3.47Å; L868-N893 VanDerWaalsContact CD1-CB 3.47Å
869	P	66.5	Low	63.3	Low	131 Å²	131	90.6 Å²	90.6	85%	0.851	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	121.9	174	-27.1	35.6	0	0	0	111.2
870	G	67.1	Low	65.6	Low	76 Å²	76	88.2 Å²	88.2	78%	0.784	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	-2.7	-177.5	0	0	0	0	0	116.5	L868 N872	L868-G870 PolarHBondContact O-N 3Å; L868-G870 VanDerWaalsContact O-N 3.15Å; G870-N872 PolarHBondContact O-N 3.43Å
871	C	80	Confident	67.3	Low	6 Å²	6	85.9 Å²	85.9	4%	0.041	49%	0.489	C	S	.	.			trans	-83.4	102.8	173.8	-156.8	0	0	0	0	110.4	H865 C866 L868 G873 H884 C890 L892	H865-C871 PolarHBondContact ND1-O 3.3Å; C866-C871 HydrophobicContact CB-CB 4.25Å; L868-C871 HydrophobicContact CB-CB 3.67Å; L868-C871 PolarHBondContact O-N 3Å; C871-G873 PolarHBondContact O-N 3.32Å; C871-H884 PolarHBondContact SG-CE1 2.84Å; C871-H884 PolarHBondContact SG-NE2 3.41Å; C871-C890 HydrophobicContact CB-CB 4.38Å; C871-C890 WeakPolarHBondContact CB-SG 3.3Å; C871-C890 WeakPolarHBondContact SG-CB 3.2Å; C871-C890 CovalentContact SG-SG 2.06Å; C871-C890 PolarHBondContact SG-SG 2.9Å; C871-L892 HydrophobicContact CB-CD1 4.08Å
872	N	75.3	Confident	68.7	Low	95 Å²	95	80.6 Å²	80.6	51%	0.508	48%	0.478	S	S	.	.			trans	-71	14.4	-174	72.7	-8.6	0	0	0	115.5	H865 G870 L874	H865-N872 PolarHBondContact CE1-O 3.38Å; H865-N872 VanDerWaalsContact CE1-O 3.24Å; G870-N872 PolarHBondContact O-N 3.43Å; N872-L874 PolarHBondContact O-N 3.37Å; N872-L874 VanDerWaalsContact O-N 3.12Å; N872-L874 WeakPolarHBondContact OD1-CB 3.5Å; N872-L874 PolarHBondContact OD1-N 3.35Å
873	G	72.6	Confident	70.7	Confident	8 Å²	8	75.8 Å²	75.8	8%	0.082	46%	0.461	C	S	.	.	S	Bend	trans	71.4	-2.8	179.1	0	0	0	0	0	115.5	C871 T883 H884	C871-G873 PolarHBondContact O-N 3.32Å; G873-T883 CarbonylContact O-C 3.55Å; G873-T883 WeakPolarHBondContact O-CA 3.45Å; G873-T883 VanDerWaalsContact O-CB 3.28Å; G873-T883 WeakPolarHBondContact O-CB 3.49Å; G873-H884 VanDerWaalsContact CA-CE1 3.48Å; G873-H884 WeakPolarHBondContact CA-CE1 3.35Å; G873-H884 PolarHBondContact O-N 3.37Å; G873-H884 PolarHBondContact O-ND1 3.4Å
874	L	73.8	Confident	72.2	Confident	100 Å²	100	71.2 Å²	71.2	52%	0.524	44%	0.437	S	S	.	.	B	Isolated β-bridge	trans	-86.8	153.1	-179.5	-57.4	-173.5	0	0	0	112.7	N872 T883 H884	N872-L874 PolarHBondContact O-N 3.37Å; N872-L874 VanDerWaalsContact O-N 3.12Å; N872-L874 WeakPolarHBondContact OD1-CB 3.5Å; N872-L874 PolarHBondContact OD1-N 3.35Å; L874-T883 HydrophobicContact CD2-CG2 4.03Å; L874-H884 PolarHBondContact O-CE1 3.31Å; L874-H884 PolarHBondContact O-ND1 2.79Å
875	G	73	Confident	73.2	Confident	28 Å²	28	74.1 Å²	74.1	29%	0.289	44%	0.437	S	S	.	.	S	Bend	trans	65.7	-174.7	-174.5	0	0	0	0	0	113.8	F881 A882 T883 H884	G875-F881 CarbonylContact C-O 3.56Å; G875-F881 VanDerWaalsContact C-O 3.24Å; G875-A882 PolarHBondContact N-O 3.05Å; G875-T883 CarbonylContact O-C 3.45Å; G875-H884 PolarHBondContact O-N 3.21Å; G875-H884 PolarHBondContact O-ND1 2.99Å
876	H	81.1	Confident	73.5	Confident	35 Å²	35	72.3 Å²	72.3	16%	0.162	43%	0.434	C	S	.	.			trans	-149.8	149.4	172.6	-167	-74.7	0	0	0	109.1	N878 N879 F881 G889	H876-N878 PolarHBondContact ND1-N 2.77Å; H876-N878 PolarHBondContact O-N 3.08Å; H876-N879 PolarHBondContact O-N 2.79Å; H876-N879 PolarHBondContact O-OD1 2.81Å; H876-F881 HydrophobicContact CB-CB 3.99Å; H876-F881 WeakPolarHBondContact CB-O 3.3Å; H876-F881 AromaticContact CD2-CD2 3.85Å; H876-F881 PolarHBondContact N-O 3.46Å; H876-G889 CarbonylContact C-O 3.59Å; H876-G889 VanDerWaalsContact CA-O 3.3Å; H876-G889 WeakPolarHBondContact CA-O 3.37Å
877	A	78.6	Confident	73.4	Confident	34 Å²	34	75.9 Å²	75.9	28%	0.281	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-6.7	-178.8	0	0	0	0	0	116.1	G889 A894	A877-G889 PolarHBondContact N-O 2.88Å; A877-A894 HydrophobicContact CB-CB 3.9Å
878	N	70.5	Confident	73.5	Confident	119 Å²	119	76 Å²	76	64%	0.636	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	3.3	177.2	-64.2	4.4	0	0	0	112.2	H876 V880	H876-N878 PolarHBondContact ND1-N 2.77Å; H876-N878 PolarHBondContact O-N 3.08Å; N878-V880 HydrophobicContact CB-CG2 4.22Å; N878-V880 PolarHBondContact O-N 3.47Å
879	N	68.1	Low	73.7	Confident	150 Å²	150	73.8 Å²	73.8	80%	0.802	44%	0.444	S	S	*	.	S	Bend	trans	56.9	-0.3	-172.1	-62.7	-0.8	0	0	0	117.2	H876 F881	H876-N879 PolarHBondContact O-N 2.79Å; H876-N879 PolarHBondContact O-OD1 2.81Å; N879-F881 PolarHBondContact O-N 2.86Å
880	V	74.9	Confident	74.4	Confident	105 Å²	105	67.6 Å²	67.6	64%	0.636	40%	0.404	S	S	*	.	S	Bend	trans	-69.8	-26.4	179.9	-179	0	0	0	0	113.7	N878	N878-V880 HydrophobicContact CB-CG2 4.22Å; N878-V880 PolarHBondContact O-N 3.47Å
881	F	71.5	Confident	74.8	Confident	129 Å²	129	65.6 Å²	65.6	57%	0.566	38%	0.377	S	S	*	.			trans	-124.7	138.7	-174.8	-56.8	-72.2	0	0	0	112	G875 H876 N879 T883	G875-F881 CarbonylContact C-O 3.56Å; G875-F881 VanDerWaalsContact C-O 3.24Å; H876-F881 HydrophobicContact CB-CB 3.99Å; H876-F881 WeakPolarHBondContact CB-O 3.3Å; H876-F881 AromaticContact CD2-CD2 3.85Å; H876-F881 PolarHBondContact N-O 3.46Å; N879-F881 PolarHBondContact O-N 2.86Å; F881-T883 PolarHBondContact O-N 3.39Å
882	A	73.4	Confident	74.4	Confident	85 Å²	85	69.6 Å²	69.6	70%	0.702	40%	0.398	S	S	*	.	S	Bend	trans	-71.3	-15.5	-179.8	0	0	0	0	0	114	G875	G875-A882 PolarHBondContact N-O 3.05Å
883	T	77.8	Confident	74.3	Confident	65 Å²	65	66.7 Å²	66.7	40%	0.399	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-144.5	157.8	176.7	62.1	0	0	0	0	111.4	G873 L874 G875 F881	G873-T883 CarbonylContact O-C 3.55Å; G873-T883 WeakPolarHBondContact O-CA 3.45Å; G873-T883 VanDerWaalsContact O-CB 3.28Å; G873-T883 WeakPolarHBondContact O-CB 3.49Å; L874-T883 HydrophobicContact CD2-CG2 4.03Å; G875-T883 CarbonylContact O-C 3.45Å; F881-T883 PolarHBondContact O-N 3.39Å
884	H	80.6	Confident	74.1	Confident	8 Å²	8	67.9 Å²	67.9	4%	0.037	39%	0.391	C	S	.	.			trans	-136.3	157.6	172.4	66.7	-83.6	0	0	0	110.6	C866 C871 G873 L874 G875 C890	C866-H884 WeakPolarHBondContact CB-NE2 3.43Å; C871-H884 PolarHBondContact SG-CE1 2.84Å; C871-H884 PolarHBondContact SG-NE2 3.41Å; G873-H884 VanDerWaalsContact CA-CE1 3.48Å; G873-H884 WeakPolarHBondContact CA-CE1 3.35Å; G873-H884 PolarHBondContact O-N 3.37Å; G873-H884 PolarHBondContact O-ND1 3.4Å; L874-H884 PolarHBondContact O-CE1 3.31Å; L874-H884 PolarHBondContact O-ND1 2.79Å; G875-H884 PolarHBondContact O-N 3.21Å; G875-H884 PolarHBondContact O-ND1 2.99Å; H884-C890 WeakPolarHBondContact CD2-CA 3.41Å; H884-C890 PolarHBondContact CD2-N 3.16Å; H884-C890 WeakPolarHBondContact NE2-CA 3.36Å; H884-C890 VanDerWaalsContact NE2-CB 3.3Å; H884-C890 WeakPolarHBondContact NE2-CB 3.25Å
885	R	79.6	Confident	73.7	Confident	142 Å²	142	69.2 Å²	69.2	54%	0.536	40%	0.395	S	S	.	.			trans	-126.2	-6.5	177.5	-58.1	-173.7	176.9	164.4	-0	114.1	P864	P864-R885 WeakPolarHBondContact O-CG 3.34Å
886	S	70.9	Confident	73.1	Confident	51 Å²	51	70.6 Å²	70.6	36%	0.357	40%	0.4	S	S	.	.	S	Bend	trans	-116.6	159.1	-176.6	61.8	0	0	0	0	112.1	C866 S888 G889 C890	C866-S886 VanDerWaalsContact SG-C 3.55Å; C866-S886 PolarHBondContact SG-O 3.03Å; C866-S886 VanDerWaalsContact SG-O 3.35Å; S886-S888 WeakPolarHBondContact CB-OG 3.19Å; S886-S888 PolarHBondContact O-N 3.1Å; S886-S888 PolarHBondContact OG-OG 2.88Å; S886-G889 PolarHBondContact O-N 3.28Å; S886-G889 PolarHBondContact OG-N 3.45Å; S886-C890 PolarHBondContact O-N 3.04Å; S886-C890 VanDerWaalsContact O-N 3.12Å
887	L	69.5	Low	72	Confident	83 Å²	83	73.1 Å²	73.1	44%	0.435	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-33.1	172	-64.7	177.6	0	0	0	112.4	P867 L868 G889 N893	P867-L887 HydrophobicContact CG-CD2 3.93Å; P867-L887 HydrophobicContact CG-CG 3.96Å; L868-L887 HydrophobicContact CB-CD2 4.29Å; L868-L887 HydrophobicContact CD1-CD2 3.67Å; L868-L887 HydrophobicContact CG-CD2 3.58Å; L887-G889 PolarHBondContact O-N 3.4Å; L887-N893 WeakPolarHBondContact O-CB 3.32Å; L887-N893 PolarHBondContact O-ND2 3.03Å
888	S	72.5	Confident	71	Confident	100 Å²	100	80.2 Å²	80.2	70%	0.699	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-19.5	174.8	50.4	0	0	0	0	113.8	S886	S886-S888 WeakPolarHBondContact CB-OG 3.19Å; S886-S888 PolarHBondContact O-N 3.1Å; S886-S888 PolarHBondContact OG-OG 2.88Å
889	G	69.5	Low	70.2	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-24.1	178.4	0	0	0	0	0	114.9	H876 A877 S886 L887 P891	H876-G889 CarbonylContact C-O 3.59Å; H876-G889 VanDerWaalsContact CA-O 3.3Å; H876-G889 WeakPolarHBondContact CA-O 3.37Å; A877-G889 PolarHBondContact N-O 2.88Å; S886-G889 PolarHBondContact O-N 3.28Å; S886-G889 PolarHBondContact OG-N 3.45Å; L887-G889 PolarHBondContact O-N 3.4Å; G889-P891 WeakPolarHBondContact O-CD 3.18Å
890	C	81.4	Confident	69.4	Low	0 Å²	0	84.6 Å²	84.6	0%	0	44%	0.444	C	S	.	.			trans	-66	120.6	-177.2	173.3	0	0	0	0	111.4	C866 L868 C871 H884 S886 L892 N893 A894	C866-C890 HydrophobicContact CB-CB 4.48Å; C866-C890 VanDerWaalsContact SG-CB 3.55Å; L868-C890 HydrophobicContact CD1-CB 4.01Å; C871-C890 HydrophobicContact CB-CB 4.38Å; C871-C890 WeakPolarHBondContact CB-SG 3.3Å; C871-C890 WeakPolarHBondContact SG-CB 3.2Å; C871-C890 CovalentContact SG-SG 2.06Å; C871-C890 PolarHBondContact SG-SG 2.9Å; H884-C890 WeakPolarHBondContact CD2-CA 3.41Å; H884-C890 PolarHBondContact CD2-N 3.16Å; H884-C890 WeakPolarHBondContact NE2-CA 3.36Å; H884-C890 VanDerWaalsContact NE2-CB 3.3Å; H884-C890 WeakPolarHBondContact NE2-CB 3.25Å; S886-C890 PolarHBondContact O-N 3.04Å; S886-C890 VanDerWaalsContact O-N 3.12Å; C890-L892 PolarHBondContact O-N 3.28Å; C890-N893 HydrophobicContact CB-CB 4.27Å; C890-N893 WeakPolarHBondContact O-CB 3.44Å; C890-N893 PolarHBondContact O-N 2.92Å; C890-A894 PolarHBondContact O-N 3.11Å
891	P	75.4	Confident	67.9	Low	35 Å²	35	85.3 Å²	85.3	23%	0.227	44%	0.441	C	S	.	.	H	α-helix	trans	-64.6	-28	-178.9	25.3	-33.3	0	0	0	112.6	G889 N893 A894 Q895	G889-P891 WeakPolarHBondContact O-CD 3.18Å; P891-N893 VanDerWaalsContact C-N 3.31Å; P891-N893 PolarHBondContact O-N 3.13Å; P891-A894 PolarHBondContact O-N 2.86Å; P891-Q895 WeakPolarHBondContact O-CG 3.46Å; P891-Q895 PolarHBondContact O-N 2.9Å; P891-Q895 VanDerWaalsContact O-N 3.17Å
892	L	72	Confident	66.6	Low	90 Å²	90	83.3 Å²	83.3	47%	0.471	44%	0.442	S	S	.	.	H	α-helix	trans	-65	-34.4	174.3	-53.6	177.4	0	0	0	112	C871 C890 Q895 S896	C871-L892 HydrophobicContact CB-CD1 4.08Å; C890-L892 PolarHBondContact O-N 3.28Å; L892-Q895 PolarHBondContact O-N 2.72Å; L892-S896 PolarHBondContact O-N 3.24Å; L892-S896 PolarHBondContact O-OG 3.46Å
893	N	73.3	Confident	65.4	Low	33 Å²	33	88.6 Å²	88.6	18%	0.176	45%	0.453	C	S	.	.	H	α-helix	trans	-67.1	-46	176.2	-158.9	31.9	0	0	0	111.4	L868 L887 C890 P891 Q895 S896 I897	L868-N893 HydrophobicContact CD1-CB 3.47Å; L868-N893 VanDerWaalsContact CD1-CB 3.47Å; L887-N893 WeakPolarHBondContact O-CB 3.32Å; L887-N893 PolarHBondContact O-ND2 3.03Å; C890-N893 HydrophobicContact CB-CB 4.27Å; C890-N893 WeakPolarHBondContact O-CB 3.44Å; C890-N893 PolarHBondContact O-N 2.92Å; P891-N893 VanDerWaalsContact C-N 3.31Å; P891-N893 PolarHBondContact O-N 3.13Å; N893-Q895 PolarHBondContact O-N 3.42Å; N893-S896 PolarHBondContact O-N 2.81Å; N893-S896 PolarHBondContact O-OG 2.87Å; N893-I897 WeakPolarHBondContact O-CD1 3.19Å; N893-I897 WeakPolarHBondContact O-CG1 3.39Å; N893-I897 PolarHBondContact O-N 2.94Å
