A0A087Y1Z6_POEFO Loading...

BTB (POZ) domain containing 7

AlphaFold DB , UniProt , Accession A0A087Y1Z6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,116 aa.

						>A0A087Y1Z6_POEFO|A0A087Y1Z6
MGANGSSYPHSCSPRIGGNTQTQQTFIGTSSYSQQGYGWESKLYSLEHGHERPADRKKKSLGLATLKRRFIKRRKSSRSADHARQMRELLSGWDVRDTNALAEEYEGTAALKELSFQASLARAEAPSLQRDLAALYQHKYCTDVDLIFQGTCFPAHRAILAARCPFFKTLLSSSPGYGAEVLMDVDTAGIDVPMFSALLHYLYTGEFGVGGAEDSRLQNVDVLVQLSEEFGTPNSLEADMKGLFDYMCYYDALLSFSSDSEMIDGSNERGAVAAVPTGGLGSSGGGGATPEEDLRAHKAILSARSPFFRNLLQRRIRTGEEMTERTLQTPTRIVLDESIIPRKYVQVILHCMYTDVVDLGLVLRGSPSSCSLGEVQALVSGCRGASTRTEEAMELYHIALFLEFSMLAQGCEDIVVESLSLDSLVPILKWSSQPYGSKWVHRQALHFLCEEFSQVVTSDVLYELGKEHLLSAIQSDYLQASEQDILKYVVKWGEQQLIKRMADREPNLLSGTAHSVNKRGVKRRDLDVEELREILSPLLPFIRTEHILPPNSDVLADALKRGLISTPPSDMLPTAEGGKANAWLRQKNAGIYVRPRLFSPYVEEAKSVLDEMMVEQTDLVRLRLVRMSNVPDTLYMVNNAVPQCCHMINHQQMAGSSSTAPSVVANEIPVPPLSVVKDMIRRLHELRHTEQVQRAYALNCGEGATVSYELQLRVLREFGLADGATELLQNPSKFFPDERFGDESPILALRQVGRCRVNSSPAMDSMITDLEGVAGFHPPLPPPPPPYHPPATPSHAQLKGGWRPRVPMPTPTRSFSYPCNRTLIQRHAASKHGGSEYSSAPRSQPPDCTNPQAMGRPLLSDQQAMGAEPMMREFMPDIALGVSVMSLREQHMADMDGEGPHSPMGPSGHHLSCSAARFSHGYGPGHGHSCKRHAPEPKLEAQAEFPDLYDFSCRPATPTSAHPLPAFTGPDLYSHSCTQSGSYPPPYVSDCQSHGHLQGRTAPDPLRLDVLSLKSQRHDGVLSSPSGPQPRTGPFPKGRPNETDLTHGLGHLRSPSGNMDGYEDRPRDAPEEMVLDGDPSGPVPLQQSHRNSVGEELLRDRRSPSKPDYPYKKSAL
					

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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	31.8	Very low	30.8	Very low	252 Å²	252	134.6 Å²	134.6	100%	1.241	82%	0.821	S	S	*	*				0	134.6	0	-55.3	-177.3	-69.6	0	0	107.2
2	G	29.9	Very low	30.4	Very low	70 Å²	70	133.7 Å²	133.7	72%	0.722	82%	0.821	S	S	*	*			cis	154.9	136.5	-8.2	0	0	0	0	0	111.6
3	A	29.3	Very low	30.1	Very low	94 Å²	94	132.2 Å²	132.2	78%	0.777	82%	0.82	S	S	*	*			trans	64.8	164.7	174.3	0	0	0	0	0	117.3
4	N	32.1	Very low	30.5	Very low	168 Å²	168	132.1 Å²	132.1	90%	0.898	82%	0.822	S	S	*	*			cis	-169.4	163.8	-48	-101.7	-7.2	0	0	0	109.3
5	G	30.5	Very low	30.3	Very low	73 Å²	73	138.1 Å²	138.1	75%	0.753	82%	0.823	S	S	*	*			trans	92.1	123.9	171.1	0	0	0	0	0	113.1
6	S	31.5	Very low	30.2	Very low	126 Å²	126	139.8 Å²	139.8	88%	0.881	83%	0.825	S	S	*	*			cis	79.9	98.1	25.7	-161.2	0	0	0	0	116.1
7	S	28.5	Very low	30	Very low	118 Å²	118	135.9 Å²	135.9	83%	0.825	82%	0.82	S	S	*	*			trans	-168.5	130.1	134.4	43.7	0	0	0	0	112.6
8	Y	25.8	Very low	29.8	Very low	221 Å²	221	133 Å²	133	87%	0.867	82%	0.823	S	S	*	*			trans	-93	173.3	153.4	-102.6	-105.3	0	0	0	107
9	P	46.4	Very low	29.7	Very low	93 Å²	93	134.1 Å²	134.1	60%	0.604	82%	0.823	S	S	*	*			cis	-142.4	-166.8	20.5	46.2	-27.4	0	0	0	116.2
10	H	27.6	Very low	29.6	Very low	170 Å²	170	134.4 Å²	134.4	79%	0.787	83%	0.825	S	S	*	*			trans	33.6	147	146.3	-56.4	-36.8	0	0	0	122.3
11	S	25.8	Very low	29.7	Very low	96 Å²	96	136.6 Å²	136.6	67%	0.671	83%	0.825	S	S	*	*			cis	-177.1	-174.4	-13.1	55.2	0	0	0	0	109.3
12	C	25.2	Very low	29.4	Very low	123 Å²	123	130.7 Å²	130.7	83%	0.831	80%	0.804	S	S	*	*			trans	92.8	124.7	166.1	-60.7	0	0	0	0	118.8
13	S	27.1	Very low	29.3	Very low	114 Å²	114	135.4 Å²	135.4	80%	0.797	81%	0.807	S	S	*	*			trans	-105.1	154.5	163	-42.6	0	0	0	0	109.9
14	P	35.5	Very low	29.2	Very low	131 Å²	131	139 Å²	139	85%	0.851	81%	0.808	S	S	*	*			trans	-93	173	145.8	30.9	-22.8	0	0	0	111.3
15	R	26.8	Very low	28.9	Very low	223 Å²	223	138.2 Å²	138.2	84%	0.842	81%	0.809	S	S	*	*			trans	-125.1	171.6	-173	-57.7	172.6	171.1	168.5	-4.5	111.1
16	I	29.8	Very low	28.7	Very low	165 Å²	165	144.2 Å²	144.2	85%	0.846	82%	0.815	S	S	*	*			trans	72.2	139.7	161.9	-59.3	146.5	0	0	0	112.9
17	G	26.4	Very low	28.4	Very low	73 Å²	73	146 Å²	146	75%	0.753	81%	0.813	S	S	*	*			cis	135.7	120.7	-2.9	0	0	0	0	0	111.3
18	G	26.5	Very low	28.3	Very low	84 Å²	84	143.5 Å²	143.5	87%	0.866	81%	0.806	S	S	*	*			trans	-165.2	148.6	-178.4	0	0	0	0	0	110.8
19	N	28.1	Very low	28.4	Very low	154 Å²	154	139.6 Å²	139.6	82%	0.824	81%	0.805	S	S	*	*			trans	-134.9	130.2	-167.4	-165.4	31.8	0	0	0	110.1
20	T	27.7	Very low	27.3	Very low	140 Å²	140	141 Å²	141	86%	0.859	82%	0.817	S	S	*	*			trans	-143.2	148.4	169.1	44.7	0	0	0	0	109.9
21	Q	30.4	Very low	27.3	Very low	180 Å²	180	139 Å²	139	84%	0.841	82%	0.822	S	S	*	*			trans	-107.5	146	179.7	-62.5	175.1	-57.6	0	0	110.6
22	T	26.4	Very low	27.2	Very low	129 Å²	129	145.3 Å²	145.3	79%	0.791	83%	0.833	S	S	*	*			trans	-160.6	127.1	143.5	-0.1	0	0	0	0	113
23	Q	27.1	Very low	27.2	Very low	168 Å²	168	144.3 Å²	144.3	79%	0.785	83%	0.827	S	S	*	*			trans	45.9	118.7	146	-66.4	174.1	5.5	0	0	122.9
24	Q	28.6	Very low	27.1	Very low	171 Å²	171	147.7 Å²	147.7	80%	0.799	83%	0.83	S	S	*	*				45.7	118.4	129	-61.2	-179.1	-12.8	0	0	121.1
25	T	24.9	Very low	26.7	Very low	151 Å²	151	149 Å²	149	93%	0.926	83%	0.825	S	S	*	*				-166.5	171.6	100.2	18.2	0	0	0	0	110.6
26	F	25.6	Very low	26.6	Very low	198 Å²	198	142.2 Å²	142.2	87%	0.868	83%	0.825	S	S	*	*			trans	-133.2	109.3	-165	-165.9	-79.9	0	0	0	111.2
27	I	26.2	Very low	26.4	Very low	165 Å²	165	143 Å²	143	85%	0.846	82%	0.819	S	S	*	*			trans	-136.1	126.4	164.9	-60.9	-178.2	0	0	0	106.9
28	G	26.5	Very low	26.4	Very low	65 Å²	65	143.2 Å²	143.2	67%	0.67	82%	0.821	S	S	*	*			trans	-94.6	146.6	179.8	0	0	0	0	0	112.5
29	T	26.8	Very low	26.4	Very low	138 Å²	138	150.4 Å²	150.4	85%	0.847	82%	0.822	S	S	*	*			trans	-123.8	139.2	168.9	51	0	0	0	0	109.7
30	S	25.2	Very low	26.1	Very low	124 Å²	124	151.5 Å²	151.5	87%	0.867	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-75.6	135.1	-172.9	42.8	0	0	0	0	113.3
31	S	25.9	Very low	26	Very low	126 Å²	126	150.8 Å²	150.8	88%	0.881	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-82.8	120	169.1	-58.8	0	0	0	0	110.2
32	Y	24.2	Very low	25.8	Very low	229 Å²	229	151.8 Å²	151.8	90%	0.898	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-101.2	120	166.3	-161.3	-93.8	0	0	0	109.3
33	S	25.7	Very low	25.8	Very low	102 Å²	102	154 Å²	154	71%	0.713	83%	0.831	S	S	*	*			trans	-98.9	112.8	-174.3	52.2	0	0	0	0	111.9
34	Q	25.2	Very low	25.6	Very low	185 Å²	185	156.8 Å²	156.8	86%	0.864	84%	0.836	S	S	*	*			trans	-76	127.3	163.2	-72.5	179.6	-30.5	0	0	110.2
35	Q	26	Very low	25.4	Very low	158 Å²	158	154.6 Å²	154.6	74%	0.738	84%	0.839	S	S	*	*			trans	-128.4	114.7	158.4	-78.9	-173.8	-55.6	0	0	108.4	Y37	Q35-Y37 HydrophobicContact CB-CE2 4.48Å
36	G	24.9	Very low	25.3	Very low	82 Å²	82	154 Å²	154	85%	0.845	83%	0.83	S	S	*	*			trans	-91.5	141.5	169	0	0	0	0	0	110.4
37	Y	26.7	Very low	25.2	Very low	180 Å²	180	152.3 Å²	152.3	71%	0.706	82%	0.824	S	S	*	*			trans	-115	130.4	171	-80.3	-94.2	0	0	0	109.6	Q35	Q35-Y37 HydrophobicContact CB-CE2 4.48Å
38	G	26.2	Very low	25.1	Very low	78 Å²	78	152.8 Å²	152.8	80%	0.804	82%	0.822	S	S	*	*			trans	-99.1	142.6	157.6	0	0	0	0	0	108.5
39	W	25.4	Very low	25	Very low	235 Å²	235	153.6 Å²	153.6	89%	0.89	83%	0.831	S	S	*	*			trans	-110	128.7	-177.2	-68.9	1.4	0	0	0	110.6
40	E	23.6	Very low	24.9	Very low	178 Å²	178	156 Å²	156	83%	0.832	83%	0.832	S	S	*	*			trans	-101.3	136.8	158.5	-72.8	-177.8	175.2	0	0	107.7
41	S	24.8	Very low	24.8	Very low	124 Å²	124	159.3 Å²	159.3	87%	0.867	83%	0.834	S	S	*	*			trans	-83.5	122.8	-180	-58	0	0	0	0	111.5
42	K	25.3	Very low	24.9	Very low	202 Å²	202	164.3 Å²	164.3	88%	0.878	83%	0.834	S	S	*	*			trans	-140.2	148.8	160.1	-77.7	-162.7	174.5	-177.5	0	111.5
43	L	26.9	Very low	25.4	Very low	176 Å²	176	159.5 Å²	159.5	92%	0.921	83%	0.83	S	S	*	*			trans	-76.5	162.8	-171.4	-64.4	165.9	0	0	0	113
44	Y	23.8	Very low	25.5	Very low	226 Å²	226	159.5 Å²	159.5	89%	0.886	84%	0.837	S	S	*	*			trans	-74	145.3	176.4	-111.7	-100.7	0	0	0	112.5
45	S	23.3	Very low	25.6	Very low	124 Å²	124	156.8 Å²	156.8	87%	0.867	83%	0.828	S	S	*	*			trans	-152.7	152.2	147.5	-168.7	0	0	0	0	108.3
46	L	24.2	Very low	25.8	Very low	140 Å²	140	160.8 Å²	160.8	73%	0.733	84%	0.837	S	S	*	*			trans	-108.2	135.2	-158.6	-175.3	72.9	0	0	0	112.3
47	E	21.7	Very low	26.1	Very low	161 Å²	161	165.8 Å²	165.8	75%	0.752	84%	0.835	S	S	*	*			trans	-174.1	167.4	139.6	-107.6	-72.2	64.9	0	0	113.6
48	H	23.9	Very low	26.3	Very low	175 Å²	175	167.2 Å²	167.2	81%	0.81	85%	0.845	S	S	*	*			trans	-78.4	155.9	-166.8	-71.6	77.8	0	0	0	117.3
49	G	24.9	Very low	26.6	Very low	83 Å²	83	173.6 Å²	173.6	86%	0.856	85%	0.85	S	S	*	*			trans	173.3	125.2	163	0	0	0	0	0	114.2
50	H	24.6	Very low	26.7	Very low	188 Å²	188	168.2 Å²	168.2	87%	0.87	85%	0.849	S	S	*	*			trans	-134.1	110.5	-169.9	-168.8	-77.2	0	0	0	112.7
51	E	23.7	Very low	27.1	Very low	193 Å²	193	168.2 Å²	168.2	90%	0.902	85%	0.853	S	S	*	*			trans	-157	170.2	159.3	-129	-168.6	175.8	0	0	114.1
52	R	28.3	Very low	27.7	Very low	231 Å²	231	165.9 Å²	165.9	87%	0.872	85%	0.849	S	S	*	*			trans	-114.8	159.7	-172.9	-91.4	-172.2	177.7	-171.4	1.5	113.2
53	P	34.6	Very low	28.3	Very low	128 Å²	128	162.9 Å²	162.9	83%	0.831	84%	0.842	S	S	*	*			trans	-86.4	160.3	-162.6	34.3	-38	0	0	0	115.4
54	A	27.7	Very low	28.8	Very low	102 Å²	102	159.3 Å²	159.3	84%	0.843	84%	0.837	S	S	*	*			trans	-125.7	123.1	171.5	0	0	0	0	0	112.3
55	D	27.5	Very low	29.5	Very low	129 Å²	129	155.1 Å²	155.1	69%	0.69	84%	0.836	S	S	*	*			trans	-76.1	136.5	-176	-179.1	15.2	0	0	0	112.9
56	R	29.3	Very low	30.1	Very low	242 Å²	242	155.3 Å²	155.3	91%	0.913	83%	0.826	S	S	*	*			trans	-141.3	84.1	169.5	-78	-162.6	170.3	-178.3	-0.8	113.4	K58	R56-K58 PolarHBondContact O-N 3.09Å
57	K	31.4	Very low	30.6	Very low	186 Å²	186	156.2 Å²	156.2	81%	0.809	82%	0.824	S	S	*	*			trans	-45.9	121.7	165.4	-62.5	171.5	-175.3	172	0	112.8
58	K	32	Very low	31.7	Very low	210 Å²	210	160.3 Å²	160.3	91%	0.913	83%	0.833	S	S	*	*			trans	-128.3	149.9	156.6	-98.2	-175.3	176.8	179.2	0	110.7	R56	R56-K58 PolarHBondContact O-N 3.09Å
59	K	32.7	Very low	32.6	Very low	212 Å²	212	162.7 Å²	162.7	92%	0.922	84%	0.835	S	S	*	*			trans	-89.7	134.3	-165.2	-55.2	167.3	-176.3	174.8	0	111.1
60	S	27.3	Very low	33.2	Very low	122 Å²	122	167.8 Å²	167.8	85%	0.853	83%	0.834	S	S	*	*			trans	-146.2	145.9	148.5	60.7	0	0	0	0	109.1
61	L	31.4	Very low	34.2	Very low	178 Å²	178	164.5 Å²	164.5	93%	0.932	82%	0.821	S	S	*	*			trans	-113.8	141.6	-177.5	-78.5	165.6	0	0	0	109.9
62	G	37.8	Very low	35.1	Very low	75 Å²	75	165 Å²	165	77%	0.773	82%	0.821	S	S	*	*			trans	58	94.9	151.2	0	0	0	0	0	118.7
63	L	36.3	Very low	35.6	Very low	140 Å²	140	164.5 Å²	164.5	73%	0.733	82%	0.819	S	S	*	*			trans	-153.8	37.6	153.7	-115.7	172.7	0	0	0	112.9	T65 L66	L63-T65 VanDerWaalsContact C-N 3.27Å; L63-T65 PolarHBondContact O-N 3.33Å; L63-L66 HydrophobicContact CD2-CB 4.08Å
64	A	37.8	Very low	36	Very low	100 Å²	100	170.3 Å²	170.3	83%	0.826	82%	0.824	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-12.6	-171.3	0	0	0	0	0	115.3
65	T	39.4	Very low	36.8	Very low	138 Å²	138	170 Å²	170	85%	0.847	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	1.7	-170.1	43.9	0	0	0	0	115.5	L63	L63-T65 VanDerWaalsContact C-N 3.27Å; L63-T65 PolarHBondContact O-N 3.33Å
66	L	34.9	Very low	38.1	Very low	128 Å²	128	167.4 Å²	167.4	67%	0.67	80%	0.796	S	S	*	*	S	Bend	trans	-108.7	-5	179.5	-143.7	81.9	0	0	0	115.1	L63 R68	L63-L66 HydrophobicContact CD2-CB 4.08Å; L66-R68 VanDerWaalsContact C-N 3.3Å; L66-R68 PolarHBondContact O-N 2.84Å
67	K	35.9	Very low	39.6	Very low	160 Å²	160	160.3 Å²	160.3	70%	0.696	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-6.3	-171.6	-131.4	-177.7	-175.4	-174.7	0	115.4	R69 I71	K67-R69 PolarHBondContact O-N 2.9Å; K67-I71 HydrophobicContact CD-CD1 4.34Å; K67-I71 HydrophobicContact CG-CD1 4.25Å
68	R	44.2	Very low	41.3	Very low	247 Å²	247	156 Å²	156	93%	0.932	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	4.8	178.9	-102.1	-175.4	-179.5	174	-0.2	115.6	L66	L66-R68 VanDerWaalsContact C-N 3.3Å; L66-R68 PolarHBondContact O-N 2.84Å
69	R	42.2	Very low	43.3	Very low	225 Å²	225	147.3 Å²	147.3	85%	0.849	73%	0.727	S	S	*	*	S	Bend	trans	-124.7	-8.7	178.9	-75.4	-166.3	172.7	-160.5	-2.6	117.4	K67	K67-R69 PolarHBondContact O-N 2.9Å
70	F	38.5	Very low	45.2	Very low	190 Å²	190	139.2 Å²	139.2	83%	0.833	70%	0.7	S	S	*	*	S	Bend	trans	-133.4	43.9	-178.4	-75.6	-75.3	0	0	0	114.5
71	I	46	Very low	48	Very low	118 Å²	118	136.6 Å²	136.6	61%	0.605	68%	0.676	S	S	*	*			trans	-124.7	53.1	158.1	-42.7	-178	0	0	0	110	K67 R73	K67-I71 HydrophobicContact CD-CD1 4.34Å; K67-I71 HydrophobicContact CG-CD1 4.25Å; I71-R73 PolarHBondContact O-N 3.39Å
72	K	42.8	Very low	50.8	Low	205 Å²	205	128.9 Å²	128.9	89%	0.891	64%	0.635	S	S	*	*			trans	-73.2	78.3	150.8	-91.1	-170.4	171.9	-177	0	107.9	R74	K72-R74 PolarHBondContact O-N 3.03Å
73	R	39.1	Very low	53.4	Low	220 Å²	220	125.5 Å²	125.5	83%	0.83	60%	0.6	S	S	*	*			trans	-50.1	125.6	156.5	-164.4	179.8	-169.6	-170.1	2.2	105	I71 K75	I71-R73 PolarHBondContact O-N 3.39Å; R73-K75 PolarHBondContact O-N 3.1Å
74	R	41.5	Very low	56	Low	250 Å²	250	126.4 Å²	126.4	94%	0.943	59%	0.594	S	S	*	*			trans	-69	81.2	-177	-72.7	-176.7	177.8	175.9	-1	109.2	K72 S76	K72-R74 PolarHBondContact O-N 3.03Å; R74-S76 PolarHBondContact O-N 2.82Å
75	K	44.8	Very low	58.6	Low	96 Å²	96	123 Å²	123	42%	0.417	56%	0.56	S	S	.	*			trans	-48.1	134.7	160	-84	-163.7	171.4	-163.9	0	106.4	R73 A80 E603 E604	R73-K75 PolarHBondContact O-N 3.1Å; K75-A80 HydrophobicContact CB-CB 4.34Å; K75-E603 IonicContact NZ-OE2 3.64Å; K75-E603 PolarHBondContact NZ-OE2 3.27Å; K75-E604 IonicContact NZ-OE2 3.54Å
76	S	54.3	Low	61.1	Low	74 Å²	74	116.4 Å²	116.4	52%	0.517	52%	0.52	S	S	.	.			trans	-54.7	147	175.8	61.5	0	0	0	0	109.4	R74 R78 S79 A80	R74-S76 PolarHBondContact O-N 2.82Å; S76-R78 VanDerWaalsContact C-N 3.27Å; S76-R78 PolarHBondContact O-N 2.81Å; S76-S79 PolarHBondContact N-OG 3.2Å; S76-S79 VanDerWaalsContact N-OG 3.14Å; S76-S79 PolarHBondContact O-N 3.13Å; S76-S79 PolarHBondContact O-OG 2.92Å; S76-S79 WeakPolarHBondContact OG-CB 3.44Å; S76-S79 PolarHBondContact OG-N 3.21Å; S76-S79 PolarHBondContact OG-OG 3.2Å; S76-A80 PolarHBondContact O-N 3.44Å
77	S	60.9	Low	63.9	Low	92 Å²	92	115.1 Å²	115.1	64%	0.643	51%	0.506	S	S	*	.	H	α-helix	trans	-50.3	-48.6	-175.7	45.2	0	0	0	0	112	S79 A80 D81	S77-S79 PolarHBondContact O-N 3.39Å; S77-A80 WeakPolarHBondContact O-CB 3.43Å; S77-A80 PolarHBondContact O-N 2.94Å; S77-A80 VanDerWaalsContact O-N 3.13Å; S77-D81 PolarHBondContact O-N 3.34Å