894	A	68.1	Low	64.1	Low	34 Å²	34	93.4 Å²	93.4	28%	0.281	47%	0.471	S	S	.	.	H	α-helix	trans	-61.2	-29.4	178.2	0	0	0	0	0	112.2	A877 C890 P891 K898	A877-A894 HydrophobicContact CB-CB 3.9Å; C890-A894 PolarHBondContact O-N 3.11Å; P891-A894 PolarHBondContact O-N 2.86Å; A894-K898 WeakPolarHBondContact O-CB 3.31Å; A894-K898 WeakPolarHBondContact O-CD 3.44Å; A894-K898 VanDerWaalsContact O-CG 3.22Å; A894-K898 WeakPolarHBondContact O-CG 3.41Å; A894-K898 PolarHBondContact O-N 2.99Å
895	Q	65.5	Low	62.6	Low	127 Å²	127	99.5 Å²	99.5	59%	0.593	50%	0.499	S	S	*	.	H	α-helix	trans	-80.4	-41.3	173.9	-68.5	-178.7	21.1	0	0	113.1	P891 L892 N893 K898 K899	P891-Q895 WeakPolarHBondContact O-CG 3.46Å; P891-Q895 PolarHBondContact O-N 2.9Å; P891-Q895 VanDerWaalsContact O-N 3.17Å; L892-Q895 PolarHBondContact O-N 2.72Å; N893-Q895 PolarHBondContact O-N 3.42Å; Q895-K898 PolarHBondContact O-N 3.12Å; Q895-K899 WeakPolarHBondContact O-CB 3.28Å; Q895-K899 PolarHBondContact O-N 2.76Å
896	S	60.1	Low	61.1	Low	57 Å²	57	99.3 Å²	99.3	40%	0.399	51%	0.506	S	S	.	.	H	α-helix	trans	-65.9	-39.6	-179.7	63.9	0	0	0	0	112.4	L892 N893 K899	L892-S896 PolarHBondContact O-N 3.24Å; L892-S896 PolarHBondContact O-OG 3.46Å; N893-S896 PolarHBondContact O-N 2.81Å; N893-S896 PolarHBondContact O-OG 2.87Å; S896-K899 PolarHBondContact O-N 2.81Å
897	I	59.9	Low	60.2	Low	89 Å²	89	105 Å²	105	46%	0.456	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-45.9	173.7	-62.8	159.6	0	0	0	110.3	N893 K899 K900	N893-I897 WeakPolarHBondContact O-CD1 3.19Å; N893-I897 WeakPolarHBondContact O-CG1 3.39Å; N893-I897 PolarHBondContact O-N 2.94Å; I897-K899 PolarHBondContact O-N 3.29Å; I897-K900 PolarHBondContact O-N 2.85Å
898	K	56.1	Low	59.3	Low	182 Å²	182	105.4 Å²	105.4	79%	0.791	54%	0.535	S	S	*	.	H	α-helix	trans	-68.1	-16.2	178.6	-75.4	-179.9	179	-177.6	0	114.6	A894 Q895	A894-K898 WeakPolarHBondContact O-CB 3.31Å; A894-K898 WeakPolarHBondContact O-CD 3.44Å; A894-K898 VanDerWaalsContact O-CG 3.22Å; A894-K898 WeakPolarHBondContact O-CG 3.41Å; A894-K898 PolarHBondContact O-N 2.99Å; Q895-K898 PolarHBondContact O-N 3.12Å
899	K	53.5	Low	58.1	Low	190 Å²	190	107.3 Å²	107.3	83%	0.826	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	6.9	175.9	-98.1	-174.2	173.2	-178.6	0	114.6	Q895 S896 I897	Q895-K899 WeakPolarHBondContact O-CB 3.28Å; Q895-K899 PolarHBondContact O-N 2.76Å; S896-K899 PolarHBondContact O-N 2.81Å; I897-K899 PolarHBondContact O-N 3.29Å
900	K	51.4	Low	57.1	Low	171 Å²	171	116.2 Å²	116.2	74%	0.743	58%	0.575	S	S	*	*	S	Bend	trans	-127.1	10.3	-176	-85.6	-159.7	169.2	-166.2	0	116.7	I897	I897-K900 PolarHBondContact O-N 2.85Å
901	H	44.3	Very low	55.6	Low	121 Å²	121	123.1 Å²	123.1	56%	0.56	61%	0.611	S	S	*	*			trans	-128.4	95.7	174.3	-65.3	-62.3	0	0	0	111.6
902	S	43.2	Very low	54.4	Low	86 Å²	86	130.8 Å²	130.8	60%	0.601	64%	0.64	S	S	*	*			trans	-68	150.3	141.6	-173.4	0	0	0	0	108	E904	S902-E904 PolarHBondContact O-N 3.3Å; S902-E904 VanDerWaalsContact O-N 3.14Å
903	E	48.8	Very low	53	Low	197 Å²	197	132.8 Å²	132.8	92%	0.921	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-13.6	-170.7	-155.6	165.9	142.4	0	0	113.4
904	E	50.8	Low	51.8	Low	166 Å²	166	136.7 Å²	136.7	78%	0.776	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-25.6	-163.6	-159	159.5	-146	0	0	115	S902 M906	S902-E904 PolarHBondContact O-N 3.3Å; S902-E904 VanDerWaalsContact O-N 3.14Å; E904-M906 PolarHBondContact O-N 2.75Å
905	E	49.4	Very low	50.7	Low	135 Å²	135	139.5 Å²	139.5	63%	0.631	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-84	-6.3	-177.8	-72.1	-165.5	123.3	0	0	114.6	M907 T908	E905-M907 PolarHBondContact O-N 3.44Å; E905-T908 PolarHBondContact O-N 3.45Å; E905-T908 PolarHBondContact O-OG1 2.77Å
906	M	48.5	Very low	50.2	Low	138 Å²	138	135.1 Å²	135.1	68%	0.68	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-72.8	-8.2	-177.1	-158.3	169.4	-69.4	0	0	113.7	E904	E904-M906 PolarHBondContact O-N 2.75Å
907	M	51.8	Low	50.1	Low	171 Å²	171	138.2 Å²	138.2	84%	0.842	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-92	-23.4	174.5	-64.8	-164.6	-177.7	0	0	114.3	E905	E905-M907 PolarHBondContact O-N 3.44Å
908	T	50.3	Low	49.7	Very low	92 Å²	92	141 Å²	141	56%	0.564	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-17.6	-168.3	50.9	0	0	0	0	114.7	E905 K910	E905-T908 PolarHBondContact O-N 3.45Å; E905-T908 PolarHBondContact O-OG1 2.77Å; T908-K910 PolarHBondContact O-N 3.28Å
909	I	47.8	Very low	50	Low	139 Å²	139	136.9 Å²	136.9	71%	0.713	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-68.1	-15.8	178.1	-62.6	176.5	0	0	0	112.2	L911	I909-L911 PolarHBondContact O-N 2.81Å; I909-L911 VanDerWaalsContact O-N 3.15Å
910	K	47.8	Very low	51	Low	187 Å²	187	134.2 Å²	134.2	81%	0.813	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-74.4	2.3	-178.1	-134.6	-177	-176.8	-171.1	0	115.6	T908	T908-K910 PolarHBondContact O-N 3.28Å
911	L	50.5	Low	52.4	Low	145 Å²	145	130.9 Å²	130.9	76%	0.759	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-121.3	14.6	-173.1	-67.8	176.7	0	0	0	115.3	I909	I909-L911 PolarHBondContact O-N 2.81Å; I909-L911 VanDerWaalsContact O-N 3.15Å
912	K	49.6	Very low	54.4	Low	196 Å²	196	128.9 Å²	128.9	85%	0.852	68%	0.676	S	S	*	*			trans	-122.5	41.5	175.4	-86.6	-176.2	174.8	173.8	0	115.3
913	T	41.8	Very low	56.4	Low	132 Å²	132	129.4 Å²	129.4	81%	0.81	67%	0.671	S	S	*	*			trans	-123	59.9	154.6	50.6	0	0	0	0	109.1	S915	T913-S915 PolarHBondContact O-N 2.97Å
914	S	48.8	Very low	58.3	Low	115 Å²	115	126.5 Å²	126.5	80%	0.804	66%	0.657	S	S	*	*			trans	-83.5	72.3	-174.3	59	0	0	0	0	112.6
915	S	44.3	Very low	60.2	Low	94 Å²	94	124.5 Å²	124.5	66%	0.657	65%	0.648	S	S	*	*			trans	-110.7	105	149.8	-166.1	0	0	0	0	105.6	T913	T913-S915 PolarHBondContact O-N 2.97Å
916	G	55.9	Low	62.2	Low	35 Å²	35	122.3 Å²	122.3	36%	0.361	64%	0.64	S	S	.	*			trans	-144.4	37.4	-147.3	0	0	0	0	0	117.3	K920	G916-K920 PolarHBondContact O-NZ 3.05Å
917	V	56.7	Low	64.4	Low	121 Å²	121	120.5 Å²	120.5	73%	0.733	63%	0.633	S	S	*	*	S	Bend	trans	-138.6	17.6	174.5	-151.8	0	0	0	0	112.5
918	E	53.5	Low	66.4	Low	148 Å²	148	116.8 Å²	116.8	69%	0.692	61%	0.613	S	S	*	*	S	Bend	trans	-130.5	-44.2	175.1	-65	175.4	155.7	0	0	110.1	K920 E921 D922	E918-K920 VanDerWaalsContact C-N 3.3Å; E918-K920 PolarHBondContact O-N 3.17Å; E918-E921 VanDerWaalsContact CA-OE2 3.32Å; E918-E921 WeakPolarHBondContact CA-OE2 3.44Å; E918-E921 PolarHBondContact N-OE2 3.33Å; E918-E921 WeakPolarHBondContact O-CB 3.36Å; E918-E921 PolarHBondContact O-N 2.94Å; E918-E921 VanDerWaalsContact O-OE2 3.12Å; E918-D922 PolarHBondContact O-N 3.14Å; E918-D922 VanDerWaalsContact O-N 3.11Å
919	N	61.1	Low	68.5	Low	95 Å²	95	116.5 Å²	116.5	51%	0.508	61%	0.606	S	S	.	*	H	α-helix	trans	-70.9	-10.9	179.7	-74.1	127.8	0	0	0	116.1	D922 I923	N919-D922 PolarHBondContact ND2-OD2 3.36Å; N919-I923 WeakPolarHBondContact O-CB 3.4Å; N919-I923 VanDerWaalsContact O-CD1 3.25Å; N919-I923 WeakPolarHBondContact O-CD1 3.44Å; N919-I923 WeakPolarHBondContact O-CG1 3.37Å; N919-I923 PolarHBondContact O-N 3.33Å
920	K	74.9	Confident	70.8	Confident	135 Å²	135	114 Å²	114	59%	0.587	59%	0.593	S	S	*	*	H	α-helix	trans	-80.6	-35.2	175.5	-65.9	171.5	-177.3	155.8	0	110.5	G916 E918 I923 H924	G916-K920 PolarHBondContact O-NZ 3.05Å; E918-K920 VanDerWaalsContact C-N 3.3Å; E918-K920 PolarHBondContact O-N 3.17Å; K920-I923 PolarHBondContact O-N 3.4Å; K920-H924 WeakPolarHBondContact O-CB 3.32Å; K920-H924 PolarHBondContact O-N 3.41Å
921	E	81.4	Confident	73.1	Confident	100 Å²	100	111.7 Å²	111.7	47%	0.467	58%	0.583	S	S	.	*	H	α-helix	trans	-68	-45.3	176.6	-58.8	61.8	-144.4	0	0	108.1	E918 H924 H925	E918-E921 VanDerWaalsContact CA-OE2 3.32Å; E918-E921 WeakPolarHBondContact CA-OE2 3.44Å; E918-E921 PolarHBondContact N-OE2 3.33Å; E918-E921 WeakPolarHBondContact O-CB 3.36Å; E918-E921 PolarHBondContact O-N 2.94Å; E918-E921 VanDerWaalsContact O-OE2 3.12Å; E921-H924 PolarHBondContact O-N 3.08Å; E921-H925 WeakPolarHBondContact O-CB 3.44Å; E921-H925 PolarHBondContact O-N 3.31Å
922	D	84.6	Confident	75.3	Confident	79 Å²	79	110.1 Å²	110.1	42%	0.422	57%	0.571	S	S	.	*	H	α-helix	trans	-58.3	-47.2	167.6	-64.5	-29.2	0	0	0	112.7	E918 N919 H924 H925 L926	E918-D922 PolarHBondContact O-N 3.14Å; E918-D922 VanDerWaalsContact O-N 3.11Å; N919-D922 PolarHBondContact ND2-OD2 3.36Å; D922-H924 VanDerWaalsContact C-N 3.34Å; D922-H924 PolarHBondContact O-N 3.29Å; D922-H925 PolarHBondContact O-N 3.19Å; D922-L926 WeakPolarHBondContact O-CB 3.1Å; D922-L926 VanDerWaalsContact O-CG 3.29Å; D922-L926 WeakPolarHBondContact O-CG 3.19Å; D922-L926 PolarHBondContact O-N 2.98Å
923	I	85.9	Confident	77.5	Confident	98 Å²	98	104.9 Å²	104.9	50%	0.503	55%	0.553	S	S	.	*	H	α-helix	trans	-63.1	-41.5	179.9	-75.6	164.7	0	0	0	110.7	N919 K920 L926 D927	N919-I923 WeakPolarHBondContact O-CB 3.4Å; N919-I923 VanDerWaalsContact O-CD1 3.25Å; N919-I923 WeakPolarHBondContact O-CD1 3.44Å; N919-I923 WeakPolarHBondContact O-CG1 3.37Å; N919-I923 PolarHBondContact O-N 3.33Å; K920-I923 PolarHBondContact O-N 3.4Å; I923-L926 PolarHBondContact O-N 3.02Å; I923-D927 WeakPolarHBondContact O-CB 3.24Å; I923-D927 PolarHBondContact O-N 3.29Å
924	H	88.9	Confident	80.1	Confident	136 Å²	136	102.8 Å²	102.8	63%	0.63	54%	0.536	S	S	*	.	H	α-helix	trans	-69.2	-33.9	176.8	-170.4	-80.5	0	0	0	112.2	K920 E921 D922 H928	K920-H924 WeakPolarHBondContact O-CB 3.32Å; K920-H924 PolarHBondContact O-N 3.41Å; E921-H924 PolarHBondContact O-N 3.08Å; D922-H924 VanDerWaalsContact C-N 3.34Å; D922-H924 PolarHBondContact O-N 3.29Å; H924-H928 WeakPolarHBondContact O-CB 3.35Å; H924-H928 PolarHBondContact O-N 2.58Å
925	H	90.8	Very high	82.3	Confident	123 Å²	123	102 Å²	102	57%	0.569	52%	0.523	S	S	*	.	H	α-helix	trans	-64.8	-44.2	170.1	-175.4	-46.4	0	0	0	111.1	E921 D922 H928 E929	E921-H925 WeakPolarHBondContact O-CB 3.44Å; E921-H925 PolarHBondContact O-N 3.31Å; D922-H925 PolarHBondContact O-N 3.19Å; H925-H928 WeakPolarHBondContact O-CB 3.36Å; H925-H928 PolarHBondContact O-N 3.46Å; H925-E929 WeakPolarHBondContact O-CB 3.45Å; H925-E929 PolarHBondContact O-N 2.74Å
926	L	92.1	Very high	84.8	Confident	90 Å²	90	100.3 Å²	100.3	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-66.6	-39.7	177.8	-72.1	167.7	0	0	0	111.6	D922 I923 H928 E929 I930	D922-L926 WeakPolarHBondContact O-CB 3.1Å; D922-L926 VanDerWaalsContact O-CG 3.29Å; D922-L926 WeakPolarHBondContact O-CG 3.19Å; D922-L926 PolarHBondContact O-N 2.98Å; I923-L926 PolarHBondContact O-N 3.02Å; L926-H928 VanDerWaalsContact C-N 3.31Å; L926-H928 PolarHBondContact O-N 3.29Å; L926-E929 PolarHBondContact O-N 2.8Å; L926-I930 VanDerWaalsContact O-CB 3.27Å; L926-I930 WeakPolarHBondContact O-CB 3.44Å; L926-I930 WeakPolarHBondContact O-CD1 3.44Å; L926-I930 WeakPolarHBondContact O-CG1 3.46Å; L926-I930 PolarHBondContact O-N 2.97Å
927	D	93.3	Very high	86.7	Confident	100 Å²	100	102.3 Å²	102.3	54%	0.535	51%	0.514	S	S	.	.	H	α-helix	trans	-65.5	-34.1	173	-78.7	-22.8	0	0	0	111.7	I923 K931	I923-D927 WeakPolarHBondContact O-CB 3.24Å; I923-D927 PolarHBondContact O-N 3.29Å; D927-K931 VanDerWaalsContact O-CB 3.28Å; D927-K931 WeakPolarHBondContact O-CB 3.47Å; D927-K931 PolarHBondContact O-N 3.16Å