78	R	68.6	Low	66.6	Low	97 Å²	97	112.5 Å²	112.5	37%	0.366	50%	0.496	S	S	.	.	H	α-helix	trans	-54.7	-47.6	174.4	-65.3	-177.3	69.3	-175.2	1.5	113.4	S76 A80 D81 H82 D484	S76-R78 VanDerWaalsContact C-N 3.27Å; S76-R78 PolarHBondContact O-N 2.81Å; R78-A80 VanDerWaalsContact C-N 3.33Å; R78-A80 PolarHBondContact O-N 3.1Å; R78-D81 PolarHBondContact O-N 2.87Å; R78-H82 PolarHBondContact O-CD2 3.24Å; R78-H82 PolarHBondContact O-N 2.74Å; R78-D484 IonicContact NH2-OD1 2.86Å; R78-D484 IonicContact NH2-OD2 2.78Å; R78-D484 PolarHBondContact NH2-OD2 3.32Å
79	S	73.3	Confident	68.8	Low	26 Å²	26	101.5 Å²	101.5	18%	0.182	46%	0.456	C	S	.	.	H	α-helix	trans	-69.2	-30.3	178.9	62.2	0	0	0	0	112.7	S76 S77 D81 A83	S76-S79 PolarHBondContact N-OG 3.2Å; S76-S79 VanDerWaalsContact N-OG 3.14Å; S76-S79 PolarHBondContact O-N 3.13Å; S76-S79 PolarHBondContact O-OG 2.92Å; S76-S79 WeakPolarHBondContact OG-CB 3.44Å; S76-S79 PolarHBondContact OG-N 3.21Å; S76-S79 PolarHBondContact OG-OG 3.2Å; S77-S79 PolarHBondContact O-N 3.39Å; S79-D81 VanDerWaalsContact C-N 3.34Å; S79-A83 WeakPolarHBondContact O-CB 3.21Å; S79-A83 PolarHBondContact O-N 3.47Å
80	A	71.7	Confident	71.2	Confident	43 Å²	43	91 Å²	91	36%	0.355	42%	0.417	S	S	.	.	H	α-helix	trans	-70.1	-29	171.3	0	0	0	0	0	113	K75 S76 S77 R78 R84	K75-A80 HydrophobicContact CB-CB 4.34Å; S76-A80 PolarHBondContact O-N 3.44Å; S77-A80 WeakPolarHBondContact O-CB 3.43Å; S77-A80 PolarHBondContact O-N 2.94Å; S77-A80 VanDerWaalsContact O-N 3.13Å; R78-A80 VanDerWaalsContact C-N 3.33Å; R78-A80 PolarHBondContact O-N 3.1Å; A80-R84 PolarHBondContact O-N 2.8Å
81	D	86.1	Confident	73.6	Confident	66 Å²	66	85.8 Å²	85.8	35%	0.353	40%	0.404	S	S	.	.	H	α-helix	trans	-79.8	-41.2	176	-68.2	-39.7	0	0	0	112.3	S77 R78 S79 A83 R84 Q85	S77-D81 PolarHBondContact O-N 3.34Å; R78-D81 PolarHBondContact O-N 2.87Å; S79-D81 VanDerWaalsContact C-N 3.34Å; D81-A83 VanDerWaalsContact C-N 3.29Å; D81-A83 PolarHBondContact O-N 3Å; D81-R84 WeakPolarHBondContact O-CA 3.41Å; D81-R84 VanDerWaalsContact O-CB 3.29Å; D81-R84 WeakPolarHBondContact O-CB 3.49Å; D81-R84 PolarHBondContact O-N 3.43Å; D81-R84 IonicContact OD1-CZ 3.74Å; D81-R84 IonicContact OD1-NE 3.81Å; D81-R84 IonicContact OD1-NH2 2.7Å; D81-R84 PolarHBondContact OD1-NH2 3.12Å; D81-Q85 WeakPolarHBondContact O-CG 3.23Å; D81-Q85 PolarHBondContact O-N 2.88Å
82	H	90.6	Very high	75.5	Confident	17 Å²	17	84.3 Å²	84.3	8%	0.079	42%	0.417	C	S	.	.	H	α-helix	trans	-59	-42	168.3	-63	-50	0	0	0	111.7	R78 R84 Q85 M86 D484 F598 P600 Y601	R78-H82 PolarHBondContact O-CD2 3.24Å; R78-H82 PolarHBondContact O-N 2.74Å; H82-R84 PolarHBondContact O-N 2.86Å; H82-Q85 PolarHBondContact ND1-OE1 3.41Å; H82-Q85 VanDerWaalsContact ND1-OE1 3.15Å; H82-Q85 WeakPolarHBondContact O-CB 3.14Å; H82-Q85 PolarHBondContact O-N 3.48Å; H82-M86 PolarHBondContact O-N 3.13Å; H82-D484 IonicContact CE1-OD2 2.72Å; H82-F598 HydrophobicContact CB-CE1 4.38Å; H82-F598 AromaticContact CD2-CZ 3.93Å; H82-F598 AromaticContact CG-CE1 3.97Å; H82-P600 HydrophobicContact CB-CB 4.22Å; H82-Y601 HydrophobicContact CB-CD1 4.26Å; H82-Y601 HydrophobicContact CB-CE1 3.77Å
83	A	91.6	Very high	77.8	Confident	3 Å²	3	75.7 Å²	75.7	3%	0.025	38%	0.379	C	S	.	.	H	α-helix	trans	-65.4	-13.4	172.6	0	0	0	0	0	114.4	S79 D81 R87 E604	S79-A83 WeakPolarHBondContact O-CB 3.21Å; S79-A83 PolarHBondContact O-N 3.47Å; D81-A83 VanDerWaalsContact C-N 3.29Å; D81-A83 PolarHBondContact O-N 3Å; A83-R87 PolarHBondContact O-NE 3.24Å; A83-R87 PolarHBondContact O-NH2 2.97Å; A83-E604 HydrophobicContact CB-CG 4.26Å; A83-E604 WeakPolarHBondContact CB-OE2 3.25Å
84	R	92.6	Very high	80.1	Confident	160 Å²	160	67.9 Å²	67.9	60%	0.604	35%	0.354	S	S	*	.	H	α-helix	trans	-89.2	-48	171.2	-164.2	-163.6	-45.4	-150	9.5	110.5	A80 D81 H82 M86 R87 E88	A80-R84 PolarHBondContact O-N 2.8Å; D81-R84 WeakPolarHBondContact O-CA 3.41Å; D81-R84 VanDerWaalsContact O-CB 3.29Å; D81-R84 WeakPolarHBondContact O-CB 3.49Å; D81-R84 PolarHBondContact O-N 3.43Å; D81-R84 IonicContact OD1-CZ 3.74Å; D81-R84 IonicContact OD1-NE 3.81Å; D81-R84 IonicContact OD1-NH2 2.7Å; D81-R84 PolarHBondContact OD1-NH2 3.12Å; H82-R84 PolarHBondContact O-N 2.86Å; R84-M86 VanDerWaalsContact C-N 3.27Å; R84-M86 PolarHBondContact O-N 2.99Å; R84-R87 PolarHBondContact O-N 2.87Å; R84-E88 PolarHBondContact O-N 3.4Å
85	Q	91.6	Very high	82.4	Confident	28 Å²	28	57.1 Å²	57.1	13%	0.131	32%	0.316	C	S	.	.	H	α-helix	trans	-51.3	-45.3	176.1	-70.3	169.5	-14.6	0	0	111.8	D81 H82 E88 L89 L548 Y601	D81-Q85 WeakPolarHBondContact O-CG 3.23Å; D81-Q85 PolarHBondContact O-N 2.88Å; H82-Q85 PolarHBondContact ND1-OE1 3.41Å; H82-Q85 VanDerWaalsContact ND1-OE1 3.15Å; H82-Q85 WeakPolarHBondContact O-CB 3.14Å; H82-Q85 PolarHBondContact O-N 3.48Å; Q85-E88 PolarHBondContact O-N 2.97Å; Q85-L89 PolarHBondContact O-N 3.2Å; Q85-L548 HydrophobicContact CB-CB 4.02Å; Q85-L548 HydrophobicContact CB-CD1 4.32Å; Q85-L548 HydrophobicContact CG-CB 4.42Å; Q85-Y601 HydrophobicContact CB-CE1 4.43Å; Q85-Y601 PolarHBondContact OE1-OH 3.03Å
86	M	93.1	Very high	84.5	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-69.1	-40.6	-178.8	-160.1	62.8	177	0	0	112.8	H82 R84 E88 L89 L90 L101 Y105 L548 W583 Y601 E604 A605	H82-M86 PolarHBondContact O-N 3.13Å; R84-M86 VanDerWaalsContact C-N 3.27Å; R84-M86 PolarHBondContact O-N 2.99Å; M86-E88 VanDerWaalsContact C-N 3.28Å; M86-E88 PolarHBondContact O-N 3.03Å; M86-L89 HydrophobicContact CE-CD2 4.38Å; M86-L89 PolarHBondContact O-N 3.45Å; M86-L89 HydrophobicContact SD-CD2 4.07Å; M86-L90 HydrophobicContact CG-CD1 4.3Å; M86-L90 WeakPolarHBondContact O-CB 3.45Å; M86-L90 WeakPolarHBondContact O-CG 3.42Å; M86-L90 PolarHBondContact O-N 2.88Å; M86-L101 HydrophobicContact CE-CD2 3.63Å; M86-Y105 HydrophobicContact CE-CE2 3.94Å; M86-L548 HydrophobicContact SD-CD1 4.1Å; M86-W583 HydrophobicContact CE-CZ3 4.37Å; M86-Y601 HydrophobicContact CB-CD1 4.03Å; M86-Y601 HydrophobicContact CG-CD1 4.38Å; M86-Y601 HydrophobicContact SD-CD1 4.17Å; M86-Y601 HydrophobicContact SD-CD2 4.46Å; M86-Y601 HydrophobicContact SD-CG 3.94Å; M86-E604 HydrophobicContact CB-CB 4.12Å; M86-E604 HydrophobicContact CB-CG 4.1Å; M86-E604 HydrophobicContact CG-CB 4.25Å; M86-A605 HydrophobicContact CE-CB 3.98Å
87	R	93.4	Very high	86.2	Confident	101 Å²	101	60.5 Å²	60.5	38%	0.381	32%	0.319	S	S	.	.	H	α-helix	trans	-63.7	-33.1	172.4	-104.3	-176.2	-71	-98.4	-21.4	112.6	A83 R84 S91 E604 V608	A83-R87 PolarHBondContact O-NE 3.24Å; A83-R87 PolarHBondContact O-NH2 2.97Å; R84-R87 PolarHBondContact O-N 2.87Å; R87-S91 PolarHBondContact O-N 3.27Å; R87-S91 VanDerWaalsContact O-N 3.12Å; R87-E604 IonicContact CZ-OE1 2.98Å; R87-E604 IonicContact CZ-OE2 3.59Å; R87-E604 IonicContact NE-OE1 2.71Å; R87-E604 IonicContact NH1-OE1 3.63Å; R87-E604 PolarHBondContact NH1-OE1 2.7Å; R87-E604 IonicContact NH1-OE2 2.74Å; R87-E604 IonicContact NH2-OE1 3.29Å; R87-E604 PolarHBondContact NH2-OE1 3.15Å; R87-E604 IonicContact NH2-OE2 3.64Å; R87-E604 PolarHBondContact NH2-OE2 3.42Å; R87-V608 HydrophobicContact CG-CG2 3.49Å; R87-V608 VanDerWaalsContact CG-CG2 3.49Å
88	E	92	Very high	87.6	Confident	104 Å²	104	56.1 Å²	56.1	49%	0.486	29%	0.288	S	S	.	.	H	α-helix	trans	-72.2	-40.6	175.7	-168.9	178.8	159.1	0	0	111.8	R84 Q85 M86 S91	R84-E88 PolarHBondContact O-N 3.4Å; Q85-E88 PolarHBondContact O-N 2.97Å; M86-E88 VanDerWaalsContact C-N 3.28Å; M86-E88 PolarHBondContact O-N 3.03Å; E88-S91 WeakPolarHBondContact O-CB 3.41Å; E88-S91 PolarHBondContact O-N 3.32Å; E88-S91 PolarHBondContact O-OG 3.15Å
89	L	90.4	Very high	88.7	Confident	16 Å²	16	54 Å²	54	8%	0.084	28%	0.284	C	S	.	.	H	α-helix	trans	-57.9	-50.6	172.2	173.5	64.4	0	0	0	111.4	Q85 M86 S91 W93 L548 W583	Q85-L89 PolarHBondContact O-N 3.2Å; M86-L89 HydrophobicContact CE-CD2 4.38Å; M86-L89 PolarHBondContact O-N 3.45Å; M86-L89 HydrophobicContact SD-CD2 4.07Å; L89-S91 PolarHBondContact O-N 3.22Å; L89-W93 HydrophobicContact CD1-CZ2 4.18Å; L89-W93 HydrophobicContact CD2-CZ2 4.46Å; L89-W93 HydrophobicContact CG-CZ2 4.1Å; L89-W93 VanDerWaalsContact O-CD1 3.28Å; L89-W93 PolarHBondContact O-NE1 2.95Å; L89-L548 HydrophobicContact CB-CD1 4.18Å; L89-L548 HydrophobicContact CB-CD2 4.15Å; L89-L548 HydrophobicContact CD1-CD2 4.25Å; L89-L548 HydrophobicContact CD2-CD1 4.04Å; L89-L548 HydrophobicContact CD2-CD2 4.23Å; L89-L548 HydrophobicContact CG-CD2 4.43Å; L89-W583 HydrophobicContact CD2-CD2 3.84Å; L89-W583 HydrophobicContact CD2-CE3 4.11Å; L89-W583 HydrophobicContact CD2-CG 4.47Å; L89-W583 HydrophobicContact CD2-CH2 3.91Å; L89-W583 HydrophobicContact CD2-CZ2 3.61Å; L89-W583 HydrophobicContact CD2-CZ3 4.15Å
90	L	91.6	Very high	89.5	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.031	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-6	-177.6	-65.2	174.4	0	0	0	113.6	M86 G92 W93 T98 L101 A605 V608	M86-L90 HydrophobicContact CG-CD1 4.3Å; M86-L90 WeakPolarHBondContact O-CB 3.45Å; M86-L90 WeakPolarHBondContact O-CG 3.42Å; M86-L90 PolarHBondContact O-N 2.88Å; L90-G92 PolarHBondContact O-N 3.32Å; L90-G92 VanDerWaalsContact O-N 3.15Å; L90-W93 HydrophobicContact CD2-CD2 3.68Å; L90-W93 HydrophobicContact CD2-CE3 3.63Å; L90-W93 HydrophobicContact CD2-CG 4.18Å; L90-W93 HydrophobicContact CD2-CH2 4.22Å; L90-W93 HydrophobicContact CD2-CZ2 4.24Å; L90-W93 HydrophobicContact CD2-CZ3 3.93Å; L90-W93 WeakPolarHBondContact O-CB 3.17Å; L90-W93 PolarHBondContact O-N 3.21Å; L90-W93 VanDerWaalsContact O-N 3.08Å; L90-T98 HydrophobicContact CD1-CG2 4.32Å; L90-T98 HydrophobicContact CD2-CG2 4.39Å; L90-L101 HydrophobicContact CD2-CD2 4Å; L90-A605 HydrophobicContact CD1-CB 4.27Å; L90-V608 HydrophobicContact CB-CG1 4.28Å; L90-V608 HydrophobicContact CD1-CB 4.02Å; L90-V608 HydrophobicContact CD1-CG1 4.01Å; L90-V608 HydrophobicContact CD1-CG2 4.26Å
91	S	89.9	Confident	90.4	Very high	80 Å²	80	52.3 Å²	52.3	56%	0.559	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	118.1	179.3	69.6	0	0	0	0	111	R87 E88 L89	R87-S91 PolarHBondContact O-N 3.27Å; R87-S91 VanDerWaalsContact O-N 3.12Å; E88-S91 WeakPolarHBondContact O-CB 3.41Å; E88-S91 PolarHBondContact O-N 3.32Å; E88-S91 PolarHBondContact O-OG 3.15Å; L89-S91 PolarHBondContact O-N 3.22Å
92	G	85.8	Confident	90.7	Very high	86 Å²	86	49.5 Å²	49.5	89%	0.887	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	7.3	-176.2	0	0	0	0	0	115.9	L90	L90-G92 PolarHBondContact O-N 3.32Å; L90-G92 VanDerWaalsContact O-N 3.15Å
93	W	90.4	Very high	90.6	Very high	25 Å²	25	53.6 Å²	53.6	10%	0.095	28%	0.277	C	S	.	.			trans	-72.5	157.9	166.9	-72.3	42.8	0	0	0	110.7	L89 L90 D97 L101 A580 W583 L584 M612	L89-W93 HydrophobicContact CD1-CZ2 4.18Å; L89-W93 HydrophobicContact CD2-CZ2 4.46Å; L89-W93 HydrophobicContact CG-CZ2 4.1Å; L89-W93 VanDerWaalsContact O-CD1 3.28Å; L89-W93 PolarHBondContact O-NE1 2.95Å; L90-W93 HydrophobicContact CD2-CD2 3.68Å; L90-W93 HydrophobicContact CD2-CE3 3.63Å; L90-W93 HydrophobicContact CD2-CG 4.18Å; L90-W93 HydrophobicContact CD2-CH2 4.22Å; L90-W93 HydrophobicContact CD2-CZ2 4.24Å; L90-W93 HydrophobicContact CD2-CZ3 3.93Å; L90-W93 WeakPolarHBondContact O-CB 3.17Å; L90-W93 PolarHBondContact O-N 3.21Å; L90-W93 VanDerWaalsContact O-N 3.08Å; W93-D97 HydrophobicContact CD2-CB 4.44Å; W93-D97 HydrophobicContact CE3-CB 3.68Å; W93-D97 HydrophobicContact CZ3-CB 4.32Å; W93-L101 HydrophobicContact CH2-CD2 4.14Å; W93-L101 HydrophobicContact CZ3-CB 4.29Å; W93-L101 HydrophobicContact CZ3-CD2 4.13Å; W93-A580 HydrophobicContact CD2-CB 4.19Å; W93-A580 HydrophobicContact CE3-CB 4.21Å; W93-A580 HydrophobicContact CH2-CB 3.82Å; W93-A580 HydrophobicContact CZ2-CB 3.79Å; W93-A580 HydrophobicContact CZ3-CB 4.02Å; W93-W583 HydrophobicContact CH2-CB 3.99Å; W93-W583 HydrophobicContact CH2-CG 4.49Å; W93-L584 HydrophobicContact CH2-CG 4.44Å; W93-L584 HydrophobicContact CZ3-CD1 4.04Å; W93-L584 HydrophobicContact CZ3-CD2 4.32Å; W93-L584 HydrophobicContact CZ3-CG 4.12Å; W93-M612 VanDerWaalsContact O-CE 3.28Å; W93-M612 WeakPolarHBondContact O-CE 3.37Å
94	D	88.4	Confident	90.5	Very high	55 Å²	55	54.7 Å²	54.7	29%	0.294	28%	0.282	S	S	.	.			trans	-89.9	163.3	169.8	102.5	11.5	0	0	0	111.9	R96 D97 T98	D94-R96 PolarHBondContact O-N 2.64Å; D94-R96 WeakPolarHBondContact OD1-CA 3.39Å; D94-R96 WeakPolarHBondContact OD1-CB 3.25Å; D94-R96 PolarHBondContact OD1-N 3.12Å; D94-R96 IonicContact OD1-NE 3.28Å; D94-R96 PolarHBondContact OD1-NE 3.48Å; D94-R96 IonicContact OD2-CZ 2.92Å; D94-R96 IonicContact OD2-NE 3.81Å; D94-R96 PolarHBondContact OD2-NE 3.28Å; D94-R96 IonicContact OD2-NH2 3.51Å; D94-R96 PolarHBondContact OD2-NH2 2.98Å; D94-D97 PolarHBondContact O-N 3.29Å; D94-D97 PolarHBondContact OD1-N 3.07Å; D94-D97 VanDerWaalsContact OD1-N 3.11Å; D94-T98 PolarHBondContact O-N 3.42Å; D94-T98 PolarHBondContact O-OG1 3.27Å
95	V	89.6	Confident	90.5	Very high	24 Å²	24	47.3 Å²	47.3	15%	0.145	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-29.3	-174.4	-174.3	0	0	0	0	112.6	N99 L609 M612 M613 Q616	V95-N99 WeakPolarHBondContact O-CB 3.17Å; V95-N99 PolarHBondContact O-N 2.83Å; V95-L609 HydrophobicContact CG1-CD1 4.03Å; V95-M612 HydrophobicContact CG2-CB 4.01Å; V95-M612 HydrophobicContact CG2-CE 4.03Å; V95-M613 HydrophobicContact CG1-CG 4.31Å; V95-Q616 HydrophobicContact CG2-CG 4.33Å; V95-Q616 VanDerWaalsContact CG2-NE2 3.26Å
96	R	88.6	Confident	90.5	Very high	186 Å²	186	48.5 Å²	48.5	70%	0.702	26%	0.259	S	S	*	.	H	α-helix	trans	-75.8	-41	179.7	-50.9	171.1	-68.1	175.8	2.1	110.8	D94 N99 A100	D94-R96 PolarHBondContact O-N 2.64Å; D94-R96 WeakPolarHBondContact OD1-CA 3.39Å; D94-R96 WeakPolarHBondContact OD1-CB 3.25Å; D94-R96 PolarHBondContact OD1-N 3.12Å; D94-R96 IonicContact OD1-NE 3.28Å; D94-R96 PolarHBondContact OD1-NE 3.48Å; D94-R96 IonicContact OD2-CZ 2.92Å; D94-R96 IonicContact OD2-NE 3.81Å; D94-R96 PolarHBondContact OD2-NE 3.28Å; D94-R96 IonicContact OD2-NH2 3.51Å; D94-R96 PolarHBondContact OD2-NH2 2.98Å; R96-N99 PolarHBondContact O-N 3.36Å; R96-A100 VanDerWaalsContact O-CB 3.31Å; R96-A100 WeakPolarHBondContact O-CB 3.18Å; R96-A100 PolarHBondContact O-N 3.4Å
97	D	89.5	Confident	90.4	Very high	56 Å²	56	48.6 Å²	48.6	30%	0.299	26%	0.26	S	S	.	.	H	α-helix	trans	-65.9	-43.1	175.6	-71.9	-26.9	0	0	0	110.8	W93 D94 A100 L101 L584	W93-D97 HydrophobicContact CD2-CB 4.44Å; W93-D97 HydrophobicContact CE3-CB 3.68Å; W93-D97 HydrophobicContact CZ3-CB 4.32Å; D94-D97 PolarHBondContact O-N 3.29Å; D94-D97 PolarHBondContact OD1-N 3.07Å; D94-D97 VanDerWaalsContact OD1-N 3.11Å; D97-A100 PolarHBondContact O-N 3.38Å; D97-L101 PolarHBondContact O-N 3.32Å; D97-L101 VanDerWaalsContact O-N 3.15Å; D97-L584 HydrophobicContact CB-CD1 3.74Å
98	T	91.4	Very high	90.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-65.1	-40.2	173.8	-55.6	0	0	0	0	111.7	L90 D94 L101 A102 V608 L609 M612	L90-T98 HydrophobicContact CD1-CG2 4.32Å; L90-T98 HydrophobicContact CD2-CG2 4.39Å; D94-T98 PolarHBondContact O-N 3.42Å; D94-T98 PolarHBondContact O-OG1 3.27Å; T98-L101 PolarHBondContact O-N 2.98Å; T98-A102 PolarHBondContact O-N 3.3Å; T98-V608 HydrophobicContact CG2-CG1 4.35Å; T98-L609 HydrophobicContact CG2-CB 4.03Å; T98-L609 HydrophobicContact CG2-CD1 4.31Å; T98-M612 HydrophobicContact CG2-SD 4.09Å
99	N	90.9	Very high	90.4	Very high	52 Å²	52	40.9 Å²	40.9	28%	0.278	24%	0.236	S	C	.	.	H	α-helix	trans	-63.6	-45.3	175.3	-176.9	86.2	0	0	0	111.9	V95 R96 L101 A102 E103 L609	V95-N99 WeakPolarHBondContact O-CB 3.17Å; V95-N99 PolarHBondContact O-N 2.83Å; R96-N99 PolarHBondContact O-N 3.36Å; N99-L101 PolarHBondContact O-N 3.28Å; N99-A102 CarbonylContact O-C 3.55Å; N99-A102 WeakPolarHBondContact O-CA 3.34Å; N99-A102 WeakPolarHBondContact O-CB 3.4Å; N99-A102 PolarHBondContact O-N 3.28Å; N99-E103 PolarHBondContact ND2-OE1 2.86Å; N99-E103 PolarHBondContact ND2-OE2 2.97Å; N99-E103 WeakPolarHBondContact O-CG 3.38Å; N99-E103 PolarHBondContact O-N 2.93Å; N99-L609 HydrophobicContact CB-CD1 3.92Å; N99-L609 HydrophobicContact CB-CD2 4.28Å
100	A	89.5	Confident	90.5	Very high	34 Å²	34	40.9 Å²	40.9	28%	0.281	24%	0.239	S	C	.	.	H	α-helix	trans	-61.6	-32.5	177.8	0	0	0	0	0	112.5	R96 D97 E104 L584	R96-A100 VanDerWaalsContact O-CB 3.31Å; R96-A100 WeakPolarHBondContact O-CB 3.18Å; R96-A100 PolarHBondContact O-N 3.4Å; D97-A100 PolarHBondContact O-N 3.38Å; A100-E104 PolarHBondContact O-N 3.12Å; A100-L584 HydrophobicContact CB-CD1 4.46Å; A100-L584 HydrophobicContact CB-CD2 3.89Å
101	L	91.1	Very high	90.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.2	-41.4	171.8	-175.1	60.7	0	0	0	111.9	M86 L90 W93 D97 T98 N99 E103 E104 Y105 W583 L584 P595	M86-L101 HydrophobicContact CE-CD2 3.63Å; L90-L101 HydrophobicContact CD2-CD2 4Å; W93-L101 HydrophobicContact CH2-CD2 4.14Å; W93-L101 HydrophobicContact CZ3-CB 4.29Å; W93-L101 HydrophobicContact CZ3-CD2 4.13Å; D97-L101 PolarHBondContact O-N 3.32Å; D97-L101 VanDerWaalsContact O-N 3.15Å; T98-L101 PolarHBondContact O-N 2.98Å; N99-L101 PolarHBondContact O-N 3.28Å; L101-E103 VanDerWaalsContact C-N 3.3Å; L101-E103 PolarHBondContact O-N 3.2Å; L101-E104 PolarHBondContact O-N 3.44Å; L101-Y105 HydrophobicContact CD1-CD2 4.29Å; L101-Y105 HydrophobicContact CD1-CE2 3.91Å; L101-Y105 HydrophobicContact CD2-CE2 4.16Å; L101-Y105 HydrophobicContact CG-CD2 4.02Å; L101-Y105 HydrophobicContact CG-CE2 3.73Å; L101-Y105 VanDerWaalsContact O-CD2 3.27Å; L101-Y105 WeakPolarHBondContact O-CD2 3.42Å; L101-Y105 PolarHBondContact O-N 3.47Å; L101-W583 HydrophobicContact CD1-CB 4.44Å; L101-W583 HydrophobicContact CD1-CE3 4.23Å; L101-L584 HydrophobicContact CB-CD2 3.88Å; L101-P595 HydrophobicContact CD1-CG 4.12Å
102	A	92.2	Very high	90.7	Very high	7 Å²	7	38.5 Å²	38.5	6%	0.058	22%	0.218	C	C	.	.	H	α-helix	trans	-64.8	-33.3	174.9	0	0	0	0	0	112.6	T98 N99 E106 K606 L609	T98-A102 PolarHBondContact O-N 3.3Å; N99-A102 CarbonylContact O-C 3.55Å; N99-A102 WeakPolarHBondContact O-CA 3.34Å; N99-A102 WeakPolarHBondContact O-CB 3.4Å; N99-A102 PolarHBondContact O-N 3.28Å; A102-E106 WeakPolarHBondContact O-CA 3.21Å; A102-E106 PolarHBondContact O-N 3.24Å; A102-K606 HydrophobicContact CB-CG 4.33Å; A102-L609 HydrophobicContact CB-CD2 3.75Å
103	E	89.8	Confident	91	Very high	103 Å²	103	37.9 Å²	37.9	48%	0.481	19%	0.192	S	C	.	.	H	α-helix	trans	-70.9	-43.3	173.7	-74.9	173.9	171.3	0	0	112.7	N99 L101 Y105 E106 G107	N99-E103 PolarHBondContact ND2-OE1 2.86Å; N99-E103 PolarHBondContact ND2-OE2 2.97Å; N99-E103 WeakPolarHBondContact O-CG 3.38Å; N99-E103 PolarHBondContact O-N 2.93Å; L101-E103 VanDerWaalsContact C-N 3.3Å; L101-E103 PolarHBondContact O-N 3.2Å; E103-Y105 VanDerWaalsContact C-N 3.35Å; E103-E106 CarbonylContact O-C 3.03Å; E103-E106 WeakPolarHBondContact O-CA 3.5Å; E103-E106 PolarHBondContact O-N 3.03Å; E103-G107 PolarHBondContact O-N 2.97Å
104	E	88.9	Confident	91.2	Very high	26 Å²	26	37 Å²	37	12%	0.121	19%	0.189	C	C	.	.	H	α-helix	trans	-67.2	-35.4	175.5	-175.9	81.5	-134.4	0	0	111	A100 L101 T108 R585 Y592 R594	A100-E104 PolarHBondContact O-N 3.12Å; L101-E104 PolarHBondContact O-N 3.44Å; E104-T108 VanDerWaalsContact O-CB 3.31Å; E104-T108 WeakPolarHBondContact O-CB 3.26Å; E104-T108 PolarHBondContact O-N 3.04Å; E104-T108 PolarHBondContact O-OG1 2.9Å; E104-R585 VanDerWaalsContact CD-NH2 3.33Å; E104-R585 IonicContact OE1-CZ 2.85Å; E104-R585 IonicContact OE1-NE 3.9Å; E104-R585 IonicContact OE1-NH2 2.69Å; E104-R585 PolarHBondContact OE1-NH2 3.49Å; E104-R585 IonicContact OE2-CZ 3.8Å; E104-R585 IonicContact OE2-NE 2.75Å; E104-R585 PolarHBondContact OE2-NE 3.23Å; E104-R585 IonicContact OE2-NH2 3.74Å; E104-R585 PolarHBondContact OE2-NH2 2.93Å; E104-R585 VanDerWaalsContact OE2-NH2 3.13Å; E104-Y592 WeakPolarHBondContact CG-OH 3.49Å; E104-R594 HydrophobicContact CG-CG 4.46Å; E104-R594 VanDerWaalsContact OE1-CD 3.31Å; E104-R594 WeakPolarHBondContact OE1-CD 3.3Å
105	Y	93.1	Very high	91.5	Very high	4 Å²	4	35 Å²	35	2%	0.016	18%	0.18	C	C	.	.	H	α-helix	trans	-66.3	-43.3	167.9	-75.4	-44.5	0	0	0	112.7	M86 L101 E103 T108 A109 P595 R596 L597 V602 A605	M86-Y105 HydrophobicContact CE-CE2 3.94Å; L101-Y105 HydrophobicContact CD1-CD2 4.29Å; L101-Y105 HydrophobicContact CD1-CE2 3.91Å; L101-Y105 HydrophobicContact CD2-CE2 4.16Å; L101-Y105 HydrophobicContact CG-CD2 4.02Å; L101-Y105 HydrophobicContact CG-CE2 3.73Å; L101-Y105 VanDerWaalsContact O-CD2 3.27Å; L101-Y105 WeakPolarHBondContact O-CD2 3.42Å; L101-Y105 PolarHBondContact O-N 3.47Å; E103-Y105 VanDerWaalsContact C-N 3.35Å; Y105-T108 PolarHBondContact O-N 3.46Å; Y105-A109 WeakPolarHBondContact O-CB 3.42Å; Y105-A109 PolarHBondContact O-N 2.96Å; Y105-P595 HydrophobicContact CE1-CB 3.89Å; Y105-R596 WeakPolarHBondContact CE1-O 3.47Å; Y105-L597 HydrophobicContact CD1-CD1 4.31Å; Y105-V602 HydrophobicContact CD1-CG2 3.74Å; Y105-V602 HydrophobicContact CD2-CG2 4.26Å; Y105-V602 HydrophobicContact CE1-CG2 4.01Å; Y105-V602 HydrophobicContact CE2-CG2 4.5Å; Y105-V602 HydrophobicContact CG-CG1 4.4Å; Y105-V602 HydrophobicContact CG-CG2 3.87Å; Y105-A605 HydrophobicContact CD2-CB 4.24Å; Y105-A605 HydrophobicContact CE2-CB 4.05Å
106	E	91.9	Very high	91.7	Very high	53 Å²	53	36.6 Å²	36.6	25%	0.248	18%	0.184	C	C	.	.	H	α-helix	trans	-28.4	-73.6	157.6	164.9	-157.3	-166.8	0	0	114.6	A102 E103 T108 A109 A110 K606 R694 L698	A102-E106 WeakPolarHBondContact O-CA 3.21Å; A102-E106 PolarHBondContact O-N 3.24Å; E103-E106 CarbonylContact O-C 3.03Å; E103-E106 WeakPolarHBondContact O-CA 3.5Å; E103-E106 PolarHBondContact O-N 3.03Å; E106-T108 VanDerWaalsContact C-N 3.32Å; E106-T108 PolarHBondContact O-N 3.05Å; E106-A109 PolarHBondContact O-N 3.15Å; E106-A110 PolarHBondContact O-N 3.3Å; E106-K606 IonicContact OE2-NZ 2.97Å; E106-K606 PolarHBondContact OE2-NZ 2.91Å; E106-R694 IonicContact OE1-CZ 2.78Å; E106-R694 IonicContact OE1-NE 3.79Å; E106-R694 IonicContact OE1-NH2 3.29Å; E106-R694 PolarHBondContact OE1-NH2 3.1Å; E106-L698 HydrophobicContact CG-CD1 3.65Å; E106-L698 HydrophobicContact CG-CD2 3.92Å; E106-L698 HydrophobicContact CG-CG 4.47Å
107	G	90.2	Very high	92	Very high	2 Å²	2	30.2 Å²	30.2	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-66.3	-32.6	-176.8	0	0	0	0	0	113.3	E103 A110 L111 C700	E103-G107 PolarHBondContact O-N 2.97Å; G107-A110 PolarHBondContact O-N 3Å; G107-L111 WeakPolarHBondContact O-CB 3.41Å; G107-L111 PolarHBondContact O-N 3.44Å; G107-C700 VanDerWaalsContact C-SG 3.51Å; G107-C700 WeakPolarHBondContact CA-SG 3.45Å; G107-C700 PolarHBondContact O-SG 3.49Å
108	T	91.4	Very high	92.3	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.006	15%	0.148	C	C	.	.	H	α-helix	trans	-69	-35.3	175.2	-54.1	0	0	0	0	111.7	E104 Y105 E106 L111 K112 D476 Y477 R594 L597	E104-T108 VanDerWaalsContact O-CB 3.31Å; E104-T108 WeakPolarHBondContact O-CB 3.26Å; E104-T108 PolarHBondContact O-N 3.04Å; E104-T108 PolarHBondContact O-OG1 2.9Å; Y105-T108 PolarHBondContact O-N 3.46Å; E106-T108 VanDerWaalsContact C-N 3.32Å; E106-T108 PolarHBondContact O-N 3.05Å; T108-L111 PolarHBondContact O-N 3.45Å; T108-K112 PolarHBondContact O-N 2.91Å; T108-D476 HydrophobicContact CG2-CB 4.49Å; T108-Y477 HydrophobicContact CG2-CD1 4.5Å; T108-Y477 HydrophobicContact CG2-CE1 4.15Å; T108-R594 WeakPolarHBondContact OG1-CD 3.29Å; T108-L597 HydrophobicContact CG2-CB 4Å; T108-L597 HydrophobicContact CG2-CD1 4.25Å
109	A	93	Very high	92.5	Very high	43 Å²	43	28.7 Å²	28.7	36%	0.355	16%	0.156	S	C	.	.	H	α-helix	trans	-68.6	-41.1	172.3	0	0	0	0	0	112.1	Y105 E106 L111 K112 E113 L597	Y105-A109 WeakPolarHBondContact O-CB 3.42Å; Y105-A109 PolarHBondContact O-N 2.96Å; E106-A109 PolarHBondContact O-N 3.15Å; A109-L111 VanDerWaalsContact C-N 3.32Å; A109-L111 PolarHBondContact O-N 3.4Å; A109-K112 WeakPolarHBondContact O-CB 3.39Å; A109-K112 PolarHBondContact O-N 3.05Å; A109-E113 PolarHBondContact O-N 2.8Å; A109-E113 VanDerWaalsContact O-N 3.13Å; A109-L597 HydrophobicContact CB-CD1 4.08Å; A109-L597 HydrophobicContact CB-CD2 4.1Å
110	A	92.9	Very high	92.7	Very high	16 Å²	16	29.4 Å²	29.4	13%	0.132	16%	0.16	C	C	.	.	H	α-helix	trans	-62	-39.7	173.7	0	0	0	0	0	112.1	E106 G107 E113 L114 A695 L698	E106-A110 PolarHBondContact O-N 3.3Å; G107-A110 PolarHBondContact O-N 3Å; A110-E113 PolarHBondContact O-N 2.96Å; A110-L114 PolarHBondContact O-N 3.16Å; A110-A695 HydrophobicContact CB-CB 4.22Å; A110-L698 HydrophobicContact CB-CD1 3.9Å
111	L	92.2	Very high	93	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-70.6	-37.3	175.7	-169.5	71.9	0	0	0	112.6	G107 T108 A109 E113 L114 S115 Y477 T705 V706 E709	G107-L111 WeakPolarHBondContact O-CB 3.41Å; G107-L111 PolarHBondContact O-N 3.44Å; T108-L111 PolarHBondContact O-N 3.45Å; A109-L111 VanDerWaalsContact C-N 3.32Å; A109-L111 PolarHBondContact O-N 3.4Å; L111-E113 VanDerWaalsContact C-N 3.29Å; L111-E113 PolarHBondContact O-N 2.97Å; L111-L114 PolarHBondContact O-N 3.37Å; L111-S115 PolarHBondContact O-N 3.15Å; L111-S115 PolarHBondContact O-OG 3.42Å; L111-Y477 WeakPolarHBondContact CG-OH 3.48Å; L111-T705 HydrophobicContact CD1-CG2 4.05Å; L111-T705 HydrophobicContact CD2-CG2 3.74Å; L111-V706 HydrophobicContact CD1-CG2 4.33Å; L111-E709 HydrophobicContact CD1-CG 3.99Å
112	K	93.4	Very high	93.2	Very high	34 Å²	34	31.1 Å²	31.1	15%	0.148	16%	0.161	C	C	.	.	H	α-helix	trans	-53.1	-50.7	171.5	-179.3	177.6	167.8	176.5	0	110.1	T108 A109 L114 S115 F116 E450 Y477 L597	T108-K112 PolarHBondContact O-N 2.91Å; A109-K112 WeakPolarHBondContact O-CB 3.39Å; A109-K112 PolarHBondContact O-N 3.05Å; K112-L114 PolarHBondContact O-N 2.74Å; K112-S115 PolarHBondContact O-N 2.86Å; K112-S115 PolarHBondContact O-OG 3.22Å; K112-F116 WeakPolarHBondContact O-CB 3.39Å; K112-F116 PolarHBondContact O-N 3.4Å; K112-E450 IonicContact NZ-OE1 3.82Å; K112-E450 PolarHBondContact NZ-OE1 3.06Å; K112-E450 IonicContact NZ-OE2 2.83Å; K112-E450 PolarHBondContact NZ-OE2 3.15Å; K112-Y477 HydrophobicContact CB-CD1 3.59Å; K112-Y477 HydrophobicContact CB-CE1 3.57Å; K112-Y477 HydrophobicContact CB-CG 4.11Å; K112-Y477 HydrophobicContact CD-CD1 4.14Å; K112-Y477 HydrophobicContact CD-CG 4.11Å; K112-Y477 HydrophobicContact CG-CD1 3.84Å; K112-Y477 HydrophobicContact CG-CD2 4.23Å; K112-Y477 HydrophobicContact CG-CE1 4.23Å; K112-Y477 HydrophobicContact CG-CG 3.84Å; K112-L597 HydrophobicContact CB-CD2 4.1Å; K112-L597 HydrophobicContact CD-CD2 3.79Å
113	E	93.5	Very high	93.2	Very high	73 Å²	73	32.4 Å²	32.4	34%	0.341	17%	0.172	S	C	.	.	H	α-helix	trans	-56.7	-48.9	179.3	-133.4	-34.5	-82.8	0	0	111.2	A109 A110 L111 S115 F116 Q117 Q691	A109-E113 PolarHBondContact O-N 2.8Å; A109-E113 VanDerWaalsContact O-N 3.13Å; A110-E113 PolarHBondContact O-N 2.96Å; L111-E113 VanDerWaalsContact C-N 3.29Å; L111-E113 PolarHBondContact O-N 2.97Å; E113-S115 PolarHBondContact O-N 2.71Å; E113-F116 WeakPolarHBondContact O-CB 3.16Å; E113-F116 PolarHBondContact O-N 2.86Å; E113-F116 VanDerWaalsContact O-N 3.13Å; E113-Q117 WeakPolarHBondContact O-CG 3.25Å; E113-Q117 PolarHBondContact O-N 2.86Å; E113-Q117 WeakPolarHBondContact OE1-CG 3.49Å; E113-Q117 PolarHBondContact OE1-NE2 3.46Å; E113-Q691 PolarHBondContact OE1-NE2 2.95Å
114	L	94.2	Very high	93.3	Very high	8 Å²	8	34.3 Å²	34.3	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-61.6	-40.3	177.7	-66.6	-178.5	0	0	0	113.2	A110 L111 K112 F116 Q117 A118 Q691 V692 A695 V706 E709	A110-L114 PolarHBondContact O-N 3.16Å; L111-L114 PolarHBondContact O-N 3.37Å; K112-L114 PolarHBondContact O-N 2.74Å; L114-F116 VanDerWaalsContact C-N 3.3Å; L114-F116 PolarHBondContact O-N 3.32Å; L114-Q117 PolarHBondContact O-N 2.7Å; L114-A118 WeakPolarHBondContact O-CB 3.06Å; L114-A118 PolarHBondContact O-N 2.69Å; L114-Q691 HydrophobicContact CD2-CG 3.89Å; L114-V692 HydrophobicContact CD1-CG2 4.42Å; L114-V692 HydrophobicContact CD2-CG2 3.59Å; L114-A695 HydrophobicContact CD1-CB 3.57Å; L114-V706 HydrophobicContact CD1-CG1 3.78Å; L114-E709 HydrophobicContact CB-CB 4.3Å
115	S	93.8	Very high	93.5	Very high	13 Å²	13	33.6 Å²	33.6	9%	0.091	18%	0.179	C	C	.	.	H	α-helix	trans	-69.8	-26.9	176.4	71.2	0	0	0	0	113.1	L111 K112 E113 S119 Y477 E709	L111-S115 PolarHBondContact O-N 3.15Å; L111-S115 PolarHBondContact O-OG 3.42Å; K112-S115 PolarHBondContact O-N 2.86Å; K112-S115 PolarHBondContact O-OG 3.22Å; E113-S115 PolarHBondContact O-N 2.71Å; S115-S119 VanDerWaalsContact O-CB 3.31Å; S115-S119 WeakPolarHBondContact O-CB 3.44Å; S115-S119 PolarHBondContact O-N 3.33Å; S115-S119 PolarHBondContact O-OG 3.28Å; S115-Y477 WeakPolarHBondContact OG-CE2 3.43Å; S115-E709 WeakPolarHBondContact CA-OE2 3.2Å; S115-E709 WeakPolarHBondContact CB-OE2 3.41Å