928	H	93.9	Very high	88.6	Confident	93 Å²	93	101.4 Å²	101.4	43%	0.431	50%	0.503	S	S	.	.	H	α-helix	trans	-67	-48.1	172	-166	-82.2	0	0	0	111.8	H924 H925 L926 I930 K931 E932	H924-H928 WeakPolarHBondContact O-CB 3.35Å; H924-H928 PolarHBondContact O-N 2.58Å; H925-H928 WeakPolarHBondContact O-CB 3.36Å; H925-H928 PolarHBondContact O-N 3.46Å; L926-H928 VanDerWaalsContact C-N 3.31Å; L926-H928 PolarHBondContact O-N 3.29Å; H928-I930 PolarHBondContact O-N 3.04Å; H928-K931 CarbonylContact O-C 3.15Å; H928-K931 WeakPolarHBondContact O-CA 3.49Å; H928-K931 WeakPolarHBondContact O-CB 3.38Å; H928-K931 PolarHBondContact O-N 2.89Å; H928-K931 VanDerWaalsContact O-N 3.11Å; H928-E932 IonicContact CE1-OE1 3.41Å; H928-E932 PolarHBondContact CE1-OE1 3.23Å; H928-E932 IonicContact CE1-OE2 3.25Å; H928-E932 PolarHBondContact CE1-OE2 3.48Å; H928-E932 VanDerWaalsContact CE1-OE2 3.25Å; H928-E932 VanDerWaalsContact ND1-CD 3.31Å; H928-E932 IonicContact ND1-OE1 3.9Å; H928-E932 IonicContact ND1-OE2 2.89Å; H928-E932 PolarHBondContact ND1-OE2 3.41Å; H928-E932 PolarHBondContact O-N 3.18Å
929	E	95.4	Very high	90.6	Very high	86 Å²	86	100.2 Å²	100.2	40%	0.402	50%	0.495	S	S	.	.	H	α-helix	trans	-62.2	-43.2	177.7	-172.6	-176.8	165.1	0	0	111.1	H925 L926 K931 E932 L933	H925-E929 WeakPolarHBondContact O-CB 3.45Å; H925-E929 PolarHBondContact O-N 2.74Å; L926-E929 PolarHBondContact O-N 2.8Å; E929-K931 VanDerWaalsContact C-N 3.3Å; E929-K931 PolarHBondContact O-N 3.08Å; E929-E932 PolarHBondContact O-N 3.04Å; E929-L933 HydrophobicContact CG-CD1 4.03Å; E929-L933 HydrophobicContact CG-CG 4.42Å; E929-L933 VanDerWaalsContact O-CB 3.3Å; E929-L933 WeakPolarHBondContact O-CB 3.47Å; E929-L933 VanDerWaalsContact O-CG 3.23Å; E929-L933 WeakPolarHBondContact O-CG 3.24Å; E929-L933 PolarHBondContact O-N 2.92Å
930	I	95.1	Very high	92.3	Very high	87 Å²	87	99.9 Å²	99.9	45%	0.446	49%	0.493	S	S	.	.	H	α-helix	trans	-60.5	-39.8	173	-72.5	164.2	0	0	0	110.8	L926 H928 N934	L926-I930 VanDerWaalsContact O-CB 3.27Å; L926-I930 WeakPolarHBondContact O-CB 3.44Å; L926-I930 WeakPolarHBondContact O-CD1 3.44Å; L926-I930 WeakPolarHBondContact O-CG1 3.46Å; L926-I930 PolarHBondContact O-N 2.97Å; H928-I930 PolarHBondContact O-N 3.04Å; I930-N934 VanDerWaalsContact O-CB 3.26Å; I930-N934 WeakPolarHBondContact O-CB 3.37Å; I930-N934 PolarHBondContact O-N 3.2Å; I930-N934 PolarHBondContact O-ND2 3.4Å; I930-N934 VanDerWaalsContact O-ND2 3.1Å
931	K	96.4	Very high	93.2	Very high	137 Å²	137	98.6 Å²	98.6	60%	0.596	49%	0.489	S	S	*	.	H	α-helix	trans	-67.1	-42	176	-174.3	-179	179.7	-175.6	0	112	D927 H928 E929 N934 N935	D927-K931 VanDerWaalsContact O-CB 3.28Å; D927-K931 WeakPolarHBondContact O-CB 3.47Å; D927-K931 PolarHBondContact O-N 3.16Å; H928-K931 CarbonylContact O-C 3.15Å; H928-K931 WeakPolarHBondContact O-CA 3.49Å; H928-K931 WeakPolarHBondContact O-CB 3.38Å; H928-K931 PolarHBondContact O-N 2.89Å; H928-K931 VanDerWaalsContact O-N 3.11Å; E929-K931 VanDerWaalsContact C-N 3.3Å; E929-K931 PolarHBondContact O-N 3.08Å; K931-N934 PolarHBondContact O-N 2.79Å; K931-N935 WeakPolarHBondContact O-CB 3.29Å; K931-N935 PolarHBondContact O-N 3.19Å; K931-N935 PolarHBondContact O-ND2 3.2Å; K931-N935 PolarHBondContact O-OD1 3.26Å
932	E	96.2	Very high	93.9	Very high	112 Å²	112	99.5 Å²	99.5	52%	0.523	49%	0.493	S	S	.	.	H	α-helix	trans	-68.3	-41.2	176.2	-72.4	-177.8	124.8	0	0	112.3	H928 E929 N935 S936	H928-E932 IonicContact CE1-OE1 3.41Å; H928-E932 PolarHBondContact CE1-OE1 3.23Å; H928-E932 IonicContact CE1-OE2 3.25Å; H928-E932 PolarHBondContact CE1-OE2 3.48Å; H928-E932 VanDerWaalsContact CE1-OE2 3.25Å; H928-E932 VanDerWaalsContact ND1-CD 3.31Å; H928-E932 IonicContact ND1-OE1 3.9Å; H928-E932 IonicContact ND1-OE2 2.89Å; H928-E932 PolarHBondContact ND1-OE2 3.41Å; H928-E932 PolarHBondContact O-N 3.18Å; E929-E932 PolarHBondContact O-N 3.04Å; E932-N935 PolarHBondContact O-N 3.05Å; E932-S936 VanDerWaalsContact O-CB 3.31Å; E932-S936 WeakPolarHBondContact O-CB 3.22Å; E932-S936 PolarHBondContact O-N 2.82Å
933	L	96.3	Very high	94.4	Very high	87 Å²	87	99.7 Å²	99.7	46%	0.455	49%	0.494	S	S	.	.	H	α-helix	trans	-63.4	-41.2	172.9	-72.3	171.1	0	0	0	111.6	E929 S936 N937	E929-L933 HydrophobicContact CG-CD1 4.03Å; E929-L933 HydrophobicContact CG-CG 4.42Å; E929-L933 VanDerWaalsContact O-CB 3.3Å; E929-L933 WeakPolarHBondContact O-CB 3.47Å; E929-L933 VanDerWaalsContact O-CG 3.23Å; E929-L933 WeakPolarHBondContact O-CG 3.24Å; E929-L933 PolarHBondContact O-N 2.92Å; L933-S936 PolarHBondContact O-N 3.39Å; L933-N937 WeakPolarHBondContact O-CB 3.29Å; L933-N937 PolarHBondContact O-N 3.29Å; L933-N937 PolarHBondContact O-ND2 3.46Å
934	N	95.8	Very high	94.7	Very high	87 Å²	87	99.4 Å²	99.4	47%	0.465	49%	0.492	S	S	.	.	H	α-helix	trans	-65.8	-42.5	174.5	-75.5	-28.9	0	0	0	112	I930 K931 S936 N937 M938	I930-N934 VanDerWaalsContact O-CB 3.26Å; I930-N934 WeakPolarHBondContact O-CB 3.37Å; I930-N934 PolarHBondContact O-N 3.2Å; I930-N934 PolarHBondContact O-ND2 3.4Å; I930-N934 VanDerWaalsContact O-ND2 3.1Å; K931-N934 PolarHBondContact O-N 2.79Å; N934-S936 VanDerWaalsContact C-N 3.3Å; N934-S936 PolarHBondContact O-N 3.26Å; N934-N937 PolarHBondContact O-N 3.36Å; N934-M938 WeakPolarHBondContact O-CB 3.48Å; N934-M938 WeakPolarHBondContact O-CG 3.32Å; N934-M938 PolarHBondContact O-N 2.89Å
935	N	96.3	Very high	94.8	Very high	99 Å²	99	99 Å²	99	53%	0.529	49%	0.491	S	S	.	.	H	α-helix	trans	-62.2	-38.7	173.9	-68.5	-18.1	0	0	0	111.7	K931 E932 K939	K931-N935 WeakPolarHBondContact O-CB 3.29Å; K931-N935 PolarHBondContact O-N 3.19Å; K931-N935 PolarHBondContact O-ND2 3.2Å; K931-N935 PolarHBondContact O-OD1 3.26Å; E932-N935 PolarHBondContact O-N 3.05Å; N935-K939 WeakPolarHBondContact O-CB 3.24Å; N935-K939 PolarHBondContact O-N 2.88Å; N935-K939 VanDerWaalsContact O-N 3.08Å
936	S	96.4	Very high	95	Very high	59 Å²	59	98.5 Å²	98.5	41%	0.413	49%	0.489	S	S	.	.	H	α-helix	trans	-67	-43.4	175.7	-167.1	0	0	0	0	111.7	E932 L933 N934 K939 I940	E932-S936 VanDerWaalsContact O-CB 3.31Å; E932-S936 WeakPolarHBondContact O-CB 3.22Å; E932-S936 PolarHBondContact O-N 2.82Å; L933-S936 PolarHBondContact O-N 3.39Å; N934-S936 VanDerWaalsContact C-N 3.3Å; N934-S936 PolarHBondContact O-N 3.26Å; S936-K939 PolarHBondContact O-N 2.9Å; S936-I940 WeakPolarHBondContact O-CB 3.3Å; S936-I940 VanDerWaalsContact O-CG1 3.26Å; S936-I940 WeakPolarHBondContact O-CG1 3.31Å; S936-I940 PolarHBondContact O-N 2.75Å
937	N	95.3	Very high	95.1	Very high	76 Å²	76	99.4 Å²	99.4	41%	0.406	49%	0.494	S	S	.	.	H	α-helix	trans	-63	-48.8	175.7	-70.8	-22.8	0	0	0	111.5	L933 N934 K939 I940 E941	L933-N937 WeakPolarHBondContact O-CB 3.29Å; L933-N937 PolarHBondContact O-N 3.29Å; L933-N937 PolarHBondContact O-ND2 3.46Å; N934-N937 PolarHBondContact O-N 3.36Å; N937-K939 VanDerWaalsContact C-N 3.26Å; N937-K939 PolarHBondContact O-N 2.8Å; N937-I940 CarbonylContact O-C 3.57Å; N937-I940 PolarHBondContact O-N 2.84Å; N937-E941 WeakPolarHBondContact O-CG 3.43Å; N937-E941 PolarHBondContact O-N 3.48Å
938	M	96.4	Very high	94.9	Very high	102 Å²	102	99.5 Å²	99.5	50%	0.502	49%	0.491	S	S	.	.	H	α-helix	trans	-53.4	-45.1	174.3	-76.7	-58.5	-44.1	0	0	111.3	N934 E941 E942	N934-M938 WeakPolarHBondContact O-CB 3.48Å; N934-M938 WeakPolarHBondContact O-CG 3.32Å; N934-M938 PolarHBondContact O-N 2.89Å; M938-E941 PolarHBondContact O-N 2.9Å; M938-E942 WeakPolarHBondContact O-CG 3.35Å; M938-E942 PolarHBondContact O-N 2.88Å
939	K	96.5	Very high	94.9	Very high	123 Å²	123	99 Å²	99	54%	0.535	50%	0.495	S	S	.	.	H	α-helix	trans	-66.5	-38.8	176.9	-176.7	176.9	176	-175.6	0	113.1	N935 S936 N937 E941 E942 D943	N935-K939 WeakPolarHBondContact O-CB 3.24Å; N935-K939 PolarHBondContact O-N 2.88Å; N935-K939 VanDerWaalsContact O-N 3.08Å; S936-K939 PolarHBondContact O-N 2.9Å; N937-K939 VanDerWaalsContact C-N 3.26Å; N937-K939 PolarHBondContact O-N 2.8Å; K939-E941 VanDerWaalsContact C-N 3.29Å; K939-E942 PolarHBondContact O-N 3.29Å; K939-D943 WeakPolarHBondContact O-CB 3.46Å; K939-D943 PolarHBondContact O-N 3.26Å
940	I	95.8	Very high	94.8	Very high	89 Å²	89	100.4 Å²	100.4	46%	0.456	50%	0.501	S	S	.	.	H	α-helix	trans	-66.6	-34.1	175.5	-71	163.5	0	0	0	110.5	S936 N937 M944	S936-I940 WeakPolarHBondContact O-CB 3.3Å; S936-I940 VanDerWaalsContact O-CG1 3.26Å; S936-I940 WeakPolarHBondContact O-CG1 3.31Å; S936-I940 PolarHBondContact O-N 2.75Å; N937-I940 CarbonylContact O-C 3.57Å; N937-I940 PolarHBondContact O-N 2.84Å; I940-M944 HydrophobicContact CG2-CE 4.46Å; I940-M944 WeakPolarHBondContact O-CB 3.32Å; I940-M944 PolarHBondContact O-N 3.47Å
941	E	95.3	Very high	94.6	Very high	108 Å²	108	103.2 Å²	103.2	51%	0.505	51%	0.513	S	S	.	.	H	α-helix	trans	-68.4	-42.2	172.5	-71.1	173.5	-163.6	0	0	111.5	N937 M938 K939 M944 M945	N937-E941 WeakPolarHBondContact O-CG 3.43Å; N937-E941 PolarHBondContact O-N 3.48Å; M938-E941 PolarHBondContact O-N 2.9Å; K939-E941 VanDerWaalsContact C-N 3.29Å; E941-M944 PolarHBondContact O-N 3.35Å; E941-M945 WeakPolarHBondContact O-CG 3.24Å; E941-M945 PolarHBondContact O-N 2.79Å
942	E	96.1	Very high	94.5	Very high	119 Å²	119	100.6 Å²	100.6	56%	0.556	50%	0.504	S	S	*	.	H	α-helix	trans	-60.6	-52.1	171.3	-73.6	171.8	179.6	0	0	112.3	M938 K939 M944 M945 H946	M938-E942 WeakPolarHBondContact O-CG 3.35Å; M938-E942 PolarHBondContact O-N 2.88Å; K939-E942 PolarHBondContact O-N 3.29Å; E942-M944 VanDerWaalsContact C-N 3.27Å; E942-M944 PolarHBondContact O-N 2.84Å; E942-M945 PolarHBondContact O-N 2.81Å; E942-H946 WeakPolarHBondContact O-CB 3.37Å; E942-H946 PolarHBondContact O-N 2.89Å
943	D	94.3	Very high	94.4	Very high	83 Å²	83	98.1 Å²	98.1	44%	0.444	50%	0.499	S	S	.	.	H	α-helix	trans	-60.6	-37	177.3	-80.6	-34	0	0	0	110.6	K939 L947	K939-D943 WeakPolarHBondContact O-CB 3.46Å; K939-D943 PolarHBondContact O-N 3.26Å; D943-L947 WeakPolarHBondContact O-CB 3.2Å; D943-L947 VanDerWaalsContact O-CG 3.24Å; D943-L947 WeakPolarHBondContact O-CG 3.47Å; D943-L947 PolarHBondContact O-N 3.33Å
944	M	91.8	Very high	94.4	Very high	92 Å²	92	97.8 Å²	97.8	45%	0.453	50%	0.504	S	S	.	.	H	α-helix	trans	-68.6	-44.8	175.9	-171.2	-170.6	-40.5	0	0	112.3	I940 E941 E942 L947 Q948	I940-M944 HydrophobicContact CG2-CE 4.46Å; I940-M944 WeakPolarHBondContact O-CB 3.32Å; I940-M944 PolarHBondContact O-N 3.47Å; E941-M944 PolarHBondContact O-N 3.35Å; E942-M944 VanDerWaalsContact C-N 3.27Å; E942-M944 PolarHBondContact O-N 2.84Å; M944-L947 PolarHBondContact O-N 3.46Å; M944-Q948 WeakPolarHBondContact O-CB 3.07Å; M944-Q948 VanDerWaalsContact O-CG 3.32Å; M944-Q948 WeakPolarHBondContact O-CG 3.35Å; M944-Q948 PolarHBondContact O-N 2.81Å
945	M	91.8	Very high	94.4	Very high	126 Å²	126	98.8 Å²	98.8	62%	0.621	51%	0.507	S	S	*	.	H	α-helix	trans	-67.2	-36.3	175.8	-72.2	-151.7	-58	0	0	111.8	E941 E942 Q948 T949	E941-M945 WeakPolarHBondContact O-CG 3.24Å; E941-M945 PolarHBondContact O-N 2.79Å; E942-M945 PolarHBondContact O-N 2.81Å; M945-Q948 PolarHBondContact O-N 2.95Å; M945-T949 VanDerWaalsContact O-CB 3.29Å; M945-T949 WeakPolarHBondContact O-CB 3.3Å; M945-T949 PolarHBondContact O-N 3.35Å; M945-T949 PolarHBondContact O-OG1 3.42Å
946	H	93.8	Very high	94.4	Very high	113 Å²	113	98.6 Å²	98.6	52%	0.523	50%	0.503	S	S	.	.	H	α-helix	trans	-63.4	-46.4	172.8	179	-79.3	0	0	0	111.1	E942 T949 Q950	E942-H946 WeakPolarHBondContact O-CB 3.37Å; E942-H946 PolarHBondContact O-N 2.89Å; H946-T949 PolarHBondContact O-N 2.7Å; H946-Q950 WeakPolarHBondContact O-CB 3.38Å; H946-Q950 PolarHBondContact O-N 2.84Å
947	L	94.3	Very high	94.3	Very high	109 Å²	109	99.5 Å²	99.5	57%	0.571	51%	0.508	S	S	*	.	H	α-helix	trans	-63.5	-41	176.8	-75.7	169.2	0	0	0	112.5	D943 M944 Q951	D943-L947 WeakPolarHBondContact O-CB 3.2Å; D943-L947 VanDerWaalsContact O-CG 3.24Å; D943-L947 WeakPolarHBondContact O-CG 3.47Å; D943-L947 PolarHBondContact O-N 3.33Å; M944-L947 PolarHBondContact O-N 3.46Å; L947-Q951 VanDerWaalsContact O-CB 3.31Å; L947-Q951 WeakPolarHBondContact O-CB 3.28Å; L947-Q951 PolarHBondContact O-N 3.44Å
948	Q	90.3	Very high	94.4	Very high	103 Å²	103	100.2 Å²	100.2	48%	0.481	51%	0.512	S	S	.	.	H	α-helix	trans	-64	-47.9	174.9	-74.2	175.2	11.8	0	0	111.4	M944 M945 Q950 Q951 I952	M944-Q948 WeakPolarHBondContact O-CB 3.07Å; M944-Q948 VanDerWaalsContact O-CG 3.32Å; M944-Q948 WeakPolarHBondContact O-CG 3.35Å; M944-Q948 PolarHBondContact O-N 2.81Å; M945-Q948 PolarHBondContact O-N 2.95Å; Q948-Q950 PolarHBondContact O-N 2.84Å; Q948-Q951 PolarHBondContact O-N 3.04Å; Q948-I952 WeakPolarHBondContact O-CB 3.21Å; Q948-I952 WeakPolarHBondContact O-CD1 3.44Å; Q948-I952 VanDerWaalsContact O-CG1 3.24Å; Q948-I952 WeakPolarHBondContact O-CG1 3.45Å; Q948-I952 PolarHBondContact O-N 3.29Å
949	T	93.3	Very high	94.4	Very high	83 Å²	83	99.4 Å²	99.4	51%	0.509	51%	0.51	S	S	.	.	H	α-helix	trans	-60.5	-45.4	176.8	-54.4	0	0	0	0	111.1	M945 H946 Q951 I952 S953	M945-T949 VanDerWaalsContact O-CB 3.29Å; M945-T949 WeakPolarHBondContact O-CB 3.3Å; M945-T949 PolarHBondContact O-N 3.35Å; M945-T949 PolarHBondContact O-OG1 3.42Å; H946-T949 PolarHBondContact O-N 2.7Å; T949-Q951 PolarHBondContact O-N 3.04Å; T949-I952 PolarHBondContact O-N 2.98Å; T949-S953 PolarHBondContact O-N 3.31Å; T949-S953 PolarHBondContact O-OG 2.79Å
950	Q	94	Very high	94.5	Very high	115 Å²	115	99.6 Å²	99.6	54%	0.537	51%	0.511	S	S	.	.	H	α-helix	trans	-64.4	-38.2	177.4	-178.4	169.5	58.6	0	0	112.3	H946 Q948 S954	H946-Q950 WeakPolarHBondContact O-CB 3.38Å; H946-Q950 PolarHBondContact O-N 2.84Å; Q948-Q950 PolarHBondContact O-N 2.84Å; Q950-S954 WeakPolarHBondContact O-CB 3.14Å; Q950-S954 PolarHBondContact O-N 3.32Å
951	Q	91.6	Very high	94.5	Very high	146 Å²	146	98.1 Å²	98.1	68%	0.682	51%	0.505	S	S	*	.	H	α-helix	trans	-67	-42.7	174.7	-175.7	177.3	2.7	0	0	111.5	L947 Q948 T949 M955	L947-Q951 VanDerWaalsContact O-CB 3.31Å; L947-Q951 WeakPolarHBondContact O-CB 3.28Å; L947-Q951 PolarHBondContact O-N 3.44Å; Q948-Q951 PolarHBondContact O-N 3.04Å; T949-Q951 PolarHBondContact O-N 3.04Å; Q951-M955 WeakPolarHBondContact O-CB 3.38Å; Q951-M955 PolarHBondContact O-N 2.9Å
952	I	93.5	Very high	94.6	Very high	82 Å²	82	96.1 Å²	96.1	42%	0.421	50%	0.498	S	S	.	.	H	α-helix	trans	-61.6	-56.2	176.5	-70.9	163.8	0	0	0	109.7	Q948 T949 S954 M955 E956	Q948-I952 WeakPolarHBondContact O-CB 3.21Å; Q948-I952 WeakPolarHBondContact O-CD1 3.44Å; Q948-I952 VanDerWaalsContact O-CG1 3.24Å; Q948-I952 WeakPolarHBondContact O-CG1 3.45Å; Q948-I952 PolarHBondContact O-N 3.29Å; T949-I952 PolarHBondContact O-N 2.98Å; I952-S954 VanDerWaalsContact C-N 3.3Å; I952-S954 PolarHBondContact O-N 2.93Å; I952-M955 CarbonylContact O-C 3.46Å; I952-M955 WeakPolarHBondContact O-CA 3.25Å; I952-M955 WeakPolarHBondContact O-CB 3.1Å; I952-M955 PolarHBondContact O-N 2.77Å; I952-E956 HydrophobicContact CG2-CG 4.2Å; I952-E956 WeakPolarHBondContact CG2-OE1 3.39Å; I952-E956 WeakPolarHBondContact O-CG 3.33Å; I952-E956 PolarHBondContact O-N 2.85Å
953	S	94.6	Very high	94.7	Very high	60 Å²	60	96.3 Å²	96.3	42%	0.42	50%	0.499	S	S	.	.	H	α-helix	trans	-67.3	-26.2	-178.6	-59.3	0	0	0	0	114.3	T949 E956 C957	T949-S953 PolarHBondContact O-N 3.31Å; T949-S953 PolarHBondContact O-OG 2.79Å; S953-E956 VanDerWaalsContact CA-OE2 3.32Å; S953-E956 WeakPolarHBondContact CA-OE2 3.18Å; S953-E956 PolarHBondContact OG-OE2 3.47Å; S953-C957 WeakPolarHBondContact O-CB 3.37Å; S953-C957 PolarHBondContact O-N 2.87Å
954	S	95.8	Very high	94.8	Very high	79 Å²	79	98.4 Å²	98.4	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-68.4	-38.3	168.9	-173	0	0	0	0	112	Q950 I952 N958	Q950-S954 WeakPolarHBondContact O-CB 3.14Å; Q950-S954 PolarHBondContact O-N 3.32Å; I952-S954 VanDerWaalsContact C-N 3.3Å; I952-S954 PolarHBondContact O-N 2.93Å; S954-N958 WeakPolarHBondContact O-CB 3.23Å; S954-N958 PolarHBondContact O-N 2.83Å
955	M	96	Very high	95	Very high	109 Å²	109	99.6 Å²	99.6	54%	0.537	51%	0.51	S	S	.	.	H	α-helix	trans	-72.4	-40.8	175.6	-173.5	176	67.2	0	0	111.9	Q951 I952 C957 N958 L959	Q951-M955 WeakPolarHBondContact O-CB 3.38Å; Q951-M955 PolarHBondContact O-N 2.9Å; I952-M955 CarbonylContact O-C 3.46Å; I952-M955 WeakPolarHBondContact O-CA 3.25Å; I952-M955 WeakPolarHBondContact O-CB 3.1Å; I952-M955 PolarHBondContact O-N 2.77Å; M955-C957 VanDerWaalsContact C-N 3.35Å; M955-N958 PolarHBondContact O-N 3.38Å; M955-L959 HydrophobicContact CG-CD1 4.29Å; M955-L959 WeakPolarHBondContact O-CB 3.26Å; M955-L959 VanDerWaalsContact O-CG 3.3Å; M955-L959 WeakPolarHBondContact O-CG 3.38Å; M955-L959 PolarHBondContact O-N 2.71Å
956	E	95.6	Very high	95.3	Very high	95 Å²	95	97.4 Å²	97.4	44%	0.444	50%	0.501	S	S	.	.	H	α-helix	trans	-61.1	-41.9	173	-68.5	168.2	158.7	0	0	111.6	I952 S953 L959 K960	I952-E956 HydrophobicContact CG2-CG 4.2Å; I952-E956 WeakPolarHBondContact CG2-OE1 3.39Å; I952-E956 WeakPolarHBondContact O-CG 3.33Å; I952-E956 PolarHBondContact O-N 2.85Å; S953-E956 VanDerWaalsContact CA-OE2 3.32Å; S953-E956 WeakPolarHBondContact CA-OE2 3.18Å; S953-E956 PolarHBondContact OG-OE2 3.47Å; E956-L959 PolarHBondContact O-N 2.87Å; E956-K960 WeakPolarHBondContact O-CG 3.29Å; E956-K960 PolarHBondContact O-N 3.36Å
957	C	95.3	Very high	95.4	Very high	77 Å²	77	98.2 Å²	98.2	52%	0.52	50%	0.503	S	S	.	.	H	α-helix	trans	-61.8	-47.3	173.8	-173.7	0	0	0	0	111.3	S953 M955 L959 K960 T961	S953-C957 WeakPolarHBondContact O-CB 3.37Å; S953-C957 PolarHBondContact O-N 2.87Å; M955-C957 VanDerWaalsContact C-N 3.35Å; C957-L959 PolarHBondContact O-N 3.41Å; C957-K960 PolarHBondContact O-N 2.93Å; C957-T961 PolarHBondContact O-N 3.06Å; C957-T961 PolarHBondContact O-OG1 2.94Å
958	N	96.9	Very high	95.6	Very high	92 Å²	92	98.7 Å²	98.7	49%	0.492	50%	0.504	S	S	.	.	H	α-helix	trans	-64.2	-38.3	178.1	-177.3	-116.7	0	0	0	113	S954 M955 T961 I962	S954-N958 WeakPolarHBondContact O-CB 3.23Å; S954-N958 PolarHBondContact O-N 2.83Å; M955-N958 PolarHBondContact O-N 3.38Å; N958-T961 PolarHBondContact O-N 3.28Å; N958-I962 WeakPolarHBondContact O-CG1 3.2Å; N958-I962 PolarHBondContact O-N 3.38Å
959	L	97.2	Very high	95.9	Very high	85 Å²	85	98 Å²	98	45%	0.445	50%	0.503	S	S	.	.	H	α-helix	trans	-63.1	-44	174.1	-74.4	169.1	0	0	0	111.5	M955 E956 C957 T961 I962 E963	M955-L959 HydrophobicContact CG-CD1 4.29Å; M955-L959 WeakPolarHBondContact O-CB 3.26Å; M955-L959 VanDerWaalsContact O-CG 3.3Å; M955-L959 WeakPolarHBondContact O-CG 3.38Å; M955-L959 PolarHBondContact O-N 2.71Å; E956-L959 PolarHBondContact O-N 2.87Å; C957-L959 PolarHBondContact O-N 3.41Å; L959-T961 PolarHBondContact O-N 2.89Å; L959-I962 CarbonylContact O-C 3.55Å; L959-I962 PolarHBondContact O-N 3.26Å; L959-I962 VanDerWaalsContact O-N 3.1Å; L959-E963 WeakPolarHBondContact O-CG 3.28Å; L959-E963 PolarHBondContact O-N 3.4Å
960	K	96.8	Very high	96	Very high	127 Å²	127	100 Å²	100	55%	0.552	51%	0.506	S	S	*	.	H	α-helix	trans	-60.2	-42.3	174.8	-73.5	174.1	180	-177.6	0	112.5	E956 C957 I962 E963 E964	E956-K960 WeakPolarHBondContact O-CG 3.29Å; E956-K960 PolarHBondContact O-N 3.36Å; C957-K960 PolarHBondContact O-N 2.93Å; K960-I962 VanDerWaalsContact C-N 3.3Å; K960-I962 PolarHBondContact O-N 2.85Å; K960-E963 PolarHBondContact O-N 2.84Å; K960-E964 WeakPolarHBondContact O-CB 3.24Å; K960-E964 WeakPolarHBondContact O-CG 3.49Å; K960-E964 PolarHBondContact O-N 2.84Å
961	T	97.6	Very high	96.1	Very high	57 Å²	57	99.6 Å²	99.6	35%	0.35	50%	0.504	S	S	.	.	H	α-helix	trans	-60.5	-40	173.6	-51.8	0	0	0	0	111.8	C957 N958 L959 E964 E965	C957-T961 PolarHBondContact O-N 3.06Å; C957-T961 PolarHBondContact O-OG1 2.94Å; N958-T961 PolarHBondContact O-N 3.28Å; L959-T961 PolarHBondContact O-N 2.89Å; T961-E964 PolarHBondContact O-N 2.78Å; T961-E965 WeakPolarHBondContact O-CB 3.37Å; T961-E965 WeakPolarHBondContact O-CG 3.49Å; T961-E965 PolarHBondContact O-N 2.82Å
962	I	97.3	Very high	96.3	Very high	67 Å²	67	98.3 Å²	98.3	34%	0.344	50%	0.498	S	S	.	.	H	α-helix	trans	-68.8	-36.3	176.5	-68.7	164.4	0	0	0	111.4	N958 L959 K960 N966	N958-I962 WeakPolarHBondContact O-CG1 3.2Å; N958-I962 PolarHBondContact O-N 3.38Å; L959-I962 CarbonylContact O-C 3.55Å; L959-I962 PolarHBondContact O-N 3.26Å; L959-I962 VanDerWaalsContact O-N 3.1Å; K960-I962 VanDerWaalsContact C-N 3.3Å; K960-I962 PolarHBondContact O-N 2.85Å; I962-N966 WeakPolarHBondContact CG2-ND2 3.42Å; I962-N966 VanDerWaalsContact O-CB 3.3Å; I962-N966 WeakPolarHBondContact O-CB 3.38Å; I962-N966 PolarHBondContact O-N 3.41Å; I962-N966 PolarHBondContact O-ND2 3.27Å
963	E	96.7	Very high	96.4	Very high	123 Å²	123	98.4 Å²	98.4	58%	0.575	50%	0.499	S	S	*	.	H	α-helix	trans	-65.4	-41.1	173.6	-71.8	166.6	178.6	0	0	111.6	L959 K960 K967	L959-E963 WeakPolarHBondContact O-CG 3.28Å; L959-E963 PolarHBondContact O-N 3.4Å; K960-E963 PolarHBondContact O-N 2.84Å; E963-K967 WeakPolarHBondContact O-CB 3.4Å; E963-K967 PolarHBondContact O-N 3.34Å
964	E	96.8	Very high	96.5	Very high	127 Å²	127	99.9 Å²	99.9	59%	0.593	50%	0.503	S	S	*	.	H	α-helix	trans	-65.4	-46.3	173.5	-72.4	167.8	-173.4	0	0	112	K960 T961 K967 M968	K960-E964 WeakPolarHBondContact O-CB 3.24Å; K960-E964 WeakPolarHBondContact O-CG 3.49Å; K960-E964 PolarHBondContact O-N 2.84Å; T961-E964 PolarHBondContact O-N 2.78Å; E964-K967 PolarHBondContact O-N 3.46Å; E964-M968 WeakPolarHBondContact O-CG 3.13Å; E964-M968 PolarHBondContact O-N 2.85Å
965	E	97	Very high	96.5	Very high	116 Å²	116	97.7 Å²	97.7	54%	0.542	49%	0.492	S	S	.	.	H	α-helix	trans	-60.9	-44.1	175	-76.7	-179.7	175.2	0	0	111.8	T961 K967 M968 I969	T961-E965 WeakPolarHBondContact O-CB 3.37Å; T961-E965 WeakPolarHBondContact O-CG 3.49Å; T961-E965 PolarHBondContact O-N 2.82Å; E965-K967 PolarHBondContact O-N 3.44Å; E965-M968 PolarHBondContact O-N 3.25Å; E965-I969 VanDerWaalsContact O-CG1 3.32Å; E965-I969 WeakPolarHBondContact O-CG1 3.26Å; E965-I969 PolarHBondContact O-N 2.89Å
966	N	96.2	Very high	96.4	Very high	81 Å²	81	97.2 Å²	97.2	43%	0.433	49%	0.492	S	S	.	.	H	α-helix	trans	-61.9	-42.7	175.2	-76.7	-42.1	0	0	0	111.7	I962 M968 I969 E970	I962-N966 WeakPolarHBondContact CG2-ND2 3.42Å; I962-N966 VanDerWaalsContact O-CB 3.3Å; I962-N966 WeakPolarHBondContact O-CB 3.38Å; I962-N966 PolarHBondContact O-N 3.41Å; I962-N966 PolarHBondContact O-ND2 3.27Å; N966-M968 VanDerWaalsContact C-N 3.32Å; N966-M968 PolarHBondContact O-N 3.29Å; N966-I969 CarbonylContact O-C 3.22Å; N966-I969 WeakPolarHBondContact O-CB 3.4Å; N966-I969 PolarHBondContact O-N 2.84Å; N966-I969 VanDerWaalsContact O-N 3.14Å; N966-E970 WeakPolarHBondContact O-CG 3.39Å; N966-E970 PolarHBondContact O-N 3.48Å
967	K	97.8	Very high	96.3	Very high	129 Å²	129	97.7 Å²	97.7	56%	0.561	50%	0.497	S	S	*	.	H	α-helix	trans	-61.1	-39.3	175.4	-176.4	178.3	178.8	179.9	0	112.1	E963 E964 E965 E970 Q971	E963-K967 WeakPolarHBondContact O-CB 3.4Å; E963-K967 PolarHBondContact O-N 3.34Å; E964-K967 PolarHBondContact O-N 3.46Å; E965-K967 PolarHBondContact O-N 3.44Å; K967-E970 PolarHBondContact O-N 2.83Å; K967-Q971 WeakPolarHBondContact O-CG 3.45Å; K967-Q971 PolarHBondContact O-N 3.3Å