116	F	94.6	Very high	93.6	Very high	56 Å²	56	35.2 Å²	35.2	25%	0.246	19%	0.19	C	C	.	.	H	α-helix	trans	-72.9	-46.1	172.5	-179.4	-116.7	0	0	0	110.9	K112 E113 L114 A118 S119 L120 H446	K112-F116 WeakPolarHBondContact O-CB 3.39Å; K112-F116 PolarHBondContact O-N 3.4Å; E113-F116 WeakPolarHBondContact O-CB 3.16Å; E113-F116 PolarHBondContact O-N 2.86Å; E113-F116 VanDerWaalsContact O-N 3.13Å; L114-F116 VanDerWaalsContact C-N 3.3Å; L114-F116 PolarHBondContact O-N 3.32Å; F116-A118 VanDerWaalsContact C-N 3.29Å; F116-A118 PolarHBondContact O-N 3.15Å; F116-S119 WeakPolarHBondContact O-CB 3.35Å; F116-S119 PolarHBondContact O-N 3.43Å; F116-L120 HydrophobicContact CD1-CD1 3.95Å; F116-L120 HydrophobicContact CE1-CD1 3.58Å; F116-L120 HydrophobicContact CE1-CG 4.4Å; F116-L120 HydrophobicContact CE2-CD1 4.32Å; F116-L120 HydrophobicContact CE2-CG 4.29Å; F116-L120 HydrophobicContact CG-CD1 4.48Å; F116-L120 HydrophobicContact CZ-CD1 3.78Å; F116-L120 HydrophobicContact CZ-CD2 4.39Å; F116-L120 HydrophobicContact CZ-CG 4.17Å; F116-L120 WeakPolarHBondContact O-CG 3.41Å; F116-L120 PolarHBondContact O-N 3.47Å; F116-H446 AromaticContact CD2-CD2 3.78Å; F116-H446 AromaticContact CD2-CE1 3.82Å; F116-H446 AromaticContact CD2-NE2 3.56Å; F116-H446 AromaticContact CE2-CE1 3.75Å; F116-H446 AromaticContact CE2-ND1 3.95Å; F116-H446 AromaticContact CE2-NE2 3.99Å
117	Q	95.1	Very high	93.7	Very high	53 Å²	53	34 Å²	34	25%	0.248	19%	0.188	C	C	.	.	H	α-helix	trans	-57	-41.6	170.6	-64.1	-63.8	-35.7	0	0	112	E113 L114 S119 A121	E113-Q117 WeakPolarHBondContact O-CG 3.25Å; E113-Q117 PolarHBondContact O-N 2.86Å; E113-Q117 WeakPolarHBondContact OE1-CG 3.49Å; E113-Q117 PolarHBondContact OE1-NE2 3.46Å; L114-Q117 PolarHBondContact O-N 2.7Å; Q117-S119 VanDerWaalsContact C-N 3.34Å; Q117-A121 PolarHBondContact O-N 3.34Å
118	A	95.6	Very high	94	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-67.7	-33.1	174.3	0	0	0	0	0	112.5	L114 F116 E709 L712 R713 R716	L114-A118 WeakPolarHBondContact O-CB 3.06Å; L114-A118 PolarHBondContact O-N 2.69Å; F116-A118 VanDerWaalsContact C-N 3.29Å; F116-A118 PolarHBondContact O-N 3.15Å; A118-E709 WeakPolarHBondContact CB-O 3.41Å; A118-L712 HydrophobicContact CB-CB 4.38Å; A118-R713 HydrophobicContact CB-CB 4Å; A118-R716 WeakPolarHBondContact O-CD 3.39Å; A118-R716 PolarHBondContact O-NH1 3.13Å
119	S	95.2	Very high	94.1	Very high	24 Å²	24	37.2 Å²	37.2	17%	0.168	20%	0.202	C	C	.	.	H	α-helix	trans	-71.8	-42.2	178.6	-65	0	0	0	0	112.3	S115 F116 Q117 A121 R442	S115-S119 VanDerWaalsContact O-CB 3.31Å; S115-S119 WeakPolarHBondContact O-CB 3.44Å; S115-S119 PolarHBondContact O-N 3.33Å; S115-S119 PolarHBondContact O-OG 3.28Å; F116-S119 WeakPolarHBondContact O-CB 3.35Å; F116-S119 PolarHBondContact O-N 3.43Å; Q117-S119 VanDerWaalsContact C-N 3.34Å; S119-A121 PolarHBondContact O-N 3.31Å; S119-R442 PolarHBondContact O-NE 3.14Å; S119-R442 PolarHBondContact O-NH2 3.5Å
120	L	95.4	Very high	94.2	Very high	67 Å²	67	41.1 Å²	41.1	35%	0.351	21%	0.207	S	C	.	.	H	α-helix	trans	-61.5	-26.8	174	-76.8	168.7	0	0	0	113.6	F116 R122 W439 Q443	F116-L120 HydrophobicContact CD1-CD1 3.95Å; F116-L120 HydrophobicContact CE1-CD1 3.58Å; F116-L120 HydrophobicContact CE1-CG 4.4Å; F116-L120 HydrophobicContact CE2-CD1 4.32Å; F116-L120 HydrophobicContact CE2-CG 4.29Å; F116-L120 HydrophobicContact CG-CD1 4.48Å; F116-L120 HydrophobicContact CZ-CD1 3.78Å; F116-L120 HydrophobicContact CZ-CD2 4.39Å; F116-L120 HydrophobicContact CZ-CG 4.17Å; F116-L120 WeakPolarHBondContact O-CG 3.41Å; F116-L120 PolarHBondContact O-N 3.47Å; L120-R122 PolarHBondContact O-N 2.99Å; L120-W439 PolarHBondContact O-NE1 2.94Å; L120-Q443 VanDerWaalsContact CD2-NE2 3.34Å
121	A	96.2	Very high	94.4	Very high	9 Å²	9	41.4 Å²	41.4	7%	0.074	21%	0.207	C	C	.	.			trans	-61	132.9	-178.4	0	0	0	0	0	112.7	Q117 S119 R442 R713 R716 E717	Q117-A121 PolarHBondContact O-N 3.34Å; S119-A121 PolarHBondContact O-N 3.31Å; A121-R442 PolarHBondContact O-NH2 3.05Å; A121-R713 HydrophobicContact CB-CG 4.22Å; A121-R716 HydrophobicContact CB-CB 3.66Å; A121-R716 WeakPolarHBondContact O-CB 3.29Å; A121-E717 HydrophobicContact CB-CG 4.05Å
122	R	94.3	Very high	94.6	Very high	61 Å²	61	41.4 Å²	41.4	23%	0.23	21%	0.207	C	C	.	.			trans	-147.5	167.2	165	63.1	179.2	-173.1	-147.6	-11	108	L120 E412 D413 R716	L120-R122 PolarHBondContact O-N 2.99Å; R122-E412 IonicContact CZ-OE2 3.64Å; R122-E412 IonicContact NE-OE2 2.67Å; R122-E412 IonicContact NH1-OE2 3.27Å; R122-E412 PolarHBondContact NH1-OE2 2.88Å; R122-D413 IonicContact CZ-OD1 3.89Å; R122-D413 VanDerWaalsContact CZ-OD1 3.26Å; R122-D413 IonicContact CZ-OD2 3.42Å; R122-D413 IonicContact NH1-OD1 3.99Å; R122-D413 PolarHBondContact NH1-OD1 2.91Å; R122-D413 IonicContact NH1-OD2 2.68Å; R122-D413 VanDerWaalsContact NH2-CG 3.26Å; R122-D413 IonicContact NH2-OD1 2.76Å; R122-D413 PolarHBondContact NH2-OD1 3.28Å; R122-D413 IonicContact NH2-OD2 2.71Å; R122-D413 PolarHBondContact NH2-OD2 3.2Å; R122-R716 CarbonylContact C-O 3.33Å; R122-R716 VanDerWaalsContact CA-O 3.28Å; R122-R716 WeakPolarHBondContact CA-O 3.45Å
123	A	93.3	Very high	94.6	Very high	34 Å²	34	41 Å²	41	28%	0.281	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-63.8	146.4	173.8	0	0	0	0	0	110.7	A125 Q409 R716 E717	A123-A125 PolarHBondContact O-N 2.89Å; A123-Q409 PolarHBondContact O-NE2 3.04Å; A123-R716 PolarHBondContact N-O 3.25Å; A123-E717 WeakPolarHBondContact CA-O 3.46Å
124	E	91.5	Very high	94.7	Very high	143 Å²	143	39.2 Å²	39.2	67%	0.668	21%	0.208	S	C	*	.	P	Polyproline II helix	trans	-65.7	127.9	167.7	-70.7	-173.4	-168.3	0	0	109.8	R130	E124-R130 IonicContact OE2-CZ 3.32Å; E124-R130 VanDerWaalsContact OE2-CZ 3.25Å; E124-R130 IonicContact OE2-NH1 2.75Å; E124-R130 PolarHBondContact OE2-NH1 2.69Å; E124-R130 IonicContact OE2-NH2 3.88Å; E124-R130 PolarHBondContact OE2-NH2 2.71Å
125	A	93.9	Very high	94.8	Very high	10 Å²	10	39 Å²	39	8%	0.083	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-72.9	150.6	164.3	0	0	0	0	0	110.2	A123 S127 M406 Q409	A123-A125 PolarHBondContact O-N 2.89Å; A125-S127 PolarHBondContact O-N 3.16Å; A125-M406 HydrophobicContact CB-CG 3.95Å; A125-M406 HydrophobicContact CB-SD 3.37Å; A125-M406 WeakPolarHBondContact CB-SD 3.48Å; A125-Q409 HydrophobicContact CB-CG 4.37Å
126	P	93.8	Very high	94.8	Very high	39 Å²	39	39.7 Å²	39.7	25%	0.253	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-78.3	121.9	179.3	32.1	-31.3	0	0	0	109.9	R130 D131 R304 S405 M406	P126-R130 HydrophobicContact CB-CB 4.23Å; P126-D131 WeakPolarHBondContact CB-OD1 3.45Å; P126-D131 WeakPolarHBondContact CG-OD1 3.36Å; P126-R304 PolarHBondContact O-NH1 3.47Å; P126-R304 VanDerWaalsContact O-NH1 3.15Å; P126-S405 WeakPolarHBondContact CD-OG 3.12Å; P126-M406 WeakPolarHBondContact O-CG 3.49Å
127	S	95.1	Very high	94.8	Very high	28 Å²	28	44.1 Å²	44.1	20%	0.196	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-61.4	157.9	170.4	57.3	0	0	0	0	111.1	A125 Q129 R130 D131 D355	A125-S127 PolarHBondContact O-N 3.16Å; S127-Q129 PolarHBondContact O-N 2.83Å; S127-Q129 VanDerWaalsContact O-N 3.1Å; S127-R130 WeakPolarHBondContact O-CB 3.49Å; S127-R130 PolarHBondContact O-N 3.19Å; S127-D131 PolarHBondContact O-N 2.97Å; S127-D355 WeakPolarHBondContact CA-OD2 3.34Å
128	L	95.2	Very high	94.7	Very high	6 Å²	6	46.1 Å²	46.1	3%	0.031	24%	0.238	C	C	.	.	H	α-helix	trans	-45.1	-41.8	170.8	175.7	62.3	0	0	0	111.9	R130 D131 L132 M240 Y353 D355	L128-R130 PolarHBondContact O-N 3Å; L128-D131 PolarHBondContact O-N 2.94Å; L128-L132 HydrophobicContact CD1-CD1 3.72Å; L128-L132 HydrophobicContact CD1-CG 3.96Å; L128-L132 HydrophobicContact CG-CD1 3.74Å; L128-L132 HydrophobicContact CG-CG 4.38Å; L128-L132 VanDerWaalsContact O-CB 3.28Å; L128-L132 WeakPolarHBondContact O-CB 3.48Å; L128-L132 WeakPolarHBondContact O-CD1 3.28Å; L128-L132 WeakPolarHBondContact O-CG 3.41Å; L128-L132 PolarHBondContact O-N 3.39Å; L128-M240 HydrophobicContact CD2-CB 3.94Å; L128-M240 HydrophobicContact CD2-CG 4.05Å; L128-Y353 WeakPolarHBondContact CD2-O 3.27Å; L128-D355 VanDerWaalsContact CB-OD2 3.32Å; L128-D355 WeakPolarHBondContact CB-OD2 3.42Å; L128-D355 PolarHBondContact N-OD1 3.37Å; L128-D355 PolarHBondContact N-OD2 2.88Å
129	Q	94.9	Very high	94.6	Very high	63 Å²	63	51.2 Å²	51.2	29%	0.294	26%	0.26	S	S	.	.	H	α-helix	trans	-57.2	-46.2	175.5	-167.3	-165.9	14.1	0	0	113.3	S127 A133 T204 E206 L236	S127-Q129 PolarHBondContact O-N 2.83Å; S127-Q129 VanDerWaalsContact O-N 3.1Å; Q129-A133 PolarHBondContact O-N 3.28Å; Q129-T204 WeakPolarHBondContact CG-O 3.3Å; Q129-T204 PolarHBondContact NE2-O 3.49Å; Q129-E206 VanDerWaalsContact NE2-CD 3.34Å; Q129-E206 PolarHBondContact NE2-OE1 2.91Å; Q129-L236 HydrophobicContact CB-CD2 4.04Å; Q129-L236 HydrophobicContact CG-CD2 4.03Å
130	R	94.6	Very high	94.4	Very high	125 Å²	125	53.4 Å²	53.4	47%	0.472	27%	0.265	S	S	.	.	H	α-helix	trans	-70.1	-41.9	179.9	-69.5	173.1	176	170.6	-4.8	111.1	E124 P126 S127 L128 A133 A134	E124-R130 IonicContact OE2-CZ 3.32Å; E124-R130 VanDerWaalsContact OE2-CZ 3.25Å; E124-R130 IonicContact OE2-NH1 2.75Å; E124-R130 PolarHBondContact OE2-NH1 2.69Å; E124-R130 IonicContact OE2-NH2 3.88Å; E124-R130 PolarHBondContact OE2-NH2 2.71Å; P126-R130 HydrophobicContact CB-CB 4.23Å; S127-R130 WeakPolarHBondContact O-CB 3.49Å; S127-R130 PolarHBondContact O-N 3.19Å; L128-R130 PolarHBondContact O-N 3Å; R130-A133 WeakPolarHBondContact O-CB 3.29Å; R130-A133 PolarHBondContact O-N 3.37Å; R130-A134 PolarHBondContact O-N 3.41Å
131	D	96.5	Very high	94.1	Very high	23 Å²	23	50.8 Å²	50.8	12%	0.123	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-36.2	177.6	-74.9	-20.2	0	0	0	112.3	P126 S127 L128 A134 L135 A303 R304	P126-D131 WeakPolarHBondContact CB-OD1 3.45Å; P126-D131 WeakPolarHBondContact CG-OD1 3.36Å; S127-D131 PolarHBondContact O-N 2.97Å; L128-D131 PolarHBondContact O-N 2.94Å; D131-A134 PolarHBondContact O-N 3.35Å; D131-L135 VanDerWaalsContact O-CB 3.32Å; D131-L135 WeakPolarHBondContact O-CB 3.41Å; D131-L135 PolarHBondContact O-N 3.09Å; D131-A303 HydrophobicContact CB-CB 4.29Å; D131-R304 WeakPolarHBondContact OD2-CD 3.29Å; D131-R304 IonicContact OD2-CZ 2.78Å; D131-R304 IonicContact OD2-NE 2.67Å; D131-R304 IonicContact OD2-NH1 3.51Å; D131-R304 PolarHBondContact OD2-NH1 3.32Å
132	L	96.4	Very high	93.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-71.2	-35.4	174.9	-72	170.7	0	0	0	112.7	L128 L135 Y136 I159 Y203 L236 M240 I300	L128-L132 HydrophobicContact CD1-CD1 3.72Å; L128-L132 HydrophobicContact CD1-CG 3.96Å; L128-L132 HydrophobicContact CG-CD1 3.74Å; L128-L132 HydrophobicContact CG-CG 4.38Å; L128-L132 VanDerWaalsContact O-CB 3.28Å; L128-L132 WeakPolarHBondContact O-CB 3.48Å; L128-L132 WeakPolarHBondContact O-CD1 3.28Å; L128-L132 WeakPolarHBondContact O-CG 3.41Å; L128-L132 PolarHBondContact O-N 3.39Å; L132-L135 HydrophobicContact CD2-CD2 3.98Å; L132-L135 PolarHBondContact O-N 3.1Å; L132-Y136 PolarHBondContact O-N 3.4Å; L132-I159 HydrophobicContact CD2-CD1 3.8Å; L132-Y203 HydrophobicContact CB-CD1 4.42Å; L132-Y203 WeakPolarHBondContact CB-O 3.43Å; L132-Y203 HydrophobicContact CD2-CD1 4.5Å; L132-L236 HydrophobicContact CD1-CD1 4.06Å; L132-L236 HydrophobicContact CD1-CD2 4.22Å; L132-L236 HydrophobicContact CD1-CG 4.44Å; L132-M240 HydrophobicContact CD1-CE 3.62Å; L132-M240 HydrophobicContact CD1-CG 4.45Å; L132-M240 HydrophobicContact CD1-SD 4.31Å; L132-M240 HydrophobicContact CD2-CE 4.22Å; L132-I300 HydrophobicContact CD2-CD1 3.9Å
133	A	94.5	Very high	93.7	Very high	26 Å²	26	49.2 Å²	49.2	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-60.3	-47.8	169.7	0	0	0	0	0	110.8	Q129 R130 L135 Y136 Q137 T204	Q129-A133 PolarHBondContact O-N 3.28Å; R130-A133 WeakPolarHBondContact O-CB 3.29Å; R130-A133 PolarHBondContact O-N 3.37Å; A133-L135 PolarHBondContact O-N 3.38Å; A133-Y136 PolarHBondContact O-N 3Å; A133-Q137 WeakPolarHBondContact O-CB 3.48Å; A133-Q137 PolarHBondContact O-N 3.02Å; A133-T204 HydrophobicContact CB-CG2 3.59Å
134	A	95.3	Very high	93.6	Very high	36 Å²	36	47.7 Å²	47.7	30%	0.298	24%	0.235	S	C	.	.	H	α-helix	trans	-63.8	-39.7	177.3	0	0	0	0	0	112.3	R130 D131 Q137 H138	R130-A134 PolarHBondContact O-N 3.41Å; D131-A134 PolarHBondContact O-N 3.35Å; A134-Q137 PolarHBondContact O-N 3.25Å; A134-H138 WeakPolarHBondContact O-CB 3.01Å; A134-H138 PolarHBondContact O-N 3.25Å; A134-H138 PolarHBondContact O-ND1 3.23Å
135	L	96.1	Very high	93.6	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-57.4	-50	174.3	176.3	70.8	0	0	0	111.6	D131 L132 A133 K139 Y140 I159 Y203 A299 A303	D131-L135 VanDerWaalsContact O-CB 3.32Å; D131-L135 WeakPolarHBondContact O-CB 3.41Å; D131-L135 PolarHBondContact O-N 3.09Å; L132-L135 HydrophobicContact CD2-CD2 3.98Å; L132-L135 PolarHBondContact O-N 3.1Å; A133-L135 PolarHBondContact O-N 3.38Å; L135-K139 PolarHBondContact O-N 3.45Å; L135-Y140 VanDerWaalsContact CD1-O 3.24Å; L135-Y140 WeakPolarHBondContact CD1-O 3.44Å; L135-I159 HydrophobicContact CD2-CD1 3.67Å; L135-Y203 HydrophobicContact CD2-CE1 4.24Å; L135-A299 HydrophobicContact CD2-CB 4.11Å; L135-A303 HydrophobicContact CB-CB 3.99Å; L135-A303 HydrophobicContact CD1-CB 4.22Å; L135-A303 HydrophobicContact CD2-CB 4.17Å; L135-A303 HydrophobicContact CG-CB 4.34Å
136	Y	94.1	Very high	93.6	Very high	28 Å²	28	42.6 Å²	42.6	11%	0.11	21%	0.211	C	C	.	.	H	α-helix	trans	-64	-43.7	178.2	179.4	-117.4	0	0	0	111.8	L132 A133 H138 L199 H200 Y203	L132-Y136 PolarHBondContact O-N 3.4Å; A133-Y136 PolarHBondContact O-N 3Å; Y136-H138 PolarHBondContact O-N 3.36Å; Y136-L199 HydrophobicContact CE2-CB 4.13Å; Y136-L199 WeakPolarHBondContact OH-CB 3.37Å; Y136-H200 HydrophobicContact CE1-CB 4.26Å; Y136-Y203 HydrophobicContact CD2-CD2 4.18Å; Y136-Y203 HydrophobicContact CD2-CE1 4.48Å; Y136-Y203 AromaticContact CD2-CE2 3.8Å; Y136-Y203 HydrophobicContact CD2-CE2 3.8Å; Y136-Y203 AromaticContact CD2-CZ 3.96Å; Y136-Y203 HydrophobicContact CE2-CE2 4.39Å; Y136-Y203 HydrophobicContact CG-CD2 4.25Å; Y136-Y203 HydrophobicContact CG-CE2 4.31Å; Y136-Y203 HydrophobicContact CG-CG 4.4Å
137	Q	93.6	Very high	93.5	Very high	149 Å²	149	42.6 Å²	42.6	70%	0.696	21%	0.209	S	C	*	.	H	α-helix	trans	-62.2	-41.3	179	-173.6	-178.9	16.3	0	0	113	A133 A134	A133-Q137 WeakPolarHBondContact O-CB 3.48Å; A133-Q137 PolarHBondContact O-N 3.02Å; A134-Q137 PolarHBondContact O-N 3.25Å