968	M	97.2	Very high	96.2	Very high	119 Å²	119	101.3 Å²	101.3	59%	0.586	50%	0.503	S	S	*	.	H	α-helix	trans	-66.2	-38.8	173.8	-68.3	-57.1	-57.6	0	0	112.1	E964 E965 N966 Q971 H972	E964-M968 WeakPolarHBondContact O-CG 3.13Å; E964-M968 PolarHBondContact O-N 2.85Å; E965-M968 PolarHBondContact O-N 3.25Å; N966-M968 VanDerWaalsContact C-N 3.32Å; N966-M968 PolarHBondContact O-N 3.29Å; M968-Q971 PolarHBondContact O-N 3.06Å; M968-H972 WeakPolarHBondContact O-CB 3.4Å; M968-H972 PolarHBondContact O-N 3.4Å
969	I	96.6	Very high	96	Very high	90 Å²	90	101 Å²	101	46%	0.462	50%	0.499	S	S	.	.	H	α-helix	trans	-65.3	-41.7	174.4	-68.9	163.3	0	0	0	110.9	E965 N966 H972 N973	E965-I969 VanDerWaalsContact O-CG1 3.32Å; E965-I969 WeakPolarHBondContact O-CG1 3.26Å; E965-I969 PolarHBondContact O-N 2.89Å; N966-I969 CarbonylContact O-C 3.22Å; N966-I969 WeakPolarHBondContact O-CB 3.4Å; N966-I969 PolarHBondContact O-N 2.84Å; N966-I969 VanDerWaalsContact O-N 3.14Å; I969-H972 PolarHBondContact O-N 3.31Å; I969-N973 WeakPolarHBondContact O-CB 3.23Å; I969-N973 PolarHBondContact O-N 3.34Å; I969-N973 PolarHBondContact O-ND2 2.87Å
970	E	95.6	Very high	95.6	Very high	123 Å²	123	102.3 Å²	102.3	58%	0.575	51%	0.506	S	S	*	.	H	α-helix	trans	-63.7	-43.8	174.8	-74.7	178.4	179.2	0	0	111.8	N966 K967 N973 N974	N966-E970 WeakPolarHBondContact O-CG 3.39Å; N966-E970 PolarHBondContact O-N 3.48Å; K967-E970 PolarHBondContact O-N 2.83Å; E970-N973 PolarHBondContact O-N 3.28Å; E970-N974 WeakPolarHBondContact O-CB 3.5Å; E970-N974 PolarHBondContact O-N 3.47Å; E970-N974 PolarHBondContact O-ND2 2.92Å
971	Q	96.7	Very high	95.2	Very high	107 Å²	107	98.7 Å²	98.7	50%	0.5	50%	0.5	S	S	.	.	H	α-helix	trans	-61.4	-44.3	174.3	-75.3	179.7	-11.8	0	0	111.9	K967 M968 N974 G975	K967-Q971 WeakPolarHBondContact O-CG 3.45Å; K967-Q971 PolarHBondContact O-N 3.3Å; M968-Q971 PolarHBondContact O-N 3.06Å; Q971-N974 PolarHBondContact O-N 3.18Å; Q971-G975 PolarHBondContact O-N 2.93Å
972	H	96.1	Very high	94.9	Very high	120 Å²	120	104 Å²	104	56%	0.556	51%	0.513	S	S	*	.	H	α-helix	trans	-61.8	-44.8	175.3	176.7	-95.4	0	0	0	112.2	M968 I969 N974 G975 L976	M968-H972 WeakPolarHBondContact O-CB 3.4Å; M968-H972 PolarHBondContact O-N 3.4Å; I969-H972 PolarHBondContact O-N 3.31Å; H972-N974 PolarHBondContact O-N 2.76Å; H972-G975 WeakPolarHBondContact O-CA 3.26Å; H972-G975 PolarHBondContact O-N 2.86Å; H972-G975 VanDerWaalsContact O-N 3.13Å; H972-L976 PolarHBondContact O-N 2.81Å
973	N	95.7	Very high	94.4	Very high	84 Å²	84	103.7 Å²	103.7	45%	0.449	51%	0.512	S	S	.	.	H	α-helix	trans	-66.1	-37.3	178.1	-69.8	-15.7	0	0	0	112.2	I969 E970 G975 L976 L977	I969-N973 WeakPolarHBondContact O-CB 3.23Å; I969-N973 PolarHBondContact O-N 3.34Å; I969-N973 PolarHBondContact O-ND2 2.87Å; E970-N973 PolarHBondContact O-N 3.28Å; N973-G975 VanDerWaalsContact C-N 3.32Å; N973-L976 PolarHBondContact O-N 2.88Å; N973-L977 WeakPolarHBondContact O-CB 3.36Å; N973-L977 PolarHBondContact O-N 3.34Å
974	N	95.1	Very high	93.9	Very high	91 Å²	91	99.2 Å²	99.2	49%	0.487	49%	0.494	S	S	.	.	H	α-helix	trans	-66.5	-34.1	171.2	-79.9	-70.3	0	0	0	112	E970 Q971 H972 L977 K978	E970-N974 WeakPolarHBondContact O-CB 3.5Å; E970-N974 PolarHBondContact O-N 3.47Å; E970-N974 PolarHBondContact O-ND2 2.92Å; Q971-N974 PolarHBondContact O-N 3.18Å; H972-N974 PolarHBondContact O-N 2.76Å; N974-L977 PolarHBondContact O-N 3.19Å; N974-K978 WeakPolarHBondContact O-CG 3.45Å; N974-K978 PolarHBondContact O-N 2.94Å
975	G	95.8	Very high	93.3	Very high	33 Å²	33	97.5 Å²	97.5	34%	0.34	49%	0.486	S	S	.	.	H	α-helix	trans	-62.3	-50.4	169.9	0	0	0	0	0	112.2	Q971 H972 N973 L977 K978 E979	Q971-G975 PolarHBondContact O-N 2.93Å; H972-G975 WeakPolarHBondContact O-CA 3.26Å; H972-G975 PolarHBondContact O-N 2.86Å; H972-G975 VanDerWaalsContact O-N 3.13Å; N973-G975 VanDerWaalsContact C-N 3.32Å; G975-L977 VanDerWaalsContact C-N 3.29Å; G975-L977 PolarHBondContact O-N 2.87Å; G975-K978 PolarHBondContact O-N 2.86Å; G975-E979 PolarHBondContact O-N 3.47Å
976	L	95.2	Very high	92.7	Very high	99 Å²	99	93.5 Å²	93.5	52%	0.518	47%	0.473	S	S	.	.	H	α-helix	trans	-59.1	-38.4	174.8	-70.7	-179.8	0	0	0	112.5	H972 N973 E979 L980	H972-L976 PolarHBondContact O-N 2.81Å; N973-L976 PolarHBondContact O-N 2.88Å; L976-E979 PolarHBondContact O-N 3.35Å; L976-L980 VanDerWaalsContact O-CB 3.26Å; L976-L980 WeakPolarHBondContact O-CB 3.38Å; L976-L980 PolarHBondContact O-N 3.24Å
977	L	93.8	Very high	92.1	Very high	105 Å²	105	91.2 Å²	91.2	55%	0.55	46%	0.461	S	S	.	.	H	α-helix	trans	-67.7	-38.9	177.1	-173	63.6	0	0	0	111.9	N973 N974 G975 L980 A981	N973-L977 WeakPolarHBondContact O-CB 3.36Å; N973-L977 PolarHBondContact O-N 3.34Å; N974-L977 PolarHBondContact O-N 3.19Å; G975-L977 VanDerWaalsContact C-N 3.29Å; G975-L977 PolarHBondContact O-N 2.87Å; L977-L980 PolarHBondContact O-N 2.82Å; L977-A981 WeakPolarHBondContact O-CB 3.3Å; L977-A981 PolarHBondContact O-N 3.21Å
978	K	92.4	Very high	91.4	Very high	152 Å²	152	85.9 Å²	85.9	66%	0.661	44%	0.438	S	S	*	.	H	α-helix	trans	-64.1	-43	173.5	-75.8	175.1	-179.8	-175.4	0	111.9	N974 G975 A981 R982	N974-K978 WeakPolarHBondContact O-CG 3.45Å; N974-K978 PolarHBondContact O-N 2.94Å; G975-K978 PolarHBondContact O-N 2.86Å; K978-A981 PolarHBondContact O-N 3.18Å; K978-R982 PolarHBondContact O-N 2.79Å
979	E	91.8	Very high	90.7	Very high	87 Å²	87	84.8 Å²	84.8	41%	0.407	44%	0.435	S	S	.	.	H	α-helix	trans	-71.7	-35.1	176.5	-66.4	-50.1	135.6	0	0	112.7	G975 L976 A981 R982 L983	G975-E979 PolarHBondContact O-N 3.47Å; L976-E979 PolarHBondContact O-N 3.35Å; E979-A981 VanDerWaalsContact C-N 3.34Å; E979-A981 PolarHBondContact O-N 2.86Å; E979-R982 WeakPolarHBondContact O-CB 3.48Å; E979-R982 PolarHBondContact O-N 3.45Å; E979-R982 IonicContact OE1-CZ 3.38Å; E979-R982 IonicContact OE1-NH1 3.16Å; E979-R982 PolarHBondContact OE1-NH1 3.18Å; E979-R982 WeakPolarHBondContact OE2-CD 3.3Å; E979-R982 IonicContact OE2-NH1 3.63Å; E979-L983 WeakPolarHBondContact O-CB 3.2Å; E979-L983 VanDerWaalsContact O-CG 3.31Å; E979-L983 WeakPolarHBondContact O-CG 3.4Å; E979-L983 PolarHBondContact O-N 2.82Å
980	L	90.4	Very high	90	Very high	112 Å²	112	82.3 Å²	82.3	59%	0.586	43%	0.425	S	S	*	.	H	α-helix	trans	-61.5	-42.2	170.9	-174.1	151	0	0	0	111.4	L976 L977 L983 S984	L976-L980 VanDerWaalsContact O-CB 3.26Å; L976-L980 WeakPolarHBondContact O-CB 3.38Å; L976-L980 PolarHBondContact O-N 3.24Å; L977-L980 PolarHBondContact O-N 2.82Å; L980-L983 PolarHBondContact O-N 3.12Å; L980-S984 PolarHBondContact O-N 2.93Å; L980-S984 PolarHBondContact O-OG 3.17Å
981	A	88.3	Confident	89.1	Confident	51 Å²	51	76.4 Å²	76.4	42%	0.421	40%	0.398	S	S	.	.	H	α-helix	trans	-66	-35.6	174.2	0	0	0	0	0	112.7	L977 K978 E979 S984 Q985	L977-A981 WeakPolarHBondContact O-CB 3.3Å; L977-A981 PolarHBondContact O-N 3.21Å; K978-A981 PolarHBondContact O-N 3.18Å; E979-A981 VanDerWaalsContact C-N 3.34Å; E979-A981 PolarHBondContact O-N 2.86Å; A981-S984 WeakPolarHBondContact CA-OG 3.43Å; A981-S984 PolarHBondContact O-OG 3.46Å; A981-Q985 WeakPolarHBondContact O-CB 3.4Å; A981-Q985 PolarHBondContact O-N 3.41Å
982	R	89.7	Confident	88.1	Confident	169 Å²	169	74.3 Å²	74.3	64%	0.638	39%	0.392	S	S	*	.	H	α-helix	trans	-62.4	-47.6	172.2	-122.4	177	-171.3	141.4	4	111.6	K978 E979 Q985 A986	K978-R982 PolarHBondContact O-N 2.79Å; E979-R982 WeakPolarHBondContact O-CB 3.48Å; E979-R982 PolarHBondContact O-N 3.45Å; E979-R982 IonicContact OE1-CZ 3.38Å; E979-R982 IonicContact OE1-NH1 3.16Å; E979-R982 PolarHBondContact OE1-NH1 3.18Å; E979-R982 WeakPolarHBondContact OE2-CD 3.3Å; E979-R982 IonicContact OE2-NH1 3.63Å; R982-Q985 PolarHBondContact O-N 3.12Å; R982-A986 VanDerWaalsContact O-CB 3.32Å; R982-A986 WeakPolarHBondContact O-CB 3.47Å; R982-A986 PolarHBondContact O-N 2.86Å
983	L	87.4	Confident	86.9	Confident	60 Å²	60	76 Å²	76	31%	0.314	41%	0.405	S	S	.	.	H	α-helix	trans	-68.5	-38.1	179.5	-71	171.5	0	0	0	111.9	E979 L980 A986 L987 I1043 V1045	E979-L983 WeakPolarHBondContact O-CB 3.2Å; E979-L983 VanDerWaalsContact O-CG 3.31Å; E979-L983 WeakPolarHBondContact O-CG 3.4Å; E979-L983 PolarHBondContact O-N 2.82Å; L980-L983 PolarHBondContact O-N 3.12Å; L983-A986 PolarHBondContact O-N 3.3Å; L983-L987 VanDerWaalsContact O-CB 3.26Å; L983-L987 WeakPolarHBondContact O-CB 3.3Å; L983-L987 PolarHBondContact O-N 3.4Å; L983-I1043 HydrophobicContact CD2-CG2 3.87Å; L983-V1045 HydrophobicContact CD1-CG1 4.16Å; L983-V1045 HydrophobicContact CD2-CG2 3.97Å
984	S	85.6	Confident	85.9	Confident	28 Å²	28	73.1 Å²	73.1	20%	0.196	39%	0.39	C	S	.	.	H	α-helix	trans	-66.5	-42.5	173.3	63.4	0	0	0	0	111.6	L980 A981 L987 I988	L980-S984 PolarHBondContact O-N 2.93Å; L980-S984 PolarHBondContact O-OG 3.17Å; A981-S984 WeakPolarHBondContact CA-OG 3.43Å; A981-S984 PolarHBondContact O-OG 3.46Å; S984-L987 PolarHBondContact O-N 3.34Å; S984-I988 WeakPolarHBondContact O-CB 3.31Å; S984-I988 VanDerWaalsContact O-CG1 3.27Å; S984-I988 WeakPolarHBondContact O-CG1 3.42Å; S984-I988 PolarHBondContact O-N 3.33Å
985	Q	85.6	Confident	84.7	Confident	91 Å²	91	75.6 Å²	75.6	43%	0.425	40%	0.398	S	S	.	.	H	α-helix	trans	-65.9	-39.4	175.8	-170.2	63	63.9	0	0	112.2	A981 R982 L987 I988 N989	A981-Q985 WeakPolarHBondContact O-CB 3.4Å; A981-Q985 PolarHBondContact O-N 3.41Å; R982-Q985 PolarHBondContact O-N 3.12Å; Q985-L987 VanDerWaalsContact C-N 3.33Å; Q985-L987 PolarHBondContact O-N 3.27Å; Q985-I988 PolarHBondContact O-N 2.81Å; Q985-N989 PolarHBondContact NE2-OD1 3.35Å; Q985-N989 WeakPolarHBondContact O-CB 3.36Å; Q985-N989 PolarHBondContact O-N 3.36Å; Q985-N989 PolarHBondContact O-OD1 3.03Å
986	A	84.6	Confident	83.4	Confident	33 Å²	33	74.3 Å²	74.3	27%	0.273	38%	0.383	S	S	.	.	H	α-helix	trans	-63.3	-38.9	173.8	0	0	0	0	0	112.1	R982 L983 N989 S990 I1043	R982-A986 VanDerWaalsContact O-CB 3.32Å; R982-A986 WeakPolarHBondContact O-CB 3.47Å; R982-A986 PolarHBondContact O-N 2.86Å; L983-A986 PolarHBondContact O-N 3.3Å; A986-N989 PolarHBondContact O-N 3.35Å; A986-S990 WeakPolarHBondContact O-CB 3.23Å; A986-S990 PolarHBondContact O-N 3.45Å; A986-S990 PolarHBondContact O-OG 2.83Å; A986-I1043 HydrophobicContact CB-CG1 4.48Å; A986-I1043 HydrophobicContact CB-CG2 4.27Å
987	L	83.8	Confident	81.8	Confident	33 Å²	33	73.7 Å²	73.7	17%	0.173	39%	0.386	C	S	.	.	H	α-helix	trans	-71	-38.5	176.2	-171.8	59.7	0	0	0	112.1	L983 S984 Q985 S990 L991 F1007 V1011 I1040 I1043	L983-L987 VanDerWaalsContact O-CB 3.26Å; L983-L987 WeakPolarHBondContact O-CB 3.3Å; L983-L987 PolarHBondContact O-N 3.4Å; S984-L987 PolarHBondContact O-N 3.34Å; Q985-L987 VanDerWaalsContact C-N 3.33Å; Q985-L987 PolarHBondContact O-N 3.27Å; L987-S990 PolarHBondContact O-N 2.88Å; L987-L991 HydrophobicContact CD1-CD1 3.61Å; L987-L991 HydrophobicContact CD1-CG 4.12Å; L987-L991 HydrophobicContact CG-CD1 3.78Å; L987-L991 VanDerWaalsContact O-CB 3.32Å; L987-L991 WeakPolarHBondContact O-CB 3.43Å; L987-L991 WeakPolarHBondContact O-CD1 3.41Å; L987-L991 WeakPolarHBondContact O-CG 3.35Å; L987-L991 PolarHBondContact O-N 2.79Å; L987-F1007 HydrophobicContact CB-CE2 4.08Å; L987-F1007 HydrophobicContact CB-CZ 4.29Å; L987-F1007 HydrophobicContact CD2-CE2 3.94Å; L987-F1007 HydrophobicContact CD2-CZ 3.87Å; L987-F1007 HydrophobicContact CG-CE2 4.06Å; L987-F1007 HydrophobicContact CG-CZ 4.39Å; L987-V1011 HydrophobicContact CD2-CG2 4.02Å; L987-I1040 HydrophobicContact CD1-CD1 3.76Å; L987-I1040 HydrophobicContact CD1-CG1 3.7Å; L987-I1043 HydrophobicContact CB-CD1 4.05Å; L987-I1043 HydrophobicContact CD1-CD1 3.75Å