138	H	94.1	Very high	93.2	Very high	96 Å²	96	41.4 Å²	41.4	44%	0.444	20%	0.2	S	C	.	.	H	α-helix	trans	-95.4	-8.1	-174.9	-62.9	84.9	0	0	0	114.3	A134 Y136 Y140	A134-H138 WeakPolarHBondContact O-CB 3.01Å; A134-H138 PolarHBondContact O-N 3.25Å; A134-H138 PolarHBondContact O-ND1 3.23Å; Y136-H138 PolarHBondContact O-N 3.36Å; H138-Y140 VanDerWaalsContact C-N 3.3Å; H138-Y140 HydrophobicContact CB-CD1 4.44Å; H138-Y140 HydrophobicContact CB-CD2 3.72Å; H138-Y140 HydrophobicContact CB-CE1 4.09Å; H138-Y140 HydrophobicContact CB-CE2 3.3Å; H138-Y140 HydrophobicContact CB-CG 4.27Å; H138-Y140 AromaticContact CG-CE2 3.84Å; H138-Y140 PolarHBondContact O-N 3.41Å
139	K	92.8	Very high	92.9	Very high	106 Å²	106	47 Å²	47	46%	0.461	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	36.4	173.9	-52.7	176.4	175.7	-171.7	0	113.7	L135 T142 P154	L135-K139 PolarHBondContact O-N 3.45Å; K139-T142 HydrophobicContact CB-CG2 4.07Å; K139-P154 HydrophobicContact CD-CB 4.09Å; K139-P154 HydrophobicContact CD-CG 3.96Å; K139-P154 HydrophobicContact CG-CB 4.45Å
140	Y	91.1	Very high	92.5	Very high	71 Å²	71	47.4 Å²	47.4	28%	0.278	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	125.1	177.6	-59.5	-50.6	0	0	0	111	L135 H138 T142 H156 R309 Q313	L135-Y140 VanDerWaalsContact CD1-O 3.24Å; L135-Y140 WeakPolarHBondContact CD1-O 3.44Å; H138-Y140 VanDerWaalsContact C-N 3.3Å; H138-Y140 HydrophobicContact CB-CD1 4.44Å; H138-Y140 HydrophobicContact CB-CD2 3.72Å; H138-Y140 HydrophobicContact CB-CE1 4.09Å; H138-Y140 HydrophobicContact CB-CE2 3.3Å; H138-Y140 HydrophobicContact CB-CG 4.27Å; H138-Y140 AromaticContact CG-CE2 3.84Å; H138-Y140 PolarHBondContact O-N 3.41Å; Y140-T142 PolarHBondContact O-N 3.15Å; Y140-H156 PolarHBondContact O-NE2 3.39Å; Y140-R309 HydrophobicContact CD2-CG 4.45Å; Y140-Q313 VanDerWaalsContact CD1-NE2 3.33Å
141	C	89.9	Confident	92.4	Very high	11 Å²	11	44 Å²	44	7%	0.074	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	64	31.5	176.5	-56.8	0	0	0	0	115.4	H156 K298	C141-H156 PolarHBondContact O-CD2 3.01Å; C141-H156 VanDerWaalsContact O-CD2 3.3Å; C141-K298 HydrophobicContact CB-CB 3.94Å
142	T	92	Very high	92.2	Very high	28 Å²	28	45.9 Å²	45.9	17%	0.172	26%	0.255	C	S	.	.			trans	-65	138.4	171.5	51.3	0	0	0	0	112	K139 Y140 P154 A155 H156	K139-T142 HydrophobicContact CB-CG2 4.07Å; Y140-T142 PolarHBondContact O-N 3.15Å; T142-P154 HydrophobicContact CG2-CB 3.91Å; T142-A155 VanDerWaalsContact CA-O 3.3Å; T142-A155 WeakPolarHBondContact CA-O 3.26Å; T142-A155 VanDerWaalsContact CB-O 3.28Å; T142-A155 WeakPolarHBondContact CB-O 3.12Å; T142-H156 WeakPolarHBondContact CG2-NE2 3.36Å; T142-H156 PolarHBondContact N-NE2 2.9Å
143	D	89.1	Confident	92.1	Very high	10 Å²	10	46.8 Å²	46.8	5%	0.053	26%	0.259	C	S	.	.			trans	-126.6	2.1	-172.2	69.8	-22.5	0	0	0	113.8	A155 H156 R157 Y177 G178	D143-A155 PolarHBondContact N-O 2.84Å; D143-H156 WeakPolarHBondContact OD1-CA 3.17Å; D143-R157 WeakPolarHBondContact OD1-CG 3.46Å; D143-R157 PolarHBondContact OD1-N 3.14Å; D143-R157 WeakPolarHBondContact OD2-CB 3.29Å; D143-R157 VanDerWaalsContact OD2-CD 3.27Å; D143-R157 WeakPolarHBondContact OD2-CD 3.24Å; D143-R157 WeakPolarHBondContact OD2-CG 3.47Å; D143-Y177 HydrophobicContact CB-CD1 3.99Å; D143-Y177 HydrophobicContact CB-CD2 3.93Å; D143-Y177 HydrophobicContact CB-CE1 3.66Å; D143-Y177 HydrophobicContact CB-CE2 3.57Å; D143-Y177 HydrophobicContact CB-CG 4.14Å; D143-Y177 VanDerWaalsContact CB-CZ 3.45Å; D143-G178 PolarHBondContact O-N 3.13Å
144	V	90.8	Very high	92.1	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.006	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	141.1	170.8	61.7	0	0	0	0	110.6	L146 A155 R157 L171 A179 V181	V144-L146 HydrophobicContact CG2-CD2 3.86Å; V144-A155 HydrophobicContact CG1-CB 4.17Å; V144-A155 PolarHBondContact N-O 2.97Å; V144-A155 PolarHBondContact O-N 2.87Å; V144-R157 HydrophobicContact CB-CG 3.58Å; V144-R157 HydrophobicContact CG1-CG 3.54Å; V144-R157 HydrophobicContact CG2-CG 4.47Å; V144-L171 HydrophobicContact CG2-CD2 3.91Å; V144-A179 WeakPolarHBondContact CG2-O 3.3Å; V144-V181 HydrophobicContact CG2-CG2 3.72Å
145	D	92.6	Very high	92	Very high	47 Å²	47	44.8 Å²	44.8	25%	0.251	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	113.1	173.7	-76	-32.7	0	0	0	109.5	P154 A179 E180 V181	D145-P154 WeakPolarHBondContact OD1-CA 3.16Å; D145-P154 WeakPolarHBondContact OD1-CB 3.32Å; D145-P154 VanDerWaalsContact OD1-CG 3.25Å; D145-P154 WeakPolarHBondContact OD1-CG 3.43Å; D145-A179 PolarHBondContact N-O 3.32Å; D145-A179 VanDerWaalsContact N-O 3.15Å; D145-E180 HydrophobicContact CB-CG 4.46Å; D145-E180 WeakPolarHBondContact O-CA 3.46Å; D145-V181 PolarHBondContact O-N 2.75Å
146	L	92.4	Very high	91.9	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	120.8	179.7	-51.8	177.4	0	0	0	109.9	V144 F153 A155 L160 F167 V181 M183 F195 L199	V144-L146 HydrophobicContact CG2-CD2 3.86Å; L146-F153 HydrophobicContact CB-CB 4.26Å; L146-F153 PolarHBondContact N-O 3.19Å; L146-F153 PolarHBondContact O-N 3.34Å; L146-A155 HydrophobicContact CD1-CB 4.49Å; L146-L160 HydrophobicContact CD1-CD1 3.81Å; L146-F167 HydrophobicContact CD1-CD1 4.5Å; L146-F167 HydrophobicContact CD1-CE1 3.68Å; L146-F167 HydrophobicContact CD1-CZ 4.06Å; L146-F167 HydrophobicContact CD2-CE1 4.39Å; L146-V181 HydrophobicContact CD2-CB 4.27Å; L146-M183 HydrophobicContact CB-CE 4.4Å; L146-M183 HydrophobicContact CB-CG 3.99Å; L146-M183 HydrophobicContact CB-SD 4.21Å; L146-M183 HydrophobicContact CD1-SD 4.4Å; L146-M183 HydrophobicContact CD2-CE 3.71Å; L146-M183 HydrophobicContact CD2-SD 4.1Å; L146-M183 HydrophobicContact CG-SD 4.47Å; L146-F195 HydrophobicContact CD1-CZ 4.27Å; L146-L199 HydrophobicContact CD1-CD1 4.46Å; L146-L199 HydrophobicContact CD1-CD2 4.02Å
147	I	91.6	Very high	91.9	Very high	39 Å²	39	44.4 Å²	44.4	20%	0.2	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	104.5	-178.6	-56.6	178.1	0	0	0	109.1	T151 E180 V181 L182 M183	I147-T151 WeakPolarHBondContact CA-O 3.47Å; I147-E180 HydrophobicContact CD1-CB 3.95Å; I147-E180 HydrophobicContact CD1-CG 4.13Å; I147-V181 PolarHBondContact N-O 2.93Å; I147-L182 HydrophobicContact CB-CD1 4.23Å; I147-L182 HydrophobicContact CG2-CD1 4.01Å; I147-M183 PolarHBondContact O-N 3.48Å
148	F	90.4	Very high	91.9	Very high	3 Å²	3	37.5 Å²	37.5	1%	0.013	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	124	178.7	179.9	-116.9	0	0	0	111	G150 T151 F153 M183 V185 I190 V192 F195	F148-G150 PolarHBondContact O-N 3.12Å; F148-G150 VanDerWaalsContact O-N 3.09Å; F148-T151 PolarHBondContact N-O 3.33Å; F148-T151 WeakPolarHBondContact O-CB 3.38Å; F148-T151 PolarHBondContact O-N 3.42Å; F148-F153 HydrophobicContact CB-CD2 4.44Å; F148-F153 HydrophobicContact CB-CE2 4.26Å; F148-M183 HydrophobicContact CB-CB 3.84Å; F148-M183 HydrophobicContact CB-CG 4.13Å; F148-M183 HydrophobicContact CD2-CB 3.83Å; F148-M183 HydrophobicContact CG-CB 4.27Å; F148-V185 HydrophobicContact CD2-CB 4.46Å; F148-V185 HydrophobicContact CE2-CB 3.94Å; F148-I190 HydrophobicContact CE1-CG2 4.06Å; F148-I190 HydrophobicContact CZ-CB 4.47Å; F148-I190 HydrophobicContact CZ-CG2 3.83Å; F148-V192 HydrophobicContact CD1-CG2 4.24Å; F148-V192 HydrophobicContact CE1-CG2 4.41Å; F148-F195 HydrophobicContact CB-CD1 3.92Å; F148-F195 HydrophobicContact CB-CE1 3.89Å; F148-F195 HydrophobicContact CB-CG 4.38Å; F148-F195 HydrophobicContact CB-CZ 4.35Å; F148-F195 HydrophobicContact CD1-CB 3.59Å; F148-F195 AromaticContact CD1-CD1 3.88Å; F148-F195 HydrophobicContact CD1-CD1 3.88Å; F148-F195 HydrophobicContact CD1-CD2 4.24Å; F148-F195 AromaticContact CD1-CG 3.65Å; F148-F195 HydrophobicContact CD1-CG 3.65Å; F148-F195 HydrophobicContact CE1-CB 3.67Å; F148-F195 HydrophobicContact CE1-CG 4.09Å; F148-F195 HydrophobicContact CG-CB 4.46Å; F148-F195 HydrophobicContact CG-CD1 4.08Å; F148-F195 HydrophobicContact CG-CD2 4.34Å; F148-F195 HydrophobicContact CG-CE1 4.4Å; F148-F195 HydrophobicContact CG-CG 4.04Å
149	Q	88.9	Confident	91.9	Very high	123 Å²	123	33 Å²	33	58%	0.575	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.3	36.7	-177.8	-60.9	178.5	3.7	0	0	113.4	T151 I190 V192	Q149-T151 VanDerWaalsContact C-N 3.28Å; Q149-T151 PolarHBondContact O-N 2.98Å; Q149-I190 PolarHBondContact NE2-O 2.74Å; Q149-V192 HydrophobicContact CB-CG2 3.86Å
150	G	86.3	Confident	91.9	Very high	72 Å²	72	27.9 Å²	27.9	74%	0.742	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.5	-1	-177.2	0	0	0	0	0	115.8	F148	F148-G150 PolarHBondContact O-N 3.12Å; F148-G150 VanDerWaalsContact O-N 3.09Å
151	T	92.3	Very high	92	Very high	54 Å²	54	24.7 Å²	24.7	33%	0.331	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	133	173.7	-56.8	0	0	0	0	110.2	I147 F148 Q149 F153 V192	I147-T151 WeakPolarHBondContact CA-O 3.47Å; F148-T151 PolarHBondContact N-O 3.33Å; F148-T151 WeakPolarHBondContact O-CB 3.38Å; F148-T151 PolarHBondContact O-N 3.42Å; Q149-T151 VanDerWaalsContact C-N 3.28Å; Q149-T151 PolarHBondContact O-N 2.98Å; T151-F153 HydrophobicContact CG2-CD2 4.21Å; T151-F153 HydrophobicContact CG2-CE2 3.59Å; T151-F153 HydrophobicContact CG2-CZ 3.81Å; T151-V192 HydrophobicContact CG2-CG1 3.88Å
152	C	92.9	Very high	92.1	Very high	62 Å²	62	25.4 Å²	25.4	42%	0.419	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.9	177.4	176.7	0	0	0	0	112
153	F	93.6	Very high	92.1	Very high	19 Å²	19	24.3 Å²	24.3	8%	0.083	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	93.1	177.5	-66.1	-89.2	0	0	0	110.7	L146 F148 T151 A155 V192 F195 L199	L146-F153 HydrophobicContact CB-CB 4.26Å; L146-F153 PolarHBondContact N-O 3.19Å; L146-F153 PolarHBondContact O-N 3.34Å; F148-F153 HydrophobicContact CB-CD2 4.44Å; F148-F153 HydrophobicContact CB-CE2 4.26Å; T151-F153 HydrophobicContact CG2-CD2 4.21Å; T151-F153 HydrophobicContact CG2-CE2 3.59Å; T151-F153 HydrophobicContact CG2-CZ 3.81Å; F153-A155 PolarHBondContact O-N 3.32Å; F153-V192 HydrophobicContact CE2-CG1 4.22Å; F153-V192 HydrophobicContact CZ-CG1 3.77Å; F153-F195 AromaticContact CD2-CD1 3.76Å; F153-F195 HydrophobicContact CD2-CD1 3.76Å; F153-F195 AromaticContact CD2-CE1 3.78Å; F153-F195 HydrophobicContact CD2-CE1 3.78Å; F153-F195 HydrophobicContact CE1-CD1 4.49Å; F153-F195 AromaticContact CE2-CD1 3.63Å; F153-F195 HydrophobicContact CE2-CD1 3.63Å; F153-F195 HydrophobicContact CE2-CE1 4.12Å; F153-F195 HydrophobicContact CG-CD1 4.24Å; F153-F195 HydrophobicContact CG-CE1 4.15Å; F153-F195 HydrophobicContact CZ-CD1 4Å; F153-L199 HydrophobicContact CB-CD1 3.68Å; F153-L199 HydrophobicContact CD1-CD1 3.75Å; F153-L199 HydrophobicContact CG-CD1 3.8Å
154	P	93.7	Very high	92.1	Very high	20 Å²	20	24.1 Å²	24.1	13%	0.13	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	129.7	172.2	-23.5	35.3	0	0	0	111.6	K139 T142 D145	K139-P154 HydrophobicContact CD-CB 4.09Å; K139-P154 HydrophobicContact CD-CG 3.96Å; K139-P154 HydrophobicContact CG-CB 4.45Å; T142-P154 HydrophobicContact CG2-CB 3.91Å; D145-P154 WeakPolarHBondContact OD1-CA 3.16Å; D145-P154 WeakPolarHBondContact OD1-CB 3.32Å; D145-P154 VanDerWaalsContact OD1-CG 3.25Å; D145-P154 WeakPolarHBondContact OD1-CG 3.43Å
155	A	94.5	Very high	91.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	-174.7	-172	0	0	0	0	0	112.7	T142 D143 V144 L146 F153 L160	T142-A155 VanDerWaalsContact CA-O 3.3Å; T142-A155 WeakPolarHBondContact CA-O 3.26Å; T142-A155 VanDerWaalsContact CB-O 3.28Å; T142-A155 WeakPolarHBondContact CB-O 3.12Å; D143-A155 PolarHBondContact N-O 2.84Å; V144-A155 HydrophobicContact CG1-CB 4.17Å; V144-A155 PolarHBondContact N-O 2.97Å; V144-A155 PolarHBondContact O-N 2.87Å; L146-A155 HydrophobicContact CD1-CB 4.49Å; F153-A155 PolarHBondContact O-N 3.32Å; A155-L160 HydrophobicContact CB-CD1 3.73Å; A155-L160 HydrophobicContact CB-CG 4.46Å
156	H	93.8	Very high	91.6	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.009	18%	0.177	C	C	.	.			trans	-122.1	114.9	-174	-54.7	91.5	0	0	0	110.6	Y140 C141 T142 D143 A158 I159 L160 Y203 A299	Y140-H156 PolarHBondContact O-NE2 3.39Å; C141-H156 PolarHBondContact O-CD2 3.01Å; C141-H156 VanDerWaalsContact O-CD2 3.3Å; T142-H156 WeakPolarHBondContact CG2-NE2 3.36Å; T142-H156 PolarHBondContact N-NE2 2.9Å; D143-H156 WeakPolarHBondContact OD1-CA 3.17Å; H156-A158 PolarHBondContact O-N 3.18Å; H156-I159 HydrophobicContact CB-CB 4.15Å; H156-I159 HydrophobicContact CB-CD1 3.89Å; H156-I159 HydrophobicContact CB-CG1 4.1Å; H156-I159 PolarHBondContact O-N 3.23Å; H156-L160 PolarHBondContact O-N 3.18Å; H156-Y203 PolarHBondContact N-OH 2.59Å; H156-Y203 AromaticContact ND1-CE1 3.42Å; H156-Y203 WeakPolarHBondContact ND1-CE1 3.47Å; H156-Y203 AromaticContact ND1-CZ 3.55Å; H156-Y203 PolarHBondContact ND1-OH 2.62Å; H156-A299 HydrophobicContact CB-CB 4.24Å
157	R	92.8	Very high	91.4	Very high	19 Å²	19	28.8 Å²	28.8	7%	0.072	18%	0.177	C	C	.	.	H	α-helix	trans	-58.9	-45.5	-173.9	-64.2	166.8	67.2	89.6	-1.6	111.9	D143 V144 I159 L160 A161 L171 S174 P175	D143-R157 WeakPolarHBondContact OD1-CG 3.46Å; D143-R157 PolarHBondContact OD1-N 3.14Å; D143-R157 WeakPolarHBondContact OD2-CB 3.29Å; D143-R157 VanDerWaalsContact OD2-CD 3.27Å; D143-R157 WeakPolarHBondContact OD2-CD 3.24Å; D143-R157 WeakPolarHBondContact OD2-CG 3.47Å; V144-R157 HydrophobicContact CB-CG 3.58Å; V144-R157 HydrophobicContact CG1-CG 3.54Å; V144-R157 HydrophobicContact CG2-CG 4.47Å; R157-I159 VanDerWaalsContact C-N 3.33Å; R157-I159 PolarHBondContact O-N 3.01Å; R157-L160 PolarHBondContact O-N 3.44Å; R157-A161 WeakPolarHBondContact O-CB 3.48Å; R157-A161 PolarHBondContact O-N 2.9Å; R157-L171 HydrophobicContact CB-CD1 4.19Å; R157-L171 HydrophobicContact CG-CD1 4.29Å; R157-L171 PolarHBondContact NH2-O 3.47Å; R157-S174 PolarHBondContact NH1-OG 3.48Å; R157-S174 PolarHBondContact NH2-OG 3.36Å; R157-S174 VanDerWaalsContact NH2-OG 3.15Å; R157-P175 PolarHBondContact NH1-O 3.37Å; R157-P175 PolarHBondContact NH2-O 2.84Å
158	A	93.8	Very high	91.3	Very high	5 Å²	5	32.3 Å²	32.3	4%	0.041	19%	0.191	C	C	.	.	H	α-helix	trans	-56.4	-44.6	178.1	0	0	0	0	0	112.6	H156 A162 L243 H297	H156-A158 PolarHBondContact O-N 3.18Å; A158-A162 VanDerWaalsContact O-CB 3.31Å; A158-A162 WeakPolarHBondContact O-CB 3.35Å; A158-A162 PolarHBondContact O-N 2.95Å; A158-L243 HydrophobicContact CB-CD1 4.22Å; A158-L243 HydrophobicContact CB-CD2 4.39Å; A158-H297 VanDerWaalsContact CB-CD2 3.47Å; A158-H297 WeakPolarHBondContact CB-CD2 3.29Å