988	I	83.2	Confident	80.3	Confident	16 Å²	16	78.6 Å²	78.6	8%	0.082	41%	0.406	C	S	.	.	H	α-helix	trans	-57.3	-54.3	169.6	-73	166.3	0	0	0	109.6	S984 Q985 S990 L991 T992 I1002 F1007	S984-I988 WeakPolarHBondContact O-CB 3.31Å; S984-I988 VanDerWaalsContact O-CG1 3.27Å; S984-I988 WeakPolarHBondContact O-CG1 3.42Å; S984-I988 PolarHBondContact O-N 3.33Å; Q985-I988 PolarHBondContact O-N 2.81Å; I988-S990 VanDerWaalsContact C-N 3.26Å; I988-S990 PolarHBondContact O-N 3.33Å; I988-L991 CarbonylContact O-C 3.46Å; I988-L991 PolarHBondContact O-N 2.84Å; I988-T992 WeakPolarHBondContact O-CG2 3.19Å; I988-T992 PolarHBondContact O-N 2.91Å; I988-T992 VanDerWaalsContact O-N 3.1Å; I988-I1002 HydrophobicContact CG1-CD1 4.42Å; I988-I1002 HydrophobicContact CG1-CG1 4.47Å; I988-I1002 HydrophobicContact CG2-CG2 4.35Å; I988-F1007 HydrophobicContact CD1-CD2 3.93Å; I988-F1007 HydrophobicContact CD1-CE2 4.4Å; I988-F1007 HydrophobicContact CD1-CG 4.31Å; I988-F1007 HydrophobicContact CG1-CD2 3.44Å; I988-F1007 VanDerWaalsContact CG1-CD2 3.44Å; I988-F1007 HydrophobicContact CG1-CE2 3.77Å; I988-F1007 HydrophobicContact CG1-CG 4.29Å
989	N	82.4	Confident	78.7	Confident	97 Å²	97	73.7 Å²	73.7	52%	0.519	39%	0.386	S	S	.	.	H	α-helix	trans	-62.9	-29.8	-177.7	-66.5	-0.9	0	0	0	113.4	Q985 A986 L991 T992	Q985-N989 PolarHBondContact NE2-OD1 3.35Å; Q985-N989 WeakPolarHBondContact O-CB 3.36Å; Q985-N989 PolarHBondContact O-N 3.36Å; Q985-N989 PolarHBondContact O-OD1 3.03Å; A986-N989 PolarHBondContact O-N 3.35Å; N989-L991 VanDerWaalsContact C-N 3.32Å; N989-T992 PolarHBondContact O-OG1 3.45Å
990	S	80.3	Confident	77.5	Confident	37 Å²	37	71.6 Å²	71.6	26%	0.259	39%	0.387	S	S	.	.	H	α-helix	trans	-82.5	-9.2	177	-56.1	0	0	0	0	113.3	A986 L987 I988 A1039	A986-S990 WeakPolarHBondContact O-CB 3.23Å; A986-S990 PolarHBondContact O-N 3.45Å; A986-S990 PolarHBondContact O-OG 2.83Å; L987-S990 PolarHBondContact O-N 2.88Å; I988-S990 VanDerWaalsContact C-N 3.26Å; I988-S990 PolarHBondContact O-N 3.33Å; S990-A1039 WeakPolarHBondContact O-CB 3.28Å
991	L	78	Confident	76.6	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-120.9	0.9	-174.9	-64.8	176.6	0	0	0	113.7	L987 I988 N989 D993 I994 I1002 Y1010 L1014 I1036 I1040	L987-L991 HydrophobicContact CD1-CD1 3.61Å; L987-L991 HydrophobicContact CD1-CG 4.12Å; L987-L991 HydrophobicContact CG-CD1 3.78Å; L987-L991 VanDerWaalsContact O-CB 3.32Å; L987-L991 WeakPolarHBondContact O-CB 3.43Å; L987-L991 WeakPolarHBondContact O-CD1 3.41Å; L987-L991 WeakPolarHBondContact O-CG 3.35Å; L987-L991 PolarHBondContact O-N 2.79Å; I988-L991 CarbonylContact O-C 3.46Å; I988-L991 PolarHBondContact O-N 2.84Å; N989-L991 VanDerWaalsContact C-N 3.32Å; L991-D993 PolarHBondContact O-N 2.87Å; L991-I994 HydrophobicContact CD2-CD1 3.98Å; L991-I994 PolarHBondContact O-N 3.35Å; L991-I994 VanDerWaalsContact O-O 3.1Å; L991-I1002 HydrophobicContact CB-CD1 3.83Å; L991-I1002 HydrophobicContact CB-CG2 4.22Å; L991-I1002 HydrophobicContact CD1-CD1 3.86Å; L991-Y1010 HydrophobicContact CB-CE1 4.31Å; L991-Y1010 HydrophobicContact CD1-CD1 4.3Å; L991-Y1010 HydrophobicContact CD1-CE1 4.08Å; L991-L1014 HydrophobicContact CD1-CD1 3.72Å; L991-I1036 HydrophobicContact CD2-CG2 4.28Å; L991-I1040 HydrophobicContact CD2-CD1 4.4Å; L991-I1040 HydrophobicContact CD2-CG1 4.33Å
992	T	75.7	Confident	75.9	Confident	63 Å²	63	68.9 Å²	68.9	39%	0.387	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-38.6	177	49.3	0	0	0	0	113.1	I988 N989 I994 I1002	I988-T992 WeakPolarHBondContact O-CG2 3.19Å; I988-T992 PolarHBondContact O-N 2.91Å; I988-T992 VanDerWaalsContact O-N 3.1Å; N989-T992 PolarHBondContact O-OG1 3.45Å; T992-I994 VanDerWaalsContact C-N 3.3Å; T992-I1002 HydrophobicContact CG2-CG2 4.34Å
993	D	70.6	Confident	75.2	Confident	154 Å²	154	63.6 Å²	63.6	82%	0.824	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-3.6	-170.7	-57.4	1	0	0	0	111.8	L991	L991-D993 PolarHBondContact O-N 2.87Å
994	I	74.8	Confident	74.5	Confident	24 Å²	24	68.3 Å²	68.3	12%	0.123	38%	0.381	C	S	.	.			trans	-104.3	131.5	177.2	-54.9	-171.5	0	0	0	107.9	L991 T992 Y1010 L1032 I1036 A1039	L991-I994 HydrophobicContact CD2-CD1 3.98Å; L991-I994 PolarHBondContact O-N 3.35Å; L991-I994 VanDerWaalsContact O-O 3.1Å; T992-I994 VanDerWaalsContact C-N 3.3Å; I994-Y1010 PolarHBondContact O-OH 3.27Å; I994-L1032 HydrophobicContact CG2-CD1 3.58Å; I994-I1036 HydrophobicContact CD1-CB 4.39Å; I994-I1036 HydrophobicContact CD1-CG1 3.75Å; I994-I1036 HydrophobicContact CG2-CD1 4.3Å; I994-I1036 HydrophobicContact CG2-CG1 3.88Å; I994-A1039 HydrophobicContact CD1-CB 4.18Å
995	Q	68.8	Low	73.9	Confident	144 Å²	144	76.2 Å²	76.2	67%	0.673	41%	0.414	S	S	*	.			trans	-113.8	124.5	173.6	-64.6	-179.4	24.4	0	0	109.8
996	L	68.8	Low	73.6	Confident	5 Å²	5	73.5 Å²	73.5	3%	0.026	40%	0.403	C	S	.	.			trans	-81.6	143.4	169.3	-69.7	178	0	0	0	110.4	Q998 M999 Y1010 T1013 L1014 M1017 L1032 I1036	L996-Q998 PolarHBondContact O-N 3.07Å; L996-M999 HydrophobicContact CB-CB 4.25Å; L996-M999 HydrophobicContact CB-CG 4.49Å; L996-M999 PolarHBondContact O-N 3.07Å; L996-Y1010 HydrophobicContact CB-CE2 4.06Å; L996-Y1010 HydrophobicContact CD1-CD1 4.04Å; L996-Y1010 HydrophobicContact CD1-CD2 3.96Å; L996-Y1010 HydrophobicContact CD1-CE1 3.84Å; L996-Y1010 HydrophobicContact CD1-CE2 3.73Å; L996-Y1010 HydrophobicContact CD1-CG 4.11Å; L996-Y1010 HydrophobicContact CG-CE1 4.14Å; L996-Y1010 HydrophobicContact CG-CE2 3.83Å; L996-T1013 HydrophobicContact CD1-CG2 4Å; L996-L1014 HydrophobicContact CD1-CD2 3.82Å; L996-L1014 HydrophobicContact CD1-CG 4.04Å; L996-L1014 HydrophobicContact CD2-CD2 3.91Å; L996-L1014 HydrophobicContact CG-CD2 4.32Å; L996-M1017 HydrophobicContact CD2-CE 4.42Å; L996-M1017 HydrophobicContact CD2-SD 3.91Å; L996-L1032 HydrophobicContact CD2-CD2 4.03Å; L996-L1032 HydrophobicContact CD2-CG 4.46Å; L996-I1036 HydrophobicContact CD2-CD1 4.13Å
997	P	62.6	Low	73.3	Confident	87 Å²	87	74 Å²	74	57%	0.565	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	136.9	174.2	-26.5	34.8	0	0	0	112.2	M999	P997-M999 PolarHBondContact O-N 3.08Å; P997-M999 VanDerWaalsContact O-N 3.17Å
998	Q	60.9	Low	73.3	Confident	207 Å²	207	79.5 Å²	79.5	97%	0.967	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	0.4	-179.8	-49.8	-178.5	5.1	0	0	116.5	L996	L996-Q998 PolarHBondContact O-N 3.07Å
999	M	60.7	Low	73.2	Confident	50 Å²	50	80.9 Å²	80.9	25%	0.246	44%	0.437	C	S	.	.			trans	-108.5	142.7	178	-67.5	-66.1	-102.4	0	0	111.9	L996 P997 N1006 A1009 Y1010	L996-M999 HydrophobicContact CB-CB 4.25Å; L996-M999 HydrophobicContact CB-CG 4.49Å; L996-M999 PolarHBondContact O-N 3.07Å; P997-M999 PolarHBondContact O-N 3.08Å; P997-M999 VanDerWaalsContact O-N 3.17Å; M999-N1006 VanDerWaalsContact CE-OD1 3.24Å; M999-N1006 WeakPolarHBondContact CE-OD1 3.44Å; M999-A1009 HydrophobicContact CE-CB 3.73Å; M999-Y1010 HydrophobicContact CB-CD2 4.45Å; M999-Y1010 HydrophobicContact CB-CE2 4.44Å
1000	G	66.5	Low	73.2	Confident	42 Å²	42	76.2 Å²	76.2	43%	0.433	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-70.7	172.4	168.1	0	0	0	0	0	112.5
1001	P	70.6	Confident	73.4	Confident	93 Å²	93	76.4 Å²	76.4	60%	0.604	41%	0.411	S	S	*	.	S	Bend	trans	-55.1	144.7	178.4	24	-34.3	0	0	0	111.8	S1003	P1001-S1003 PolarHBondContact O-N 3.31Å; P1001-S1003 PolarHBondContact O-OG 2.93Å
1002	I	74.1	Confident	73.7	Confident	14 Å²	14	80.5 Å²	80.5	7%	0.072	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-62.3	133.1	-176.6	-162.1	173.4	0	0	0	110.5	I988 L991 T992 F1007 Y1010	I988-I1002 HydrophobicContact CG1-CD1 4.42Å; I988-I1002 HydrophobicContact CG1-CG1 4.47Å; I988-I1002 HydrophobicContact CG2-CG2 4.35Å; L991-I1002 HydrophobicContact CB-CD1 3.83Å; L991-I1002 HydrophobicContact CB-CG2 4.22Å; L991-I1002 HydrophobicContact CD1-CD1 3.86Å; T992-I1002 HydrophobicContact CG2-CG2 4.34Å; I1002-F1007 HydrophobicContact CD1-CD2 4Å; I1002-F1007 HydrophobicContact CD1-CE2 4.47Å; I1002-F1007 HydrophobicContact CG1-CD2 4.4Å; I1002-Y1010 HydrophobicContact CB-CD1 4.5Å; I1002-Y1010 HydrophobicContact CB-CD2 4.39Å; I1002-Y1010 HydrophobicContact CB-CE1 4.45Å; I1002-Y1010 HydrophobicContact CB-CE2 4.36Å; I1002-Y1010 HydrophobicContact CB-CG 4.45Å; I1002-Y1010 HydrophobicContact CD1-CD1 3.45Å; I1002-Y1010 VanDerWaalsContact CD1-CD1 3.45Å; I1002-Y1010 HydrophobicContact CD1-CE1 3.82Å; I1002-Y1010 HydrophobicContact CD1-CG 3.9Å; I1002-Y1010 HydrophobicContact CG1-CD1 4.01Å; I1002-Y1010 HydrophobicContact CG1-CD2 4.33Å; I1002-Y1010 HydrophobicContact CG1-CE1 4.4Å; I1002-Y1010 HydrophobicContact CG1-CG 3.95Å
1003	S	73.8	Confident	74	Confident	58 Å²	58	80 Å²	80	41%	0.406	43%	0.43	S	S	.	.			trans	-153.7	157.1	-174.5	48.9	0	0	0	0	108.7	P1001 H1005 N1006 F1007	P1001-S1003 PolarHBondContact O-N 3.31Å; P1001-S1003 PolarHBondContact O-OG 2.93Å; S1003-H1005 VanDerWaalsContact C-N 3.26Å; S1003-H1005 PolarHBondContact O-N 3.44Å; S1003-N1006 CarbonylContact O-C 3.59Å; S1003-N1006 PolarHBondContact O-N 2.9Å; S1003-F1007 PolarHBondContact O-N 2.06Å
1004	E	73.7	Confident	74.4	Confident	159 Å²	159	73.5 Å²	73.5	74%	0.743	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-38.1	-172.6	-165	174.3	-154.3	0	0	113.2
1005	H	72.1	Confident	74.8	Confident	193 Å²	193	75.4 Å²	75.4	89%	0.894	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-21.5	174.6	-78.6	16.6	0	0	0	115	S1003	S1003-H1005 VanDerWaalsContact C-N 3.26Å; S1003-H1005 PolarHBondContact O-N 3.44Å
1006	N	79.1	Confident	75.4	Confident	35 Å²	35	72 Å²	72	19%	0.187	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-7	178.2	-162.4	28.2	0	0	0	112.5	M999 S1003 E1008 A1009 Y1010	M999-N1006 VanDerWaalsContact CE-OD1 3.24Å; M999-N1006 WeakPolarHBondContact CE-OD1 3.44Å; S1003-N1006 CarbonylContact O-C 3.59Å; S1003-N1006 PolarHBondContact O-N 2.9Å; N1006-E1008 PolarHBondContact O-N 2.98Å; N1006-A1009 PolarHBondContact O-N 3.36Å; N1006-Y1010 WeakPolarHBondContact O-CB 3.24Å; N1006-Y1010 PolarHBondContact O-N 2.93Å
1007	F	79.4	Confident	75.7	Confident	43 Å²	43	72.7 Å²	72.7	19%	0.189	40%	0.398	C	S	.	.	H	α-helix	trans	-58.1	-45.8	-169.4	178.7	-106.7	0	0	0	112.9	L987 I988 I1002 S1003 A1009 Y1010 V1011	L987-F1007 HydrophobicContact CB-CE2 4.08Å; L987-F1007 HydrophobicContact CB-CZ 4.29Å; L987-F1007 HydrophobicContact CD2-CE2 3.94Å; L987-F1007 HydrophobicContact CD2-CZ 3.87Å; L987-F1007 HydrophobicContact CG-CE2 4.06Å; L987-F1007 HydrophobicContact CG-CZ 4.39Å; I988-F1007 HydrophobicContact CD1-CD2 3.93Å; I988-F1007 HydrophobicContact CD1-CE2 4.4Å; I988-F1007 HydrophobicContact CD1-CG 4.31Å; I988-F1007 HydrophobicContact CG1-CD2 3.44Å; I988-F1007 VanDerWaalsContact CG1-CD2 3.44Å; I988-F1007 HydrophobicContact CG1-CE2 3.77Å; I988-F1007 HydrophobicContact CG1-CG 4.29Å; I1002-F1007 HydrophobicContact CD1-CD2 4Å; I1002-F1007 HydrophobicContact CD1-CE2 4.47Å; I1002-F1007 HydrophobicContact CG1-CD2 4.4Å; S1003-F1007 PolarHBondContact O-N 2.06Å; F1007-A1009 PolarHBondContact O-N 3.37Å; F1007-Y1010 WeakPolarHBondContact O-CB 3.38Å; F1007-Y1010 PolarHBondContact O-N 3.46Å; F1007-V1011 HydrophobicContact CD1-CG2 4.39Å; F1007-V1011 HydrophobicContact CD2-CG2 4.13Å; F1007-V1011 HydrophobicContact CE1-CG2 4.06Å; F1007-V1011 HydrophobicContact CE2-CG2 3.79Å; F1007-V1011 HydrophobicContact CG-CG2 4.43Å; F1007-V1011 HydrophobicContact CZ-CG2 3.76Å; F1007-V1011 WeakPolarHBondContact O-CB 3.16Å; F1007-V1011 WeakPolarHBondContact O-CG2 3.35Å; F1007-V1011 PolarHBondContact O-N 3.17Å