159	I	95.1	Very high	91.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-70.4	-50.2	-179	-63.9	175.1	0	0	0	110.3	L132 L135 H156 R157 A161 A162 R163 Y203 M240 A299 I300	L132-I159 HydrophobicContact CD2-CD1 3.8Å; L135-I159 HydrophobicContact CD2-CD1 3.67Å; H156-I159 HydrophobicContact CB-CB 4.15Å; H156-I159 HydrophobicContact CB-CD1 3.89Å; H156-I159 HydrophobicContact CB-CG1 4.1Å; H156-I159 PolarHBondContact O-N 3.23Å; R157-I159 VanDerWaalsContact C-N 3.33Å; R157-I159 PolarHBondContact O-N 3.01Å; I159-A161 VanDerWaalsContact C-N 3.33Å; I159-A161 PolarHBondContact O-N 3.45Å; I159-A162 PolarHBondContact O-N 3.24Å; I159-R163 HydrophobicContact CG2-CG 4.24Å; I159-R163 VanDerWaalsContact O-CB 3.29Å; I159-R163 WeakPolarHBondContact O-CB 3.47Å; I159-R163 WeakPolarHBondContact O-CG 3.37Å; I159-R163 PolarHBondContact O-N 2.83Å; I159-Y203 HydrophobicContact CB-CE1 4.36Å; I159-Y203 HydrophobicContact CD1-CD1 4.07Å; I159-Y203 HydrophobicContact CD1-CE1 3.61Å; I159-Y203 HydrophobicContact CG2-CD1 4.05Å; I159-Y203 HydrophobicContact CG2-CD2 4.35Å; I159-Y203 HydrophobicContact CG2-CE1 3.95Å; I159-Y203 HydrophobicContact CG2-CE2 4.27Å; I159-Y203 HydrophobicContact CG2-CG 4.26Å; I159-M240 HydrophobicContact CB-CE 4.41Å; I159-M240 HydrophobicContact CG1-CE 4.11Å; I159-M240 HydrophobicContact CG2-CE 3.8Å; I159-A299 HydrophobicContact CD1-CB 4.25Å; I159-I300 HydrophobicContact CD1-CD1 4.18Å; I159-I300 HydrophobicContact CG1-CD1 4.42Å
160	L	93.3	Very high	91.1	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.1	-40.1	-179.9	-65.8	179.4	0	0	0	112.2	L146 A155 H156 R157 R163 C164 F167 L171 L199 L202 Y203	L146-L160 HydrophobicContact CD1-CD1 3.81Å; A155-L160 HydrophobicContact CB-CD1 3.73Å; A155-L160 HydrophobicContact CB-CG 4.46Å; H156-L160 PolarHBondContact O-N 3.18Å; R157-L160 PolarHBondContact O-N 3.44Å; L160-R163 PolarHBondContact O-N 3.49Å; L160-C164 WeakPolarHBondContact O-CB 3.33Å; L160-C164 PolarHBondContact O-N 3.43Å; L160-F167 HydrophobicContact CB-CB 3.89Å; L160-F167 HydrophobicContact CB-CD2 4.45Å; L160-F167 HydrophobicContact CB-CG 4.12Å; L160-F167 HydrophobicContact CD1-CD1 4.34Å; L160-F167 HydrophobicContact CD1-CG 4.48Å; L160-F167 HydrophobicContact CD2-CD2 4.38Å; L160-L171 HydrophobicContact CB-CD1 4.06Å; L160-L171 HydrophobicContact CD1-CD1 4.43Å; L160-L199 HydrophobicContact CD2-CD2 3.85Å; L160-L202 HydrophobicContact CD2-CB 4.45Å; L160-L202 HydrophobicContact CD2-CD1 3.65Å; L160-Y203 HydrophobicContact CD2-CE2 4.18Å
161	A	92.3	Very high	91.2	Very high	4 Å²	4	29.8 Å²	29.8	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-76.6	-20.4	179.2	0	0	0	0	0	114.2	R157 I159 K168 Y249	R157-A161 WeakPolarHBondContact O-CB 3.48Å; R157-A161 PolarHBondContact O-N 2.9Å; I159-A161 VanDerWaalsContact C-N 3.33Å; I159-A161 PolarHBondContact O-N 3.45Å; A161-K168 HydrophobicContact CB-CB 4.1Å; A161-K168 HydrophobicContact CB-CG 4.2Å; A161-K168 WeakPolarHBondContact O-CB 3.46Å; A161-K168 WeakPolarHBondContact O-CD 3.35Å; A161-K168 WeakPolarHBondContact O-CG 3.49Å; A161-Y249 HydrophobicContact CB-CD2 3.95Å; A161-Y249 HydrophobicContact CB-CE2 3.38Å
162	A	92.8	Very high	90.8	Very high	26 Å²	26	31.1 Å²	31.1	22%	0.215	18%	0.18	C	C	.	.	H	α-helix	trans	-77.5	-42.7	167.4	0	0	0	0	0	111.3	A158 I159 L243	A158-A162 VanDerWaalsContact O-CB 3.31Å; A158-A162 WeakPolarHBondContact O-CB 3.35Å; A158-A162 PolarHBondContact O-N 2.95Å; I159-A162 PolarHBondContact O-N 3.24Å; A162-L243 HydrophobicContact CB-CB 4.08Å; A162-L243 HydrophobicContact CB-CD1 4.35Å; A162-L243 HydrophobicContact CB-CD2 4.41Å
163	R	91.2	Very high	90	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.015	19%	0.193	C	C	.	.	H	α-helix	trans	-88.6	-12.3	-169.9	-63.3	-70.3	-68.8	138	-0.2	115.2	I159 L160 L202 P233 N234 D239 M240	I159-R163 HydrophobicContact CG2-CG 4.24Å; I159-R163 VanDerWaalsContact O-CB 3.29Å; I159-R163 WeakPolarHBondContact O-CB 3.47Å; I159-R163 WeakPolarHBondContact O-CG 3.37Å; I159-R163 PolarHBondContact O-N 2.83Å; L160-R163 PolarHBondContact O-N 3.49Å; R163-L202 HydrophobicContact CB-CB 4.23Å; R163-L202 HydrophobicContact CB-CD2 4.06Å; R163-L202 WeakPolarHBondContact CG-O 3.45Å; R163-L202 PolarHBondContact NE-O 3.11Å; R163-P233 WeakPolarHBondContact O-CB 3.29Å; R163-N234 PolarHBondContact NH1-O 3.3Å; R163-D239 IonicContact CZ-OD2 3.35Å; R163-D239 IonicContact NH1-OD2 2.84Å; R163-D239 PolarHBondContact NH1-OD2 3.48Å; R163-M240 HydrophobicContact CG-CE 4.33Å
164	C	88.5	Confident	88.8	Confident	6 Å²	6	33.1 Å²	33.1	4%	0.041	20%	0.197	C	C	.	.			trans	-149.8	119	-176.8	176.5	0	0	0	0	112.8	L160 F166 F167 K168 L202 F230	L160-C164 WeakPolarHBondContact O-CB 3.33Å; L160-C164 PolarHBondContact O-N 3.43Å; C164-F166 VanDerWaalsContact C-N 3.32Å; C164-F166 PolarHBondContact O-N 3.47Å; C164-F167 HydrophobicContact CB-CB 4.19Å; C164-F167 HydrophobicContact CB-CD2 3.8Å; C164-F167 HydrophobicContact CB-CG 4.49Å; C164-F167 PolarHBondContact O-N 3.09Å; C164-K168 WeakPolarHBondContact O-CB 3.4Å; C164-K168 PolarHBondContact O-N 2.88Å; C164-L202 HydrophobicContact CB-CD1 4.15Å; C164-L202 HydrophobicContact CB-CD2 4.04Å; C164-F230 PolarHBondContact SG-O 2.75Å
165	P	87.3	Confident	87.3	Confident	76 Å²	76	36.8 Å²	36.8	49%	0.494	22%	0.221	S	C	.	.	H	α-helix	trans	-57	-34.8	174.7	-29	36.2	0	0	0	115.6	K168 T169 F230	P165-K168 PolarHBondContact O-N 3.43Å; P165-T169 PolarHBondContact O-N 3.28Å; P165-T169 PolarHBondContact O-OG1 3.37Å; P165-F230 WeakPolarHBondContact CD-O 2.99Å
166	F	86.1	Confident	86	Confident	70 Å²	70	38.3 Å²	38.3	31%	0.307	24%	0.236	S	C	.	.	H	α-helix	trans	-62.3	-55.1	174.4	168.5	-90.3	0	0	0	110.8	C164 K168 T169 L170 F230	C164-F166 VanDerWaalsContact C-N 3.32Å; C164-F166 PolarHBondContact O-N 3.47Å; F166-K168 VanDerWaalsContact C-N 3.29Å; F166-K168 PolarHBondContact O-N 2.9Å; F166-T169 PolarHBondContact O-N 3.01Å; F166-T169 VanDerWaalsContact O-N 3.11Å; F166-L170 HydrophobicContact CE1-CD2 3.7Å; F166-L170 HydrophobicContact CZ-CD2 3.88Å; F166-L170 WeakPolarHBondContact O-CB 3.35Å; F166-L170 PolarHBondContact O-N 3.37Å; F166-F230 HydrophobicContact CB-CB 4.48Å; F166-F230 HydrophobicContact CB-CD1 3.86Å; F166-F230 HydrophobicContact CB-CG 4.49Å; F166-F230 AromaticContact CD1-CD1 3.56Å; F166-F230 HydrophobicContact CD1-CD1 3.56Å; F166-F230 AromaticContact CD1-CE1 3.48Å; F166-F230 HydrophobicContact CD1-CE1 3.48Å; F166-F230 VanDerWaalsContact CD1-CE1 3.48Å; F166-F230 HydrophobicContact CE1-CD1 4.27Å; F166-F230 AromaticContact CE1-CE1 3.7Å; F166-F230 HydrophobicContact CE1-CE1 3.7Å; F166-F230 AromaticContact CG-CD1 3.79Å; F166-F230 HydrophobicContact CG-CD1 3.79Å; F166-F230 AromaticContact CG-CE1 3.98Å; F166-F230 HydrophobicContact CG-CE1 3.98Å; F166-F230 HydrophobicContact CZ-CE1 4.35Å
167	F	88.8	Confident	84.4	Confident	0 Å²	0	41 Å²	41	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.6	-35.8	177.5	-76.5	-64.2	0	0	0	112.2	L146 L160 C164 T169 L170 L171 M183 F195 L199 L202 F230	L146-F167 HydrophobicContact CD1-CD1 4.5Å; L146-F167 HydrophobicContact CD1-CE1 3.68Å; L146-F167 HydrophobicContact CD1-CZ 4.06Å; L146-F167 HydrophobicContact CD2-CE1 4.39Å; L160-F167 HydrophobicContact CB-CB 3.89Å; L160-F167 HydrophobicContact CB-CD2 4.45Å; L160-F167 HydrophobicContact CB-CG 4.12Å; L160-F167 HydrophobicContact CD1-CD1 4.34Å; L160-F167 HydrophobicContact CD1-CG 4.48Å; L160-F167 HydrophobicContact CD2-CD2 4.38Å; C164-F167 HydrophobicContact CB-CB 4.19Å; C164-F167 HydrophobicContact CB-CD2 3.8Å; C164-F167 HydrophobicContact CB-CG 4.49Å; C164-F167 PolarHBondContact O-N 3.09Å; F167-T169 VanDerWaalsContact C-N 3.3Å; F167-T169 PolarHBondContact O-N 3Å; F167-L170 HydrophobicContact CD1-CD2 4.48Å; F167-L170 PolarHBondContact O-N 3.45Å; F167-L171 HydrophobicContact CB-CD1 4.28Å; F167-L171 WeakPolarHBondContact O-CB 3.49Å; F167-L171 WeakPolarHBondContact O-CG 3.09Å; F167-L171 PolarHBondContact O-N 3.2Å; F167-M183 HydrophobicContact CE1-SD 3.8Å; F167-M183 HydrophobicContact CZ-SD 4.47Å; F167-F195 HydrophobicContact CZ-CE2 4.23Å; F167-F195 HydrophobicContact CZ-CZ 4.16Å; F167-L199 HydrophobicContact CE2-CD2 4.31Å; F167-L199 HydrophobicContact CZ-CD2 4.17Å; F167-L202 HydrophobicContact CD2-CD1 3.87Å; F167-L202 HydrophobicContact CE2-CD1 3.83Å; F167-F230 HydrophobicContact CE2-CD1 4.42Å; F167-F230 HydrophobicContact CE2-CE1 4.44Å
168	K	88.7	Confident	83	Confident	113 Å²	113	41.7 Å²	41.7	49%	0.491	26%	0.26	S	S	.	.	H	α-helix	trans	-56.7	-44.2	173.2	-170.2	176.2	-169.2	163.5	0	112.2	A161 C164 P165 F166 S172	A161-K168 HydrophobicContact CB-CB 4.1Å; A161-K168 HydrophobicContact CB-CG 4.2Å; A161-K168 WeakPolarHBondContact O-CB 3.46Å; A161-K168 WeakPolarHBondContact O-CD 3.35Å; A161-K168 WeakPolarHBondContact O-CG 3.49Å; C164-K168 WeakPolarHBondContact O-CB 3.4Å; C164-K168 PolarHBondContact O-N 2.88Å; P165-K168 PolarHBondContact O-N 3.43Å; F166-K168 VanDerWaalsContact C-N 3.29Å; F166-K168 PolarHBondContact O-N 2.9Å; K168-S172 WeakPolarHBondContact O-CB 3.37Å; K168-S172 PolarHBondContact O-N 2.89Å; K168-S172 PolarHBondContact O-OG 3.27Å
169	T	88.3	Confident	81.9	Confident	98 Å²	98	42 Å²	42	60%	0.601	26%	0.263	S	S	*	.	H	α-helix	trans	-71	-52.1	179.6	-53.6	0	0	0	0	110.6	P165 F166 F167 L171 S172	P165-T169 PolarHBondContact O-N 3.28Å; P165-T169 PolarHBondContact O-OG1 3.37Å; F166-T169 PolarHBondContact O-N 3.01Å; F166-T169 VanDerWaalsContact O-N 3.11Å; F167-T169 VanDerWaalsContact C-N 3.3Å; F167-T169 PolarHBondContact O-N 3Å; T169-L171 PolarHBondContact O-N 3.03Å; T169-S172 PolarHBondContact O-N 3.4Å; T169-S172 PolarHBondContact O-OG 3.44Å
170	L	87.1	Confident	81.4	Confident	47 Å²	47	49 Å²	49	25%	0.246	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-47.1	-179.2	-178	61.2	0	0	0	112.6	F166 F167 S172 S173 S174 V181 M183	F166-L170 HydrophobicContact CE1-CD2 3.7Å; F166-L170 HydrophobicContact CZ-CD2 3.88Å; F166-L170 WeakPolarHBondContact O-CB 3.35Å; F166-L170 PolarHBondContact O-N 3.37Å; F167-L170 HydrophobicContact CD1-CD2 4.48Å; F167-L170 PolarHBondContact O-N 3.45Å; L170-S172 VanDerWaalsContact C-N 3.31Å; L170-S172 PolarHBondContact O-N 3.05Å; L170-S173 PolarHBondContact O-N 3.05Å; L170-S173 PolarHBondContact O-OG 2.86Å; L170-S174 PolarHBondContact O-N 3.03Å; L170-V181 HydrophobicContact CD2-CG1 4.45Å; L170-V181 HydrophobicContact CG-CG1 4.38Å; L170-M183 HydrophobicContact CD2-CE 3.59Å; L170-M183 HydrophobicContact CD2-SD 4.16Å
171	L	87.8	Confident	81.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-71	-28.2	-178.7	-62.8	173.3	0	0	0	112	V144 R157 L160 F167 T169 S173 S174 V181	V144-L171 HydrophobicContact CG2-CD2 3.91Å; R157-L171 HydrophobicContact CB-CD1 4.19Å; R157-L171 HydrophobicContact CG-CD1 4.29Å; R157-L171 PolarHBondContact NH2-O 3.47Å; L160-L171 HydrophobicContact CB-CD1 4.06Å; L160-L171 HydrophobicContact CD1-CD1 4.43Å; F167-L171 HydrophobicContact CB-CD1 4.28Å; F167-L171 WeakPolarHBondContact O-CB 3.49Å; F167-L171 WeakPolarHBondContact O-CG 3.09Å; F167-L171 PolarHBondContact O-N 3.2Å; T169-L171 PolarHBondContact O-N 3.03Å; L171-S173 PolarHBondContact O-N 3.38Å; L171-S174 WeakPolarHBondContact CA-OG 3.39Å; L171-S174 PolarHBondContact O-N 2.92Å; L171-S174 PolarHBondContact O-OG 3.11Å; L171-V181 HydrophobicContact CD2-CG2 4.42Å
172	S	84.3	Confident	80.7	Confident	83 Å²	83	55.4 Å²	55.4	58%	0.58	33%	0.329	S	S	*	.	H	α-helix	trans	-66.5	-21.8	175.4	76.2	0	0	0	0	114.3	K168 T169 L170	K168-S172 WeakPolarHBondContact O-CB 3.37Å; K168-S172 PolarHBondContact O-N 2.89Å; K168-S172 PolarHBondContact O-OG 3.27Å; T169-S172 PolarHBondContact O-N 3.4Å; T169-S172 PolarHBondContact O-OG 3.44Å; L170-S172 VanDerWaalsContact C-N 3.31Å; L170-S172 PolarHBondContact O-N 3.05Å
173	S	76.1	Confident	80.4	Confident	99 Å²	99	54.6 Å²	54.6	69%	0.692	32%	0.321	S	S	*	.	H	α-helix	trans	-99.1	-13.2	174.9	64	0	0	0	0	114.1	L170 L171	L170-S173 PolarHBondContact O-N 3.05Å; L170-S173 PolarHBondContact O-OG 2.86Å; L171-S173 PolarHBondContact O-N 3.38Å
174	S	69	Low	79.5	Confident	24 Å²	24	61.3 Å²	61.3	17%	0.168	36%	0.357	C	S	.	.	S	Bend	trans	-73.7	158.5	178.3	69.9	0	0	0	0	113.2	R157 L170 L171	R157-S174 PolarHBondContact NH1-OG 3.48Å; R157-S174 PolarHBondContact NH2-OG 3.36Å; R157-S174 VanDerWaalsContact NH2-OG 3.15Å; L170-S174 PolarHBondContact O-N 3.03Å; L171-S174 WeakPolarHBondContact CA-OG 3.39Å; L171-S174 PolarHBondContact O-N 2.92Å; L171-S174 PolarHBondContact O-OG 3.11Å
175	P	62.7	Low	78.7	Confident	97 Å²	97	61.9 Å²	61.9	63%	0.63	36%	0.361	S	S	*	.			trans	-58.6	174.9	170.9	-23.6	35	0	0	0	114	R157 A179	R157-P175 PolarHBondContact NH1-O 3.37Å; R157-P175 PolarHBondContact NH2-O 2.84Å; P175-A179 HydrophobicContact CB-CB 4.15Å
176	G	65.4	Low	77.5	Confident	32 Å²	32	65.9 Å²	65.9	33%	0.33	38%	0.378	S	S	.	.	S	Bend	trans	-67.9	-165.5	-175.9	0	0	0	0	0	115.9	G178 A179	G176-G178 PolarHBondContact O-N 2.83Å; G176-A179 WeakPolarHBondContact O-CB 2.93Å; G176-A179 PolarHBondContact O-N 3.39Å; G176-A179 VanDerWaalsContact O-N 3.16Å
177	Y	61.5	Low	76.5	Confident	57 Å²	57	63.5 Å²	63.5	22%	0.224	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	125.9	-172.1	-143.1	-93.8	0	0	0	113.2	D143 D251 K298 R325	D143-Y177 HydrophobicContact CB-CD1 3.99Å; D143-Y177 HydrophobicContact CB-CD2 3.93Å; D143-Y177 HydrophobicContact CB-CE1 3.66Å; D143-Y177 HydrophobicContact CB-CE2 3.57Å; D143-Y177 HydrophobicContact CB-CG 4.14Å; D143-Y177 VanDerWaalsContact CB-CZ 3.45Å; Y177-D251 HydrophobicContact CE2-CB 3.74Å; Y177-D251 PolarHBondContact OH-OD2 3.2Å; Y177-K298 WeakPolarHBondContact OH-CD 3.47Å; Y177-K298 WeakPolarHBondContact OH-CE 3.28Å; Y177-K298 PolarHBondContact OH-NZ 2.93Å; Y177-R325 HydrophobicContact CD1-CG 3.83Å; Y177-R325 HydrophobicContact CE1-CG 4.36Å
178	G	62.7	Low	75	Confident	35 Å²	35	67.6 Å²	67.6	36%	0.361	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	20.1	-176.7	0	0	0	0	0	115.2	D143 G176	D143-G178 PolarHBondContact O-N 3.13Å; G176-G178 PolarHBondContact O-N 2.83Å
179	A	71.8	Confident	73.9	Confident	11 Å²	11	64.9 Å²	64.9	9%	0.091	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	130.9	173.7	0	0	0	0	0	112.4	V144 D145 P175 G176 V181	V144-A179 WeakPolarHBondContact CG2-O 3.3Å; D145-A179 PolarHBondContact N-O 3.32Å; D145-A179 VanDerWaalsContact N-O 3.15Å; P175-A179 HydrophobicContact CB-CB 4.15Å; G176-A179 WeakPolarHBondContact O-CB 2.93Å; G176-A179 PolarHBondContact O-N 3.39Å; G176-A179 VanDerWaalsContact O-N 3.16Å; A179-V181 HydrophobicContact CB-CG2 4.32Å
180	E	83.4	Confident	73.4	Confident	147 Å²	147	60.8 Å²	60.8	69%	0.687	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.8	127.1	157.9	-69	-179.9	179.9	0	0	108.8	D145 I147	D145-E180 HydrophobicContact CB-CG 4.46Å; D145-E180 WeakPolarHBondContact O-CA 3.46Å; I147-E180 HydrophobicContact CD1-CB 3.95Å; I147-E180 HydrophobicContact CD1-CG 4.13Å
181	V	86.9	Confident	73.1	Confident	15 Å²	15	62.3 Å²	62.3	9%	0.091	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	117.1	178.5	-168.6	0	0	0	0	109.1	V144 D145 L146 I147 L170 L171 A179 M183	V144-V181 HydrophobicContact CG2-CG2 3.72Å; D145-V181 PolarHBondContact O-N 2.75Å; L146-V181 HydrophobicContact CD2-CB 4.27Å; I147-V181 PolarHBondContact N-O 2.93Å; L170-V181 HydrophobicContact CD2-CG1 4.45Å; L170-V181 HydrophobicContact CG-CG1 4.38Å; L171-V181 HydrophobicContact CD2-CG2 4.42Å; A179-V181 HydrophobicContact CB-CG2 4.32Å; V181-M183 HydrophobicContact CB-CE 3.82Å; V181-M183 HydrophobicContact CG1-CE 3.45Å; V181-M183 VanDerWaalsContact CG1-CE 3.45Å; V181-M183 WeakPolarHBondContact O-CE 3.22Å; V181-M183 PolarHBondContact O-N 3.33Å
182	L	85.1	Confident	73	Confident	124 Å²	124	64 Å²	64	65%	0.649	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	125.6	176.5	-169.4	71.7	0	0	0	110.1	I147 D184	I147-L182 HydrophobicContact CB-CD1 4.23Å; I147-L182 HydrophobicContact CG2-CD1 4.01Å; L182-D184 PolarHBondContact O-N 3.29Å
183	M	85	Confident	73.1	Confident	9 Å²	9	64 Å²	64	4%	0.044	40%	0.398	C	S	.	.			trans	-90.7	90.2	176.6	-60.8	-65.8	97.2	0	0	109.4	L146 I147 F148 F167 L170 V181 V185 F195	L146-M183 HydrophobicContact CB-CE 4.4Å; L146-M183 HydrophobicContact CB-CG 3.99Å; L146-M183 HydrophobicContact CB-SD 4.21Å; L146-M183 HydrophobicContact CD1-SD 4.4Å; L146-M183 HydrophobicContact CD2-CE 3.71Å; L146-M183 HydrophobicContact CD2-SD 4.1Å; L146-M183 HydrophobicContact CG-SD 4.47Å; I147-M183 PolarHBondContact O-N 3.48Å; F148-M183 HydrophobicContact CB-CB 3.84Å; F148-M183 HydrophobicContact CB-CG 4.13Å; F148-M183 HydrophobicContact CD2-CB 3.83Å; F148-M183 HydrophobicContact CG-CB 4.27Å; F167-M183 HydrophobicContact CE1-SD 3.8Å; F167-M183 HydrophobicContact CZ-SD 4.47Å; L170-M183 HydrophobicContact CD2-CE 3.59Å; L170-M183 HydrophobicContact CD2-SD 4.16Å; V181-M183 HydrophobicContact CB-CE 3.82Å; V181-M183 HydrophobicContact CG1-CE 3.45Å; V181-M183 VanDerWaalsContact CG1-CE 3.45Å; V181-M183 WeakPolarHBondContact O-CE 3.22Å; V181-M183 PolarHBondContact O-N 3.33Å; M183-V185 VanDerWaalsContact C-N 3.27Å; M183-V185 HydrophobicContact CB-CG2 4.28Å; M183-V185 PolarHBondContact O-N 2.72Å; M183-V185 VanDerWaalsContact O-N 3.1Å; M183-F195 HydrophobicContact CG-CE1 4.4Å; M183-F195 HydrophobicContact CG-CE2 4.42Å; M183-F195 HydrophobicContact CG-CZ 3.76Å; M183-F195 HydrophobicContact SD-CZ 4.04Å
184	D	73.8	Confident	73.3	Confident	144 Å²	144	60.5 Å²	60.5	77%	0.77	37%	0.371	S	S	*	.			trans	-84.3	72.6	174.5	-155	28.8	0	0	0	109.5	L182	L182-D184 PolarHBondContact O-N 3.29Å
185	V	70.4	Confident	74.1	Confident	19 Å²	19	59.4 Å²	59.4	12%	0.115	36%	0.363	C	S	.	.			trans	-108.3	89.4	-175.8	179.6	0	0	0	0	108.5	F148 M183 T187 I190 F230	F148-V185 HydrophobicContact CD2-CB 4.46Å; F148-V185 HydrophobicContact CE2-CB 3.94Å; M183-V185 VanDerWaalsContact C-N 3.27Å; M183-V185 HydrophobicContact CB-CG2 4.28Å; M183-V185 PolarHBondContact O-N 2.72Å; M183-V185 VanDerWaalsContact O-N 3.1Å; V185-T187 VanDerWaalsContact CG1-OG1 3.26Å; V185-T187 WeakPolarHBondContact CG1-OG1 3.24Å; V185-T187 PolarHBondContact O-N 3.39Å; V185-T187 VanDerWaalsContact O-N 3.13Å; V185-I190 HydrophobicContact CG1-CD1 4.02Å; V185-F230 HydrophobicContact CG1-CZ 4.33Å
186	D	62.9	Low	75.3	Confident	160 Å²	160	56.9 Å²	56.9	86%	0.856	35%	0.348	S	S	*	.			trans	-73.3	10.2	-179.6	-106.2	-11.5	0	0	0	113.8	A188	D186-A188 PolarHBondContact O-N 3.25Å
187	T	64.9	Low	76.3	Confident	19 Å²	19	55.9 Å²	55.9	12%	0.117	34%	0.337	C	S	.	.			trans	-62.1	115.7	-175	-51.6	0	0	0	0	112.5	V185 G189 I190 E229	V185-T187 VanDerWaalsContact CG1-OG1 3.26Å; V185-T187 WeakPolarHBondContact CG1-OG1 3.24Å; V185-T187 PolarHBondContact O-N 3.39Å; V185-T187 VanDerWaalsContact O-N 3.13Å; T187-G189 PolarHBondContact O-N 3.38Å; T187-I190 HydrophobicContact CG2-CD1 3.69Å; T187-I190 HydrophobicContact CG2-CG1 3.78Å; T187-I190 PolarHBondContact O-N 2.84Å; T187-E229 WeakPolarHBondContact CB-OE2 3.32Å; T187-E229 VanDerWaalsContact CG2-OE1 3.23Å; T187-E229 WeakPolarHBondContact CG2-OE1 3.4Å; T187-E229 WeakPolarHBondContact CG2-OE2 3.37Å; T187-E229 VanDerWaalsContact OG1-CD 3.22Å; T187-E229 PolarHBondContact OG1-OE1 3.03Å; T187-E229 VanDerWaalsContact OG1-OE1 3.12Å; T187-E229 PolarHBondContact OG1-OE2 3.41Å
188	A	58.1	Low	77.4	Confident	87 Å²	87	53.5 Å²	53.5	72%	0.719	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	101.4	174.5	0	0	0	0	0	111.1	D186 Q225	D186-A188 PolarHBondContact O-N 3.25Å; A188-Q225 PolarHBondContact O-NE2 2.84Å
189	G	64.9	Low	78.7	Confident	55 Å²	55	51.9 Å²	51.9	57%	0.567	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	128.9	-14.7	178.4	0	0	0	0	0	115.1	T187	T187-G189 PolarHBondContact O-N 3.38Å
190	I	76.6	Confident	79.5	Confident	12 Å²	12	54.8 Å²	54.8	6%	0.062	32%	0.322	C	S	.	.			trans	-90.6	110.5	178.2	-56.2	-178	0	0	0	110	F148 Q149 V185 T187 F195 L226 F230	F148-I190 HydrophobicContact CE1-CG2 4.06Å; F148-I190 HydrophobicContact CZ-CB 4.47Å; F148-I190 HydrophobicContact CZ-CG2 3.83Å; Q149-I190 PolarHBondContact NE2-O 2.74Å; V185-I190 HydrophobicContact CG1-CD1 4.02Å; T187-I190 HydrophobicContact CG2-CD1 3.69Å; T187-I190 HydrophobicContact CG2-CG1 3.78Å; T187-I190 PolarHBondContact O-N 2.84Å; I190-F195 HydrophobicContact CG2-CB 4.04Å; I190-F195 HydrophobicContact CG2-CD2 4.44Å; I190-L226 HydrophobicContact CD1-CD2 3.63Å; I190-L226 HydrophobicContact CG1-CD2 4.4Å; I190-F230 HydrophobicContact CD1-CE2 4Å; I190-F230 HydrophobicContact CD1-CZ 4.42Å
191	D	81.7	Confident	79.7	Confident	79 Å²	79	49.9 Å²	49.9	42%	0.422	30%	0.298	S	S	.	.			trans	-104.1	174.4	168.8	75	-5	0	0	0	111.7	P193 M194 F195	D191-P193 WeakPolarHBondContact OD1-CD 3.38Å; D191-M194 PolarHBondContact O-N 3.42Å; D191-M194 VanDerWaalsContact O-N 3.1Å; D191-M194 WeakPolarHBondContact OD1-CB 3.19Å; D191-M194 PolarHBondContact OD1-N 2.95Å; D191-F195 PolarHBondContact O-N 3.45Å
192	V	86.4	Confident	79.9	Confident	36 Å²	36	49.4 Å²	49.4	22%	0.218	30%	0.295	C	S	.	.	H	α-helix	trans	-57.7	-44.9	-178.1	177.2	0	0	0	0	112.6	F148 Q149 T151 F153 S196	F148-V192 HydrophobicContact CD1-CG2 4.24Å; F148-V192 HydrophobicContact CE1-CG2 4.41Å; Q149-V192 HydrophobicContact CB-CG2 3.86Å; T151-V192 HydrophobicContact CG2-CG1 3.88Å; F153-V192 HydrophobicContact CE2-CG1 4.22Å; F153-V192 HydrophobicContact CZ-CG1 3.77Å; V192-S196 WeakPolarHBondContact O-CB 3.27Å; V192-S196 PolarHBondContact O-N 3.39Å
193	P	85.5	Confident	80.3	Confident	84 Å²	84	43.5 Å²	43.5	55%	0.545	26%	0.264	S	S	.	.	H	α-helix	trans	-54.3	-47	167.8	-28.6	34	0	0	0	114.6	D191 S196 A197	D191-P193 WeakPolarHBondContact OD1-CD 3.38Å; P193-S196 WeakPolarHBondContact O-CB 3.48Å; P193-S196 PolarHBondContact O-N 3.32Å; P193-A197 PolarHBondContact O-N 3.48Å
194	M	81.6	Confident	80.5	Confident	25 Å²	25	43.3 Å²	43.3	12%	0.123	26%	0.263	C	S	.	.	H	α-helix	trans	-66.6	-41.4	-177.9	-166.5	61.7	72.9	0	0	111.9	D191 S196 A197 L198 F207 V209 V222	D191-M194 PolarHBondContact O-N 3.42Å; D191-M194 VanDerWaalsContact O-N 3.1Å; D191-M194 WeakPolarHBondContact OD1-CB 3.19Å; D191-M194 PolarHBondContact OD1-N 2.95Å; M194-S196 VanDerWaalsContact C-N 3.31Å; M194-S196 PolarHBondContact O-N 2.85Å; M194-A197 PolarHBondContact O-N 3.48Å; M194-A197 VanDerWaalsContact O-N 3.13Å; M194-L198 PolarHBondContact O-N 2.69Å; M194-F207 HydrophobicContact SD-CE1 4.1Å; M194-F207 HydrophobicContact SD-CZ 3.64Å; M194-V209 HydrophobicContact CE-CG2 4.3Å; M194-V209 HydrophobicContact SD-CG2 3.82Å; M194-V222 HydrophobicContact CE-CB 4.48Å; M194-V222 HydrophobicContact CE-CG1 4.06Å; M194-V222 HydrophobicContact CE-CG2 4.14Å; M194-V222 HydrophobicContact CG-CG1 3.92Å; M194-V222 HydrophobicContact SD-CB 4.48Å; M194-V222 HydrophobicContact SD-CG1 3.64Å
195	F	85.3	Confident	81.1	Confident	0 Å²	0	38 Å²	38	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-39.6	173.5	-171.2	-102.8	0	0	0	111.6	L146 F148 F153 F167 M183 I190 D191 A197 L198 L199	L146-F195 HydrophobicContact CD1-CZ 4.27Å; F148-F195 HydrophobicContact CB-CD1 3.92Å; F148-F195 HydrophobicContact CB-CE1 3.89Å; F148-F195 HydrophobicContact CB-CG 4.38Å; F148-F195 HydrophobicContact CB-CZ 4.35Å; F148-F195 HydrophobicContact CD1-CB 3.59Å; F148-F195 AromaticContact CD1-CD1 3.88Å; F148-F195 HydrophobicContact CD1-CD1 3.88Å; F148-F195 HydrophobicContact CD1-CD2 4.24Å; F148-F195 AromaticContact CD1-CG 3.65Å; F148-F195 HydrophobicContact CD1-CG 3.65Å; F148-F195 HydrophobicContact CE1-CB 3.67Å; F148-F195 HydrophobicContact CE1-CG 4.09Å; F148-F195 HydrophobicContact CG-CB 4.46Å; F148-F195 HydrophobicContact CG-CD1 4.08Å; F148-F195 HydrophobicContact CG-CD2 4.34Å; F148-F195 HydrophobicContact CG-CE1 4.4Å; F148-F195 HydrophobicContact CG-CG 4.04Å; F153-F195 AromaticContact CD2-CD1 3.76Å; F153-F195 HydrophobicContact CD2-CD1 3.76Å; F153-F195 AromaticContact CD2-CE1 3.78Å; F153-F195 HydrophobicContact CD2-CE1 3.78Å; F153-F195 HydrophobicContact CE1-CD1 4.49Å; F153-F195 AromaticContact CE2-CD1 3.63Å; F153-F195 HydrophobicContact CE2-CD1 3.63Å; F153-F195 HydrophobicContact CE2-CE1 4.12Å; F153-F195 HydrophobicContact CG-CD1 4.24Å; F153-F195 HydrophobicContact CG-CE1 4.15Å; F153-F195 HydrophobicContact CZ-CD1 4Å; F167-F195 HydrophobicContact CZ-CE2 4.23Å; F167-F195 HydrophobicContact CZ-CZ 4.16Å; M183-F195 HydrophobicContact CG-CE1 4.4Å; M183-F195 HydrophobicContact CG-CE2 4.42Å; M183-F195 HydrophobicContact CG-CZ 3.76Å; M183-F195 HydrophobicContact SD-CZ 4.04Å; I190-F195 HydrophobicContact CG2-CB 4.04Å; I190-F195 HydrophobicContact CG2-CD2 4.44Å; D191-F195 PolarHBondContact O-N 3.45Å; F195-A197 VanDerWaalsContact C-N 3.3Å; F195-A197 PolarHBondContact O-N 3.39Å; F195-L198 HydrophobicContact CD2-CD2 4.35Å; F195-L198 PolarHBondContact O-N 3.29Å; F195-L199 HydrophobicContact CD1-CD1 3.95Å; F195-L199 HydrophobicContact CD1-CG 4.41Å; F195-L199 HydrophobicContact CE1-CD1 3.61Å; F195-L199 HydrophobicContact CE1-CG 4.16Å; F195-L199 HydrophobicContact CZ-CD1 4.3Å; F195-L199 HydrophobicContact CZ-CG 4.47Å; F195-L199 WeakPolarHBondContact O-CG 3.37Å; F195-L199 PolarHBondContact O-N 3.24Å
196	S	88.2	Confident	81.6	Confident	44 Å²	44	43 Å²	43	31%	0.308	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-34.9	172.9	-168.1	0	0	0	0	113	V192 P193 M194 H200	V192-S196 WeakPolarHBondContact O-CB 3.27Å; V192-S196 PolarHBondContact O-N 3.39Å; P193-S196 WeakPolarHBondContact O-CB 3.48Å; P193-S196 PolarHBondContact O-N 3.32Å; M194-S196 VanDerWaalsContact C-N 3.31Å; M194-S196 PolarHBondContact O-N 2.85Å; S196-H200 WeakPolarHBondContact O-CB 3.47Å; S196-H200 PolarHBondContact O-N 3.46Å
197	A	84.7	Confident	82	Confident	12 Å²	12	36.7 Å²	36.7	10%	0.099	23%	0.229	C	C	.	.	H	α-helix	trans	-75	-39.1	177.5	0	0	0	0	0	112.5	P193 M194 F195 H200 Y201 F207 V209	P193-A197 PolarHBondContact O-N 3.48Å; M194-A197 PolarHBondContact O-N 3.48Å; M194-A197 VanDerWaalsContact O-N 3.13Å; F195-A197 VanDerWaalsContact C-N 3.3Å; F195-A197 PolarHBondContact O-N 3.39Å; A197-H200 PolarHBondContact O-N 3.34Å; A197-Y201 WeakPolarHBondContact O-CB 3.42Å; A197-Y201 PolarHBondContact O-N 2.89Å; A197-F207 HydrophobicContact CB-CZ 4.43Å; A197-V209 HydrophobicContact CB-CG2 3.45Å; A197-V209 VanDerWaalsContact CB-CG2 3.45Å
198	L	85.3	Confident	81.8	Confident	7 Å²	7	38.8 Å²	38.8	4%	0.037	26%	0.255	C	S	.	.	H	α-helix	trans	-56.1	-50.3	168.5	168.1	65.1	0	0	0	110.7	M194 F195 H200 Y201 L202 L226 F230	M194-L198 PolarHBondContact O-N 2.69Å; F195-L198 HydrophobicContact CD2-CD2 4.35Å; F195-L198 PolarHBondContact O-N 3.29Å; L198-H200 PolarHBondContact O-N 3.48Å; L198-Y201 WeakPolarHBondContact O-CB 3.15Å; L198-Y201 PolarHBondContact O-N 2.83Å; L198-L202 WeakPolarHBondContact O-CG 3.42Å; L198-L202 PolarHBondContact O-N 2.89Å; L198-L226 HydrophobicContact CB-CD1 4.41Å; L198-L226 HydrophobicContact CD1-CD1 4.22Å; L198-L226 HydrophobicContact CD1-CD2 4.32Å; L198-L226 HydrophobicContact CD2-CD2 3.93Å; L198-F230 HydrophobicContact CD2-CD1 4.35Å; L198-F230 HydrophobicContact CD2-CE1 4.13Å; L198-F230 HydrophobicContact CD2-CE2 4.35Å; L198-F230 HydrophobicContact CD2-CZ 4.14Å
199	L	89.4	Confident	81.5	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-59.9	-46.9	177.4	-71.8	178	0	0	0	111.2	Y136 L146 F153 L160 F167 F195 Y201 L202 Y203	Y136-L199 HydrophobicContact CE2-CB 4.13Å; Y136-L199 WeakPolarHBondContact OH-CB 3.37Å; L146-L199 HydrophobicContact CD1-CD1 4.46Å; L146-L199 HydrophobicContact CD1-CD2 4.02Å; F153-L199 HydrophobicContact CB-CD1 3.68Å; F153-L199 HydrophobicContact CD1-CD1 3.75Å; F153-L199 HydrophobicContact CG-CD1 3.8Å; L160-L199 HydrophobicContact CD2-CD2 3.85Å; F167-L199 HydrophobicContact CE2-CD2 4.31Å; F167-L199 HydrophobicContact CZ-CD2 4.17Å; F195-L199 HydrophobicContact CD1-CD1 3.95Å; F195-L199 HydrophobicContact CD1-CG 4.41Å; F195-L199 HydrophobicContact CE1-CD1 3.61Å; F195-L199 HydrophobicContact CE1-CG 4.16Å; F195-L199 HydrophobicContact CZ-CD1 4.3Å; F195-L199 HydrophobicContact CZ-CG 4.47Å; F195-L199 WeakPolarHBondContact O-CG 3.37Å; F195-L199 PolarHBondContact O-N 3.24Å; L199-Y201 VanDerWaalsContact C-N 3.3Å; L199-Y201 PolarHBondContact O-N 3.13Å; L199-L202 PolarHBondContact O-N 2.8Å; L199-L202 VanDerWaalsContact O-N 3.15Å; L199-Y203 VanDerWaalsContact O-CD2 3.29Å; L199-Y203 WeakPolarHBondContact O-CD2 3.48Å; L199-Y203 PolarHBondContact O-N 2.89Å