1008	E	83.8	Confident	76.4	Confident	149 Å²	149	75.4 Å²	75.4	70%	0.696	40%	0.398	S	S	*	.	H	α-helix	trans	-64	-42.6	179	-177.5	173.2	-166.1	0	0	112	N1006 Y1010 V1011 N1012	N1006-E1008 PolarHBondContact O-N 2.98Å; E1008-Y1010 VanDerWaalsContact C-N 3.35Å; E1008-V1011 PolarHBondContact O-N 3.4Å; E1008-N1012 WeakPolarHBondContact CG-ND2 3.26Å; E1008-N1012 VanDerWaalsContact O-CB 3.28Å; E1008-N1012 WeakPolarHBondContact O-CB 3.27Å; E1008-N1012 VanDerWaalsContact O-CG 3.3Å; E1008-N1012 PolarHBondContact O-N 3.15Å; E1008-N1012 PolarHBondContact O-ND2 3.38Å
1009	A	81.7	Confident	77.3	Confident	44 Å²	44	70.4 Å²	70.4	36%	0.364	38%	0.378	S	S	.	.	H	α-helix	trans	-67	-36.4	176	0	0	0	0	0	112	M999 N1006 F1007 T1013	M999-A1009 HydrophobicContact CE-CB 3.73Å; N1006-A1009 PolarHBondContact O-N 3.36Å; F1007-A1009 PolarHBondContact O-N 3.37Å; A1009-T1013 WeakPolarHBondContact O-CB 3.29Å; A1009-T1013 PolarHBondContact O-N 3.3Å; A1009-T1013 PolarHBondContact O-OG1 3.25Å
1010	Y	82.4	Confident	77.8	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-64.8	-50.7	174.7	-154	-91.3	0	0	0	111.4	L991 I994 L996 M999 I1002 N1006 F1007 E1008 N1012 T1013 L1014	L991-Y1010 HydrophobicContact CB-CE1 4.31Å; L991-Y1010 HydrophobicContact CD1-CD1 4.3Å; L991-Y1010 HydrophobicContact CD1-CE1 4.08Å; I994-Y1010 PolarHBondContact O-OH 3.27Å; L996-Y1010 HydrophobicContact CB-CE2 4.06Å; L996-Y1010 HydrophobicContact CD1-CD1 4.04Å; L996-Y1010 HydrophobicContact CD1-CD2 3.96Å; L996-Y1010 HydrophobicContact CD1-CE1 3.84Å; L996-Y1010 HydrophobicContact CD1-CE2 3.73Å; L996-Y1010 HydrophobicContact CD1-CG 4.11Å; L996-Y1010 HydrophobicContact CG-CE1 4.14Å; L996-Y1010 HydrophobicContact CG-CE2 3.83Å; M999-Y1010 HydrophobicContact CB-CD2 4.45Å; M999-Y1010 HydrophobicContact CB-CE2 4.44Å; I1002-Y1010 HydrophobicContact CB-CD1 4.5Å; I1002-Y1010 HydrophobicContact CB-CD2 4.39Å; I1002-Y1010 HydrophobicContact CB-CE1 4.45Å; I1002-Y1010 HydrophobicContact CB-CE2 4.36Å; I1002-Y1010 HydrophobicContact CB-CG 4.45Å; I1002-Y1010 HydrophobicContact CD1-CD1 3.45Å; I1002-Y1010 VanDerWaalsContact CD1-CD1 3.45Å; I1002-Y1010 HydrophobicContact CD1-CE1 3.82Å; I1002-Y1010 HydrophobicContact CD1-CG 3.9Å; I1002-Y1010 HydrophobicContact CG1-CD1 4.01Å; I1002-Y1010 HydrophobicContact CG1-CD2 4.33Å; I1002-Y1010 HydrophobicContact CG1-CE1 4.4Å; I1002-Y1010 HydrophobicContact CG1-CG 3.95Å; N1006-Y1010 WeakPolarHBondContact O-CB 3.24Å; N1006-Y1010 PolarHBondContact O-N 2.93Å; F1007-Y1010 WeakPolarHBondContact O-CB 3.38Å; F1007-Y1010 PolarHBondContact O-N 3.46Å; E1008-Y1010 VanDerWaalsContact C-N 3.35Å; Y1010-N1012 PolarHBondContact O-N 3.1Å; Y1010-T1013 PolarHBondContact O-N 2.82Å; Y1010-L1014 HydrophobicContact CD1-CD1 3.82Å; Y1010-L1014 HydrophobicContact CD1-CG 4.14Å; Y1010-L1014 HydrophobicContact CE1-CD1 3.99Å; Y1010-L1014 HydrophobicContact CE1-CG 4.32Å; Y1010-L1014 WeakPolarHBondContact O-CG 3.14Å; Y1010-L1014 PolarHBondContact O-N 3.06Å
1011	V	82.9	Confident	77.6	Confident	40 Å²	40	70.9 Å²	70.9	24%	0.242	38%	0.375	C	S	.	.	H	α-helix	trans	-63.3	-38.5	177.9	170.6	0	0	0	0	111.8	L987 F1007 E1008 L1014 T1015	L987-V1011 HydrophobicContact CD2-CG2 4.02Å; F1007-V1011 HydrophobicContact CD1-CG2 4.39Å; F1007-V1011 HydrophobicContact CD2-CG2 4.13Å; F1007-V1011 HydrophobicContact CE1-CG2 4.06Å; F1007-V1011 HydrophobicContact CE2-CG2 3.79Å; F1007-V1011 HydrophobicContact CG-CG2 4.43Å; F1007-V1011 HydrophobicContact CZ-CG2 3.76Å; F1007-V1011 WeakPolarHBondContact O-CB 3.16Å; F1007-V1011 WeakPolarHBondContact O-CG2 3.35Å; F1007-V1011 PolarHBondContact O-N 3.17Å; E1008-V1011 PolarHBondContact O-N 3.4Å; V1011-L1014 PolarHBondContact O-N 2.84Å; V1011-T1015 WeakPolarHBondContact O-CB 3.45Å; V1011-T1015 PolarHBondContact O-N 3.26Å; V1011-T1015 PolarHBondContact O-OG1 3Å
1012	N	84.2	Confident	76.9	Confident	86 Å²	86	75.2 Å²	75.2	46%	0.46	39%	0.388	S	S	.	.	H	α-helix	trans	-65	-42.5	173.4	-78.8	-45.1	0	0	0	111.6	E1008 Y1010 T1015 D1016	E1008-N1012 WeakPolarHBondContact CG-ND2 3.26Å; E1008-N1012 VanDerWaalsContact O-CB 3.28Å; E1008-N1012 WeakPolarHBondContact O-CB 3.27Å; E1008-N1012 VanDerWaalsContact O-CG 3.3Å; E1008-N1012 PolarHBondContact O-N 3.15Å; E1008-N1012 PolarHBondContact O-ND2 3.38Å; Y1010-N1012 PolarHBondContact O-N 3.1Å; N1012-T1015 PolarHBondContact O-N 3.48Å; N1012-D1016 PolarHBondContact O-N 2.81Å
1013	T	82.9	Confident	76.1	Confident	53 Å²	53	80 Å²	80	33%	0.325	41%	0.409	S	S	.	.	H	α-helix	trans	-63.7	-43	176.1	-55.4	0	0	0	0	111.7	L996 A1009 Y1010 T1015 D1016 M1017	L996-T1013 HydrophobicContact CD1-CG2 4Å; A1009-T1013 WeakPolarHBondContact O-CB 3.29Å; A1009-T1013 PolarHBondContact O-N 3.3Å; A1009-T1013 PolarHBondContact O-OG1 3.25Å; Y1010-T1013 PolarHBondContact O-N 2.82Å; T1013-T1015 VanDerWaalsContact C-N 3.31Å; T1013-T1015 PolarHBondContact O-N 2.85Å; T1013-D1016 PolarHBondContact O-N 3.49Å; T1013-M1017 HydrophobicContact CG2-SD 4.41Å; T1013-M1017 WeakPolarHBondContact O-CB 3.42Å; T1013-M1017 WeakPolarHBondContact O-CG 3.43Å; T1013-M1017 PolarHBondContact O-N 2.89Å
1014	L	79.8	Confident	75.1	Confident	18 Å²	18	86.5 Å²	86.5	9%	0.094	43%	0.433	C	S	.	.	H	α-helix	trans	-60.3	-41.6	172.3	-71.8	-179.7	0	0	0	112.2	L991 L996 Y1010 V1011 M1017 Y1018 I1036	L991-L1014 HydrophobicContact CD1-CD1 3.72Å; L996-L1014 HydrophobicContact CD1-CD2 3.82Å; L996-L1014 HydrophobicContact CD1-CG 4.04Å; L996-L1014 HydrophobicContact CD2-CD2 3.91Å; L996-L1014 HydrophobicContact CG-CD2 4.32Å; Y1010-L1014 HydrophobicContact CD1-CD1 3.82Å; Y1010-L1014 HydrophobicContact CD1-CG 4.14Å; Y1010-L1014 HydrophobicContact CE1-CD1 3.99Å; Y1010-L1014 HydrophobicContact CE1-CG 4.32Å; Y1010-L1014 WeakPolarHBondContact O-CG 3.14Å; Y1010-L1014 PolarHBondContact O-N 3.06Å; V1011-L1014 PolarHBondContact O-N 2.84Å; L1014-M1017 PolarHBondContact O-N 3.41Å; L1014-Y1018 VanDerWaalsContact O-CB 3.28Å; L1014-Y1018 WeakPolarHBondContact O-CB 3.43Å; L1014-Y1018 PolarHBondContact O-N 3.37Å; L1014-I1036 HydrophobicContact CD2-CD1 3.53Å; L1014-I1036 HydrophobicContact CD2-CG1 4.29Å; L1014-I1036 HydrophobicContact CD2-CG2 4.14Å
1015	T	82.5	Confident	74.7	Confident	63 Å²	63	81.9 Å²	81.9	39%	0.387	41%	0.41	S	S	.	.	H	α-helix	trans	-68.6	-41.7	-178.8	-65.9	0	0	0	0	111.2	V1011 N1012 T1013 Y1018 N1019	V1011-T1015 WeakPolarHBondContact O-CB 3.45Å; V1011-T1015 PolarHBondContact O-N 3.26Å; V1011-T1015 PolarHBondContact O-OG1 3Å; N1012-T1015 PolarHBondContact O-N 3.48Å; T1013-T1015 VanDerWaalsContact C-N 3.31Å; T1013-T1015 PolarHBondContact O-N 2.85Å; T1015-Y1018 PolarHBondContact O-N 3Å; T1015-N1019 WeakPolarHBondContact CG2-ND2 3.28Å; T1015-N1019 VanDerWaalsContact O-CB 3.24Å; T1015-N1019 WeakPolarHBondContact O-CB 3.38Å; T1015-N1019 PolarHBondContact O-N 3.41Å; T1015-N1019 PolarHBondContact O-ND2 3.11Å
1016	D	82	Confident	74.5	Confident	72 Å²	72	74.6 Å²	74.6	39%	0.385	38%	0.381	S	S	.	.	H	α-helix	trans	-67.4	-42.5	171.6	-105.1	-43.3	0	0	0	111.4	K586 N1012 T1013 Y1018 N1019 N1020	K586-D1016 IonicContact NZ-OD1 2.73Å; K586-D1016 PolarHBondContact NZ-OD1 3.49Å; K586-D1016 IonicContact NZ-OD2 2.74Å; N1012-D1016 PolarHBondContact O-N 2.81Å; T1013-D1016 PolarHBondContact O-N 3.49Å; D1016-Y1018 VanDerWaalsContact C-N 3.29Å; D1016-Y1018 PolarHBondContact O-N 3.44Å; D1016-N1019 PolarHBondContact O-N 3.31Å; D1016-N1020 VanDerWaalsContact O-CB 3.3Å; D1016-N1020 WeakPolarHBondContact O-CB 3.46Å; D1016-N1020 PolarHBondContact O-N 3.25Å; D1016-N1020 PolarHBondContact O-ND2 2.83Å; D1016-N1020 PolarHBondContact OD1-ND2 3.21Å
1017	M	74.7	Confident	74.1	Confident	20 Å²	20	78 Å²	78	10%	0.099	40%	0.404	C	S	.	.	H	α-helix	trans	-60.3	-37.8	174.8	-76	-179.6	61.8	0	0	112.8	L996 T1013 L1014 S1021 L1032 L1033	L996-M1017 HydrophobicContact CD2-CE 4.42Å; L996-M1017 HydrophobicContact CD2-SD 3.91Å; T1013-M1017 HydrophobicContact CG2-SD 4.41Å; T1013-M1017 WeakPolarHBondContact O-CB 3.42Å; T1013-M1017 WeakPolarHBondContact O-CG 3.43Å; T1013-M1017 PolarHBondContact O-N 2.89Å; L1014-M1017 PolarHBondContact O-N 3.41Å; M1017-S1021 WeakPolarHBondContact O-CB 3.49Å; M1017-S1021 PolarHBondContact O-N 3Å; M1017-L1032 HydrophobicContact CE-CD2 4.37Å; M1017-L1033 HydrophobicContact CB-CD2 4.11Å; M1017-L1033 HydrophobicContact CE-CD2 4.47Å; M1017-L1033 HydrophobicContact CE-CG 4.18Å
1018	Y	76.5	Confident	73.7	Confident	144 Å²	144	83 Å²	83	57%	0.565	43%	0.428	S	S	*	.	H	α-helix	trans	-71.4	-46.1	175.8	-173.6	-90	0	0	0	112	L1014 T1015 D1016 N1020 S1021	L1014-Y1018 VanDerWaalsContact O-CB 3.28Å; L1014-Y1018 WeakPolarHBondContact O-CB 3.43Å; L1014-Y1018 PolarHBondContact O-N 3.37Å; T1015-Y1018 PolarHBondContact O-N 3Å; D1016-Y1018 VanDerWaalsContact C-N 3.29Å; D1016-Y1018 PolarHBondContact O-N 3.44Å; Y1018-N1020 PolarHBondContact O-N 3.42Å; Y1018-S1021 WeakPolarHBondContact O-CB 3.38Å; Y1018-S1021 PolarHBondContact O-N 3.23Å; Y1018-S1021 PolarHBondContact O-OG 2.94Å
1019	N	79.6	Confident	73	Confident	102 Å²	102	77.3 Å²	77.3	55%	0.545	41%	0.405	S	S	.	.	H	α-helix	trans	-67.4	-33.1	-179.7	-74.2	-34.9	0	0	0	113.2	T1015 D1016 S1021	T1015-N1019 WeakPolarHBondContact CG2-ND2 3.28Å; T1015-N1019 VanDerWaalsContact O-CB 3.24Å; T1015-N1019 WeakPolarHBondContact O-CB 3.38Å; T1015-N1019 PolarHBondContact O-N 3.41Å; T1015-N1019 PolarHBondContact O-ND2 3.11Å; D1016-N1019 PolarHBondContact O-N 3.31Å; N1019-S1021 VanDerWaalsContact C-N 3.31Å
1020	N	70.9	Confident	72.8	Confident	51 Å²	51	79.7 Å²	79.7	27%	0.273	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	4.5	177.3	-56.9	-50.2	0	0	0	112.4	D1016 Y1018 E1022 H1023 Y1025	D1016-N1020 VanDerWaalsContact O-CB 3.3Å; D1016-N1020 WeakPolarHBondContact O-CB 3.46Å; D1016-N1020 PolarHBondContact O-N 3.25Å; D1016-N1020 PolarHBondContact O-ND2 2.83Å; D1016-N1020 PolarHBondContact OD1-ND2 3.21Å; Y1018-N1020 PolarHBondContact O-N 3.42Å; N1020-E1022 PolarHBondContact O-N 3.23Å; N1020-H1023 PolarHBondContact O-N 3.39Å; N1020-Y1025 HydrophobicContact CB-CE2 4.09Å; N1020-Y1025 WeakPolarHBondContact O-CE2 3.42Å
1021	S	62.7	Low	72.7	Confident	51 Å²	51	82.1 Å²	82.1	36%	0.357	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-10	-170.1	64.9	0	0	0	0	115.8	M1017 Y1018 N1019 H1023	M1017-S1021 WeakPolarHBondContact O-CB 3.49Å; M1017-S1021 PolarHBondContact O-N 3Å; Y1018-S1021 WeakPolarHBondContact O-CB 3.38Å; Y1018-S1021 PolarHBondContact O-N 3.23Å; Y1018-S1021 PolarHBondContact O-OG 2.94Å; N1019-S1021 VanDerWaalsContact C-N 3.31Å; S1021-H1023 VanDerWaalsContact C-N 3.29Å
1022	E	56.6	Low	72.5	Confident	184 Å²	184	81.7 Å²	81.7	86%	0.86	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-15.3	171.1	-61.4	-172.9	150.9	0	0	113.2	N1020	N1020-E1022 PolarHBondContact O-N 3.23Å
1023	H	56.5	Low	72.3	Confident	114 Å²	114	78 Å²	78	53%	0.528	40%	0.403	S	S	.	.	S	Bend	trans	-90.7	164.7	177.6	-65.1	33.2	0	0	0	111.4	N1020 S1021 Y1025	N1020-H1023 PolarHBondContact O-N 3.39Å; S1021-H1023 VanDerWaalsContact C-N 3.29Å; H1023-Y1025 VanDerWaalsContact C-N 3.27Å; H1023-Y1025 PolarHBondContact O-N 3.05Å
1024	E	54.3	Low	72.2	Confident	195 Å²	195	79.7 Å²	79.7	91%	0.911	41%	0.411	S	S	*	.			trans	-72.7	68.4	-171.2	-66.3	-164.3	121.3	0	0	114.8
1025	Y	63.6	Low	72.3	Confident	63 Å²	63	83.7 Å²	83.7	25%	0.247	43%	0.432	C	S	.	.			trans	-61.1	143.8	165.6	-83.6	-68.9	0	0	0	112.2	N1020 H1023 C1029 K1030	N1020-Y1025 HydrophobicContact CB-CE2 4.09Å; N1020-Y1025 WeakPolarHBondContact O-CE2 3.42Å; H1023-Y1025 VanDerWaalsContact C-N 3.27Å; H1023-Y1025 PolarHBondContact O-N 3.05Å; Y1025-C1029 HydrophobicContact CD1-CB 3.73Å; Y1025-C1029 HydrophobicContact CG-CB 4.12Å; Y1025-K1030 VanDerWaalsContact O-CE 3.24Å; Y1025-K1030 WeakPolarHBondContact O-CE 3.4Å; Y1025-K1030 PolarHBondContact O-NZ 3.02Å
1026	S	68	Low	72.2	Confident	40 Å²	40	81.2 Å²	81.2	28%	0.28	42%	0.416	S	S	.	.			trans	-47.3	145.9	168.1	169.2	0	0	0	0	111	E1028 C1029 K1030	S1026-E1028 PolarHBondContact O-N 3.32Å; S1026-E1028 VanDerWaalsContact O-N 3.11Å; S1026-E1028 PolarHBondContact OG-N 2.98Å; S1026-E1028 VanDerWaalsContact OG-N 3.12Å; S1026-E1028 PolarHBondContact OG-OE2 3.11Å; S1026-C1029 PolarHBondContact O-N 3.04Å; S1026-K1030 PolarHBondContact O-N 3.36Å
1027	P	71.2	Confident	72.1	Confident	106 Å²	106	81.6 Å²	81.6	69%	0.688	41%	0.414	S	S	*	.	H	α-helix	trans	-50.7	-31.6	169.5	22.4	-35.1	0	0	0	113	K1030 A1031	P1027-K1030 PolarHBondContact O-N 3.26Å; P1027-A1031 WeakPolarHBondContact O-CB 3.45Å; P1027-A1031 PolarHBondContact O-N 3.47Å
1028	E	71.1	Confident	72.4	Confident	147 Å²	147	86.2 Å²	86.2	69%	0.687	44%	0.436	S	S	*	.	H	α-helix	trans	-65.6	-46.2	177.1	-59	146.6	148.5	0	0	111.3	S1026 K1030 A1031 L1032	S1026-E1028 PolarHBondContact O-N 3.32Å; S1026-E1028 VanDerWaalsContact O-N 3.11Å; S1026-E1028 PolarHBondContact OG-N 2.98Å; S1026-E1028 VanDerWaalsContact OG-N 3.12Å; S1026-E1028 PolarHBondContact OG-OE2 3.11Å; E1028-K1030 VanDerWaalsContact C-N 3.3Å; E1028-K1030 PolarHBondContact O-N 3.35Å; E1028-A1031 PolarHBondContact O-N 3.24Å; E1028-L1032 VanDerWaalsContact O-CB 3.26Å; E1028-L1032 WeakPolarHBondContact O-CB 3.22Å; E1028-L1032 PolarHBondContact O-N 2.83Å
1029	C	70.1	Confident	72.4	Confident	30 Å²	30	81 Å²	81	20%	0.203	42%	0.422	C	S	.	.	H	α-helix	trans	-66.5	-31.9	176.7	-64.5	0	0	0	0	112.4	Y1025 S1026 L1033	Y1025-C1029 HydrophobicContact CD1-CB 3.73Å; Y1025-C1029 HydrophobicContact CG-CB 4.12Å; S1026-C1029 PolarHBondContact O-N 3.04Å; C1029-L1033 WeakPolarHBondContact O-CB 3.35Å; C1029-L1033 WeakPolarHBondContact O-CG 3.44Å; C1029-L1033 PolarHBondContact O-N 3.36Å
1030	K	77.6	Confident	72.3	Confident	95 Å²	95	79 Å²	79	41%	0.413	41%	0.411	S	S	.	.	H	α-helix	trans	-71	-45.6	174.8	-72.6	170.2	174.9	155.2	0	111.5	Y1025 S1026 P1027 E1028 L1032 L1033 D1034	Y1025-K1030 VanDerWaalsContact O-CE 3.24Å; Y1025-K1030 WeakPolarHBondContact O-CE 3.4Å; Y1025-K1030 PolarHBondContact O-NZ 3.02Å; S1026-K1030 PolarHBondContact O-N 3.36Å; P1027-K1030 PolarHBondContact O-N 3.26Å; E1028-K1030 VanDerWaalsContact C-N 3.3Å; E1028-K1030 PolarHBondContact O-N 3.35Å; K1030-L1032 VanDerWaalsContact C-N 3.32Å; K1030-L1032 PolarHBondContact O-N 2.88Å; K1030-L1033 PolarHBondContact O-N 2.85Å; K1030-D1034 PolarHBondContact O-N 3.4Å
1031	A	79.2	Confident	72.6	Confident	51 Å²	51	83.6 Å²	83.6	42%	0.421	43%	0.429	S	S	.	.	H	α-helix	trans	-61.3	-40.3	173.2	0	0	0	0	0	112.1	P1027 E1028 D1034 N1035	P1027-A1031 WeakPolarHBondContact O-CB 3.45Å; P1027-A1031 PolarHBondContact O-N 3.47Å; E1028-A1031 PolarHBondContact O-N 3.24Å; A1031-D1034 PolarHBondContact O-N 3.35Å; A1031-N1035 PolarHBondContact O-N 3.46Å; A1031-N1035 PolarHBondContact O-ND2 3.01Å
1032	L	79.5	Confident	72.7	Confident	31 Å²	31	84.3 Å²	84.3	16%	0.162	44%	0.444	C	S	.	.	H	α-helix	trans	-60.3	-48.5	174.1	-176.2	56.3	0	0	0	111.4	I994 L996 M1017 E1028 K1030 D1034 N1035 I1036	I994-L1032 HydrophobicContact CG2-CD1 3.58Å; L996-L1032 HydrophobicContact CD2-CD2 4.03Å; L996-L1032 HydrophobicContact CD2-CG 4.46Å; M1017-L1032 HydrophobicContact CE-CD2 4.37Å; E1028-L1032 VanDerWaalsContact O-CB 3.26Å; E1028-L1032 WeakPolarHBondContact O-CB 3.22Å; E1028-L1032 PolarHBondContact O-N 2.83Å; K1030-L1032 VanDerWaalsContact C-N 3.32Å; K1030-L1032 PolarHBondContact O-N 2.88Å; L1032-D1034 VanDerWaalsContact C-N 3.32Å; L1032-D1034 PolarHBondContact O-N 3.12Å; L1032-N1035 PolarHBondContact O-N 2.97Å; L1032-I1036 HydrophobicContact CD1-CD1 4.16Å; L1032-I1036 HydrophobicContact CG-CD1 3.92Å; L1032-I1036 VanDerWaalsContact O-CD1 3.29Å; L1032-I1036 WeakPolarHBondContact O-CD1 3.46Å; L1032-I1036 VanDerWaalsContact O-CG1 3.23Å; L1032-I1036 WeakPolarHBondContact O-CG1 3.44Å; L1032-I1036 PolarHBondContact O-N 3.26Å
1033	L	79.3	Confident	73.6	Confident	8 Å²	8	77.2 Å²	77.2	4%	0.042	41%	0.412	C	S	.	.	H	α-helix	trans	-59.8	-37.7	175.1	-82.5	168.2	0	0	0	113.1	M1017 C1029 K1030 K1037	M1017-L1033 HydrophobicContact CB-CD2 4.11Å; M1017-L1033 HydrophobicContact CE-CD2 4.47Å; M1017-L1033 HydrophobicContact CE-CG 4.18Å; C1029-L1033 WeakPolarHBondContact O-CB 3.35Å; C1029-L1033 WeakPolarHBondContact O-CG 3.44Å; C1029-L1033 PolarHBondContact O-N 3.36Å; K1030-L1033 PolarHBondContact O-N 2.85Å; L1033-K1037 VanDerWaalsContact O-CG 3.23Å; L1033-K1037 WeakPolarHBondContact O-CG 3.38Å; L1033-K1037 PolarHBondContact O-N 3.15Å
1034	D	80.9	Confident	73.8	Confident	89 Å²	89	80.6 Å²	80.6	48%	0.476	43%	0.427	S	S	.	.	H	α-helix	trans	-75.1	-33.5	177.8	-76	-21.5	0	0	0	113	K1030 A1031 L1032 K1037 Q1038	K1030-D1034 PolarHBondContact O-N 3.4Å; A1031-D1034 PolarHBondContact O-N 3.35Å; L1032-D1034 VanDerWaalsContact C-N 3.32Å; L1032-D1034 PolarHBondContact O-N 3.12Å; D1034-K1037 PolarHBondContact O-N 3.06Å; D1034-K1037 WeakPolarHBondContact OD1-CD 3.1Å; D1034-K1037 WeakPolarHBondContact OD1-CE 3.34Å; D1034-K1037 IonicContact OD1-NZ 2.67Å; D1034-K1037 PolarHBondContact OD1-NZ 3.2Å; D1034-Q1038 WeakPolarHBondContact O-CB 3.25Å; D1034-Q1038 PolarHBondContact O-N 3.39Å
1035	N	80.9	Confident	73.9	Confident	102 Å²	102	79.4 Å²	79.4	55%	0.545	43%	0.433	S	S	.	.	H	α-helix	trans	-62.7	-44.4	168.4	-74	-22	0	0	0	111.4	A1031 L1032 Q1038 A1039	A1031-N1035 PolarHBondContact O-N 3.46Å; A1031-N1035 PolarHBondContact O-ND2 3.01Å; L1032-N1035 PolarHBondContact O-N 2.97Å; N1035-Q1038 PolarHBondContact O-N 3.03Å; N1035-Q1038 VanDerWaalsContact O-N 3.09Å; N1035-A1039 PolarHBondContact O-N 3.35Å
1036	I	81	Confident	74.4	Confident	10 Å²	10	80.2 Å²	80.2	5%	0.051	44%	0.442	C	S	.	.	H	α-helix	trans	-59.7	-48.4	174.9	-70	156.1	0	0	0	110.7	L991 I994 L996 L1014 L1032 Q1038 A1039 I1040	L991-I1036 HydrophobicContact CD2-CG2 4.28Å; I994-I1036 HydrophobicContact CD1-CB 4.39Å; I994-I1036 HydrophobicContact CD1-CG1 3.75Å; I994-I1036 HydrophobicContact CG2-CD1 4.3Å; I994-I1036 HydrophobicContact CG2-CG1 3.88Å; L996-I1036 HydrophobicContact CD2-CD1 4.13Å; L1014-I1036 HydrophobicContact CD2-CD1 3.53Å; L1014-I1036 HydrophobicContact CD2-CG1 4.29Å; L1014-I1036 HydrophobicContact CD2-CG2 4.14Å; L1032-I1036 HydrophobicContact CD1-CD1 4.16Å; L1032-I1036 HydrophobicContact CG-CD1 3.92Å; L1032-I1036 VanDerWaalsContact O-CD1 3.29Å; L1032-I1036 WeakPolarHBondContact O-CD1 3.46Å; L1032-I1036 VanDerWaalsContact O-CG1 3.23Å; L1032-I1036 WeakPolarHBondContact O-CG1 3.44Å; L1032-I1036 PolarHBondContact O-N 3.26Å; I1036-Q1038 PolarHBondContact O-N 3.36Å; I1036-A1039 PolarHBondContact O-N 3.27Å; I1036-I1040 HydrophobicContact CG2-CD1 3.64Å; I1036-I1040 HydrophobicContact CG2-CG1 4.43Å; I1036-I1040 WeakPolarHBondContact O-CB 3.38Å; I1036-I1040 WeakPolarHBondContact O-CG1 3.4Å; I1036-I1040 PolarHBondContact O-N 3.21Å
1037	K	80.8	Confident	74.8	Confident	80 Å²	80	82.3 Å²	82.3	35%	0.348	45%	0.451	S	S	.	.	H	α-helix	trans	-58.4	-36.6	173.7	-70.5	167.2	-149	164.2	0	111.7	L1033 D1034 K1041	L1033-K1037 VanDerWaalsContact O-CG 3.23Å; L1033-K1037 WeakPolarHBondContact O-CG 3.38Å; L1033-K1037 PolarHBondContact O-N 3.15Å; D1034-K1037 PolarHBondContact O-N 3.06Å; D1034-K1037 WeakPolarHBondContact OD1-CD 3.1Å; D1034-K1037 WeakPolarHBondContact OD1-CE 3.34Å; D1034-K1037 IonicContact OD1-NZ 2.67Å; D1034-K1037 PolarHBondContact OD1-NZ 3.2Å; K1037-K1041 WeakPolarHBondContact O-CD 3.32Å; K1037-K1041 VanDerWaalsContact O-CE 3.32Å; K1037-K1041 WeakPolarHBondContact O-CE 3.36Å; K1037-K1041 WeakPolarHBondContact O-CG 3.5Å; K1037-K1041 PolarHBondContact O-N 3.35Å
1038	Q	79.8	Confident	75	Confident	118 Å²	118	81 Å²	81	55%	0.551	44%	0.438	S	S	*	.	H	α-helix	trans	-73.5	-35.3	-178.4	-172.4	58.7	24.7	0	0	112.7	D1034 N1035 I1036	D1034-Q1038 WeakPolarHBondContact O-CB 3.25Å; D1034-Q1038 PolarHBondContact O-N 3.39Å; N1035-Q1038 PolarHBondContact O-N 3.03Å; N1035-Q1038 VanDerWaalsContact O-N 3.09Å; I1036-Q1038 PolarHBondContact O-N 3.36Å
1039	A	77.4	Confident	75.2	Confident	34 Å²	34	77.1 Å²	77.1	28%	0.281	42%	0.423	S	S	.	.	H	α-helix	trans	-69.9	-47.9	173.1	0	0	0	0	0	112	S990 I994 N1035 I1036 K1041 G1042	S990-A1039 WeakPolarHBondContact O-CB 3.28Å; I994-A1039 HydrophobicContact CD1-CB 4.18Å; N1035-A1039 PolarHBondContact O-N 3.35Å; I1036-A1039 PolarHBondContact O-N 3.27Å; A1039-K1041 PolarHBondContact O-N 3.14Å; A1039-G1042 PolarHBondContact O-N 3.49Å
1040	I	77.4	Confident	75.5	Confident	61 Å²	61	80.1 Å²	80.1	31%	0.313	44%	0.437	S	S	.	.	H	α-helix	trans	-64.7	-25.7	-177.1	-66.6	175.3	0	0	0	112.7	L987 L991 I1036 G1042 I1043	L987-I1040 HydrophobicContact CD1-CD1 3.76Å; L987-I1040 HydrophobicContact CD1-CG1 3.7Å; L991-I1040 HydrophobicContact CD2-CD1 4.4Å; L991-I1040 HydrophobicContact CD2-CG1 4.33Å; I1036-I1040 HydrophobicContact CG2-CD1 3.64Å; I1036-I1040 HydrophobicContact CG2-CG1 4.43Å; I1036-I1040 WeakPolarHBondContact O-CB 3.38Å; I1036-I1040 WeakPolarHBondContact O-CG1 3.4Å; I1036-I1040 PolarHBondContact O-N 3.21Å; I1040-G1042 PolarHBondContact O-N 3.18Å; I1040-I1043 HydrophobicContact CG2-CD1 4.43Å; I1040-I1043 PolarHBondContact O-N 3.21Å
1041	K	76.1	Confident	75.4	Confident	146 Å²	146	79.1 Å²	79.1	64%	0.635	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-17.4	174.2	-82.5	166.5	-151.5	169.1	0	114.8	K1037 A1039	K1037-K1041 WeakPolarHBondContact O-CD 3.32Å; K1037-K1041 VanDerWaalsContact O-CE 3.32Å; K1037-K1041 WeakPolarHBondContact O-CE 3.36Å; K1037-K1041 WeakPolarHBondContact O-CG 3.5Å; K1037-K1041 PolarHBondContact O-N 3.35Å; A1039-K1041 PolarHBondContact O-N 3.14Å
1042	G	66.6	Low	75.1	Confident	66 Å²	66	81.1 Å²	81.1	68%	0.68	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-16.5	175.5	0	0	0	0	0	114.6	A1039 I1040 H1044	A1039-G1042 PolarHBondContact O-N 3.49Å; I1040-G1042 PolarHBondContact O-N 3.18Å; G1042-H1044 PolarHBondContact O-N 3.29Å
1043	I	74.9	Confident	74.8	Confident	36 Å²	36	84.9 Å²	84.9	19%	0.185	46%	0.461	C	S	.	.			trans	-82	114.3	-175.7	-54.1	176.5	0	0	0	109.2	L983 A986 L987 I1040 V1045	L983-I1043 HydrophobicContact CD2-CG2 3.87Å; A986-I1043 HydrophobicContact CB-CG1 4.48Å; A986-I1043 HydrophobicContact CB-CG2 4.27Å; L987-I1043 HydrophobicContact CB-CD1 4.05Å; L987-I1043 HydrophobicContact CD1-CD1 3.75Å; I1040-I1043 HydrophobicContact CG2-CD1 4.43Å; I1040-I1043 PolarHBondContact O-N 3.21Å; I1043-V1045 HydrophobicContact CG2-CG2 4.46Å
1044	H	59.4	Low	74.4	Confident	184 Å²	184	91.3 Å²	91.3	85%	0.852	50%	0.496	S	S	*	.			trans	-81.5	145.9	167.6	-127.4	65.2	0	0	0	110.1	G1042	G1042-H1044 PolarHBondContact O-N 3.29Å
1045	V	57.7	Low	73.8	Confident	170 Å²	170	91.5 Å²	91.5	100%	1.03	50%	0.497	S	S	*	.			trans	-133.6	0	-177	-172.9	0	0	0	0	108.8	L983 I1043	L983-V1045 HydrophobicContact CD1-CG1 4.16Å; L983-V1045 HydrophobicContact CD2-CG2 3.97Å; I1043-V1045 HydrophobicContact CG2-CG2 4.46Å

Retrieved 1,045 of 1,045 residues in 3665.3 ms (Link to these results)

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