200	H	90	Very high	80.8	Confident	73 Å²	73	36.5 Å²	36.5	34%	0.338	23%	0.231	S	C	.	.	H	α-helix	trans	-56.9	-42.3	175.3	-174.9	-85.6	0	0	0	112.7	Y136 S196 A197 L198 L202 Y203 T204	Y136-H200 HydrophobicContact CE1-CB 4.26Å; S196-H200 WeakPolarHBondContact O-CB 3.47Å; S196-H200 PolarHBondContact O-N 3.46Å; A197-H200 PolarHBondContact O-N 3.34Å; L198-H200 PolarHBondContact O-N 3.48Å; H200-L202 VanDerWaalsContact C-N 3.35Å; H200-L202 PolarHBondContact O-N 3.31Å; H200-Y203 PolarHBondContact O-N 3.04Å; H200-T204 PolarHBondContact CE1-OG1 3.48Å; H200-T204 PolarHBondContact ND1-OG1 3.34Å; H200-T204 WeakPolarHBondContact O-CB 3.43Å; H200-T204 WeakPolarHBondContact O-CG2 3.49Å; H200-T204 PolarHBondContact O-N 3.11Å; H200-T204 PolarHBondContact O-OG1 3.23Å
201	Y	87.5	Confident	79.3	Confident	44 Å²	44	40.7 Å²	40.7	17%	0.173	28%	0.277	C	S	.	.	H	α-helix	trans	-62.7	-35.8	177.1	169	-113.5	0	0	0	113.1	A197 L198 L199 Y203 T204 G205 F207 L223 P233	A197-Y201 WeakPolarHBondContact O-CB 3.42Å; A197-Y201 PolarHBondContact O-N 2.89Å; L198-Y201 WeakPolarHBondContact O-CB 3.15Å; L198-Y201 PolarHBondContact O-N 2.83Å; L199-Y201 VanDerWaalsContact C-N 3.3Å; L199-Y201 PolarHBondContact O-N 3.13Å; Y201-Y203 VanDerWaalsContact C-N 3.31Å; Y201-Y203 PolarHBondContact O-N 3.17Å; Y201-T204 PolarHBondContact O-N 2.79Å; Y201-G205 VanDerWaalsContact CD2-C 3.45Å; Y201-G205 WeakPolarHBondContact CE2-O 3.19Å; Y201-G205 WeakPolarHBondContact O-CA 3.17Å; Y201-G205 PolarHBondContact O-N 3.08Å; Y201-F207 HydrophobicContact CD1-CD2 4.15Å; Y201-F207 HydrophobicContact CD2-CB 3.9Å; Y201-F207 HydrophobicContact CD2-CD2 4.38Å; Y201-F207 HydrophobicContact CG-CB 4.2Å; Y201-F207 AromaticContact CG-CD2 3.84Å; Y201-F207 HydrophobicContact CG-CD2 3.84Å; Y201-L223 HydrophobicContact CD1-CD2 4.34Å; Y201-L223 HydrophobicContact CE1-CD2 3.97Å; Y201-P233 HydrophobicContact CE1-CG 3.72Å; Y201-P233 WeakPolarHBondContact OH-CG 3.49Å
202	L	90.5	Very high	77.7	Confident	5 Å²	5	39.3 Å²	39.3	3%	0.026	28%	0.277	C	S	.	.	H	α-helix	trans	-62.9	-36.3	175.7	-66.3	177.9	0	0	0	112.2	L160 R163 C164 F167 L198 L199 H200	L160-L202 HydrophobicContact CD2-CB 4.45Å; L160-L202 HydrophobicContact CD2-CD1 3.65Å; R163-L202 HydrophobicContact CB-CB 4.23Å; R163-L202 HydrophobicContact CB-CD2 4.06Å; R163-L202 WeakPolarHBondContact CG-O 3.45Å; R163-L202 PolarHBondContact NE-O 3.11Å; C164-L202 HydrophobicContact CB-CD1 4.15Å; C164-L202 HydrophobicContact CB-CD2 4.04Å; F167-L202 HydrophobicContact CD2-CD1 3.87Å; F167-L202 HydrophobicContact CE2-CD1 3.83Å; L198-L202 WeakPolarHBondContact O-CG 3.42Å; L198-L202 PolarHBondContact O-N 2.89Å; L199-L202 PolarHBondContact O-N 2.8Å; L199-L202 VanDerWaalsContact O-N 3.15Å; H200-L202 VanDerWaalsContact C-N 3.35Å; H200-L202 PolarHBondContact O-N 3.31Å
203	Y	93.3	Very high	76	Confident	0 Å²	0	44 Å²	44	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-80.7	-30.6	177.8	-73.9	-109.2	0	0	0	113.5	L132 L135 Y136 H156 I159 L160 L199 H200 Y201 L236	L132-Y203 HydrophobicContact CB-CD1 4.42Å; L132-Y203 WeakPolarHBondContact CB-O 3.43Å; L132-Y203 HydrophobicContact CD2-CD1 4.5Å; L135-Y203 HydrophobicContact CD2-CE1 4.24Å; Y136-Y203 HydrophobicContact CD2-CD2 4.18Å; Y136-Y203 HydrophobicContact CD2-CE1 4.48Å; Y136-Y203 AromaticContact CD2-CE2 3.8Å; Y136-Y203 HydrophobicContact CD2-CE2 3.8Å; Y136-Y203 AromaticContact CD2-CZ 3.96Å; Y136-Y203 HydrophobicContact CE2-CE2 4.39Å; Y136-Y203 HydrophobicContact CG-CD2 4.25Å; Y136-Y203 HydrophobicContact CG-CE2 4.31Å; Y136-Y203 HydrophobicContact CG-CG 4.4Å; H156-Y203 PolarHBondContact N-OH 2.59Å; H156-Y203 AromaticContact ND1-CE1 3.42Å; H156-Y203 WeakPolarHBondContact ND1-CE1 3.47Å; H156-Y203 AromaticContact ND1-CZ 3.55Å; H156-Y203 PolarHBondContact ND1-OH 2.62Å; I159-Y203 HydrophobicContact CB-CE1 4.36Å; I159-Y203 HydrophobicContact CD1-CD1 4.07Å; I159-Y203 HydrophobicContact CD1-CE1 3.61Å; I159-Y203 HydrophobicContact CG2-CD1 4.05Å; I159-Y203 HydrophobicContact CG2-CD2 4.35Å; I159-Y203 HydrophobicContact CG2-CE1 3.95Å; I159-Y203 HydrophobicContact CG2-CE2 4.27Å; I159-Y203 HydrophobicContact CG2-CG 4.26Å; L160-Y203 HydrophobicContact CD2-CE2 4.18Å; L199-Y203 VanDerWaalsContact O-CD2 3.29Å; L199-Y203 WeakPolarHBondContact O-CD2 3.48Å; L199-Y203 PolarHBondContact O-N 2.89Å; H200-Y203 PolarHBondContact O-N 3.04Å; Y201-Y203 VanDerWaalsContact C-N 3.31Å; Y201-Y203 PolarHBondContact O-N 3.17Å; Y203-L236 WeakPolarHBondContact O-CD1 3.33Å; Y203-L236 WeakPolarHBondContact O-CD2 3.39Å
204	T	90.4	Very high	74.2	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.031	31%	0.306	C	S	.	.	H	α-helix	trans	-115.1	-13.6	-167	62.1	0	0	0	0	115	Q129 A133 H200 Y201 E206	Q129-T204 WeakPolarHBondContact CG-O 3.3Å; Q129-T204 PolarHBondContact NE2-O 3.49Å; A133-T204 HydrophobicContact CB-CG2 3.59Å; H200-T204 PolarHBondContact CE1-OG1 3.48Å; H200-T204 PolarHBondContact ND1-OG1 3.34Å; H200-T204 WeakPolarHBondContact O-CB 3.43Å; H200-T204 WeakPolarHBondContact O-CG2 3.49Å; H200-T204 PolarHBondContact O-N 3.11Å; H200-T204 PolarHBondContact O-OG1 3.23Å; Y201-T204 PolarHBondContact O-N 2.79Å; T204-E206 PolarHBondContact O-N 3.26Å; T204-E206 VanDerWaalsContact O-N 3.13Å; T204-E206 PolarHBondContact OG1-N 3.15Å; T204-E206 PolarHBondContact OG1-O 3.19Å
205	G	85.8	Confident	72.8	Confident	32 Å²	32	46.7 Å²	46.7	33%	0.33	31%	0.309	S	S	.	.	S	Bend	trans	65.8	3.6	-171.2	0	0	0	0	0	114.6	Y201	Y201-G205 VanDerWaalsContact CD2-C 3.45Å; Y201-G205 WeakPolarHBondContact CE2-O 3.19Å; Y201-G205 WeakPolarHBondContact O-CA 3.17Å; Y201-G205 PolarHBondContact O-N 3.08Å
206	E	81.4	Confident	71.2	Confident	123 Å²	123	54 Å²	54	58%	0.575	34%	0.336	S	S	*	.			trans	-119.5	123.8	-180	-73.4	-175.9	-151.3	0	0	111.6	Q129 T204	Q129-E206 VanDerWaalsContact NE2-CD 3.34Å; Q129-E206 PolarHBondContact NE2-OE1 2.91Å; T204-E206 PolarHBondContact O-N 3.26Å; T204-E206 VanDerWaalsContact O-N 3.13Å; T204-E206 PolarHBondContact OG1-N 3.15Å; T204-E206 PolarHBondContact OG1-O 3.19Å
207	F	70.9	Confident	69.5	Low	29 Å²	29	58.1 Å²	58.1	13%	0.127	35%	0.354	C	S	.	.			trans	-97.9	101.7	-176.7	-164.1	-86.4	0	0	0	110	M194 A197 Y201 V209 N219 V222 L223 L226	M194-F207 HydrophobicContact SD-CE1 4.1Å; M194-F207 HydrophobicContact SD-CZ 3.64Å; A197-F207 HydrophobicContact CB-CZ 4.43Å; Y201-F207 HydrophobicContact CD1-CD2 4.15Å; Y201-F207 HydrophobicContact CD2-CB 3.9Å; Y201-F207 HydrophobicContact CD2-CD2 4.38Å; Y201-F207 HydrophobicContact CG-CB 4.2Å; Y201-F207 AromaticContact CG-CD2 3.84Å; Y201-F207 HydrophobicContact CG-CD2 3.84Å; F207-V209 HydrophobicContact CD1-CG2 4.25Å; F207-V209 HydrophobicContact CE1-CG2 3.61Å; F207-V209 HydrophobicContact CZ-CG2 4.16Å; F207-N219 HydrophobicContact CD1-CB 3.87Å; F207-N219 HydrophobicContact CE1-CB 4.04Å; F207-V222 HydrophobicContact CZ-CG1 4.41Å; F207-L223 HydrophobicContact CB-CD1 3.94Å; F207-L223 HydrophobicContact CB-CD2 4.21Å; F207-L223 HydrophobicContact CB-CG 4.34Å; F207-L223 HydrophobicContact CD1-CD1 4.3Å; F207-L223 HydrophobicContact CD1-CG 4.21Å; F207-L223 HydrophobicContact CD2-CD2 3.61Å; F207-L223 HydrophobicContact CD2-CG 4.05Å; F207-L223 HydrophobicContact CE2-CD2 4.09Å; F207-L223 HydrophobicContact CE2-CG 4.39Å; F207-L223 HydrophobicContact CG-CD1 4.04Å; F207-L223 HydrophobicContact CG-CD2 3.92Å; F207-L223 HydrophobicContact CG-CG 3.95Å; F207-L226 HydrophobicContact CE2-CD1 3.75Å; F207-L226 HydrophobicContact CZ-CD1 3.98Å
208	G	60.3	Low	68.1	Low	63 Å²	63	64 Å²	64	65%	0.649	38%	0.38	S	S	*	.			trans	-117.8	66.9	-168.2	0	0	0	0	0	114.5
209	V	52.3	Low	66.9	Low	41 Å²	41	64.4 Å²	64.4	25%	0.248	38%	0.382	C	S	.	.	S	Bend	trans	-85.6	108.9	166.2	-174.5	0	0	0	0	108.8	M194 A197 F207 S215 N219	M194-V209 HydrophobicContact CE-CG2 4.3Å; M194-V209 HydrophobicContact SD-CG2 3.82Å; A197-V209 HydrophobicContact CB-CG2 3.45Å; A197-V209 VanDerWaalsContact CB-CG2 3.45Å; F207-V209 HydrophobicContact CD1-CG2 4.25Å; F207-V209 HydrophobicContact CE1-CG2 3.61Å; F207-V209 HydrophobicContact CZ-CG2 4.16Å; V209-S215 WeakPolarHBondContact O-CB 3.34Å; V209-N219 WeakPolarHBondContact CB-OD1 3.33Å; V209-N219 PolarHBondContact O-ND2 3.42Å
210	G	49.9	Very low	65.7	Low	52 Å²	52	67.5 Å²	67.5	54%	0.536	40%	0.401	S	S	.	.			trans	76	129.9	172.6	0	0	0	0	0	115.2	A212	G210-A212 PolarHBondContact O-N 2.94Å
211	G	45.7	Very low	64.4	Low	101 Å²	101	69.7 Å²	69.7	100%	1.041	42%	0.415	S	S	*	.	S	Bend	trans	-77.6	36.9	177	0	0	0	0	0	114.8
212	A	46.5	Very low	63.4	Low	49 Å²	49	68.8 Å²	68.8	41%	0.405	41%	0.414	S	S	.	.	S	Bend	trans	-125.2	140.7	-176.9	0	0	0	0	0	111.1	G210 D214 S215	G210-A212 PolarHBondContact O-N 2.94Å; A212-D214 PolarHBondContact O-N 3.28Å; A212-S215 PolarHBondContact O-N 3.3Å
213	E	51.5	Low	62.2	Low	136 Å²	136	71 Å²	71	64%	0.636	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-35	179.7	-74.9	-74	89.6	0	0	112.3	S215 R216	E213-S215 VanDerWaalsContact C-N 3.33Å; E213-S215 PolarHBondContact O-N 2.96Å; E213-R216 VanDerWaalsContact CD-NH1 3.32Å; E213-R216 VanDerWaalsContact O-CB 3.25Å; E213-R216 WeakPolarHBondContact O-CB 3.36Å; E213-R216 WeakPolarHBondContact O-CG 3.4Å; E213-R216 PolarHBondContact O-N 2.89Å; E213-R216 VanDerWaalsContact O-N 3.15Å; E213-R216 WeakPolarHBondContact OE1-CD 3.41Å; E213-R216 IonicContact OE1-CZ 2.71Å; E213-R216 IonicContact OE1-NE 3.32Å; E213-R216 IonicContact OE1-NH1 2.74Å; E213-R216 PolarHBondContact OE1-NH1 3.48Å; E213-R216 IonicContact OE2-NH1 3.95Å; E213-R216 PolarHBondContact OE2-NH1 3.35Å; E213-R216 VanDerWaalsContact OE2-NH1 3.16Å
214	D	46.9	Very low	61	Low	138 Å²	138	73.7 Å²	73.7	74%	0.738	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-33.6	179.8	-62.7	-48.6	0	0	0	113.2	A212 R216 L217	A212-D214 PolarHBondContact O-N 3.28Å; D214-R216 PolarHBondContact O-N 3.44Å; D214-L217 PolarHBondContact O-N 3.25Å
215	S	52.7	Low	59.8	Low	27 Å²	27	76.6 Å²	76.6	19%	0.189	46%	0.455	C	S	.	.	H	α-helix	trans	-64.4	-23.7	177.4	-59	0	0	0	0	112.2	V209 A212 E213 L217 Q218 N219	V209-S215 WeakPolarHBondContact O-CB 3.34Å; A212-S215 PolarHBondContact O-N 3.3Å; E213-S215 VanDerWaalsContact C-N 3.33Å; E213-S215 PolarHBondContact O-N 2.96Å; S215-L217 PolarHBondContact O-N 3.28Å; S215-Q218 PolarHBondContact O-N 3.47Å; S215-N219 WeakPolarHBondContact O-CB 3.43Å; S215-N219 PolarHBondContact O-N 3.17Å; S215-N219 PolarHBondContact O-ND2 3.46Å; S215-N219 PolarHBondContact O-OD1 3.01Å
216	R	53.1	Low	58.9	Low	152 Å²	152	75.5 Å²	75.5	57%	0.574	44%	0.441	S	S	*	.	H	α-helix	trans	-65.6	-22.7	-176.6	-59.3	176.3	62.2	-170.7	-8.2	113.5	E213 D214	E213-R216 VanDerWaalsContact CD-NH1 3.32Å; E213-R216 VanDerWaalsContact O-CB 3.25Å; E213-R216 WeakPolarHBondContact O-CB 3.36Å; E213-R216 WeakPolarHBondContact O-CG 3.4Å; E213-R216 PolarHBondContact O-N 2.89Å; E213-R216 VanDerWaalsContact O-N 3.15Å; E213-R216 WeakPolarHBondContact OE1-CD 3.41Å; E213-R216 IonicContact OE1-CZ 2.71Å; E213-R216 IonicContact OE1-NE 3.32Å; E213-R216 IonicContact OE1-NH1 2.74Å; E213-R216 PolarHBondContact OE1-NH1 3.48Å; E213-R216 IonicContact OE2-NH1 3.95Å; E213-R216 PolarHBondContact OE2-NH1 3.35Å; E213-R216 VanDerWaalsContact OE2-NH1 3.16Å; D214-R216 PolarHBondContact O-N 3.44Å
217	L	51.4	Low	58.3	Low	131 Å²	131	71.3 Å²	71.3	69%	0.686	43%	0.426	S	S	*	.	H	α-helix	trans	-81.6	-46.7	175.7	-65.8	176.3	0	0	0	111.4	D214 S215 N219 V220 D221	D214-L217 PolarHBondContact O-N 3.25Å; S215-L217 PolarHBondContact O-N 3.28Å; L217-N219 PolarHBondContact O-N 3.25Å; L217-V220 WeakPolarHBondContact O-CB 3.4Å; L217-V220 PolarHBondContact O-N 3.43Å; L217-D221 PolarHBondContact O-N 2.91Å
218	Q	56.1	Low	58.2	Low	137 Å²	137	77.4 Å²	77.4	64%	0.64	46%	0.455	S	S	*	.	H	α-helix	trans	-58.7	-36.8	173.8	-67.6	179.6	-15	0	0	111.6	S215 V220 D221 V222	S215-Q218 PolarHBondContact O-N 3.47Å; Q218-V220 PolarHBondContact O-N 2.93Å; Q218-D221 PolarHBondContact O-N 2.6Å; Q218-V222 WeakPolarHBondContact O-CG2 3.3Å; Q218-V222 PolarHBondContact O-N 2.97Å; Q218-V222 VanDerWaalsContact O-N 3.07Å
219	N	59.9	Low	58.5	Low	14 Å²	14	78.6 Å²	78.6	8%	0.075	44%	0.443	C	S	.	.	H	α-helix	trans	-63.5	-24.5	175.8	-67.9	-9.4	0	0	0	113.3	F207 V209 S215 L217 L223	F207-N219 HydrophobicContact CD1-CB 3.87Å; F207-N219 HydrophobicContact CE1-CB 4.04Å; V209-N219 WeakPolarHBondContact CB-OD1 3.33Å; V209-N219 PolarHBondContact O-ND2 3.42Å; S215-N219 WeakPolarHBondContact O-CB 3.43Å; S215-N219 PolarHBondContact O-N 3.17Å; S215-N219 PolarHBondContact O-ND2 3.46Å; S215-N219 PolarHBondContact O-OD1 3.01Å; L217-N219 PolarHBondContact O-N 3.25Å; N219-L223 WeakPolarHBondContact O-CB 3.13Å; N219-L223 WeakPolarHBondContact O-CD1 3.4Å; N219-L223 WeakPolarHBondContact O-CG 3.4Å; N219-L223 PolarHBondContact O-N 2.93Å
220	V	63.3	Low	59.3	Low	66 Å²	66	77.1 Å²	77.1	40%	0.4	43%	0.434	S	S	.	.	H	α-helix	trans	-75.4	-48.4	175.4	172.3	0	0	0	0	110.8	L217 Q218 V222 L223 V224	L217-V220 WeakPolarHBondContact O-CB 3.4Å; L217-V220 PolarHBondContact O-N 3.43Å; Q218-V220 PolarHBondContact O-N 2.93Å; V220-V222 VanDerWaalsContact C-N 3.28Å; V220-V222 PolarHBondContact O-N 3.16Å; V220-L223 PolarHBondContact O-N 3.35Å; V220-V224 WeakPolarHBondContact O-CG2 3.46Å; V220-V224 PolarHBondContact O-N 2.76Å
221	D	63.8	Low	60.1	Low	118 Å²	118	76 Å²	76	63%	0.631	42%	0.422	S	S	*	.	H	α-helix	trans	-61.1	-40.9	179	-64.7	-31.6	0	0	0	111	L217 Q218 V224 Q225	L217-D221 PolarHBondContact O-N 2.91Å; Q218-D221 PolarHBondContact O-N 2.6Å; D221-V224 PolarHBondContact O-N 3.04Å; D221-Q225 PolarHBondContact O-N 2.71Å
222	V	65.6	Low	61	Low	25 Å²	25	76.5 Å²	76.5	15%	0.152	41%	0.405	C	S	.	.	H	α-helix	trans	-71	-37.4	175.6	-179.8	0	0	0	0	112.1	M194 F207 Q218 V220 V224 Q225 L226	M194-V222 HydrophobicContact CE-CB 4.48Å; M194-V222 HydrophobicContact CE-CG1 4.06Å; M194-V222 HydrophobicContact CE-CG2 4.14Å; M194-V222 HydrophobicContact CG-CG1 3.92Å; M194-V222 HydrophobicContact SD-CB 4.48Å; M194-V222 HydrophobicContact SD-CG1 3.64Å; F207-V222 HydrophobicContact CZ-CG1 4.41Å; Q218-V222 WeakPolarHBondContact O-CG2 3.3Å; Q218-V222 PolarHBondContact O-N 2.97Å; Q218-V222 VanDerWaalsContact O-N 3.07Å; V220-V222 VanDerWaalsContact C-N 3.28Å; V220-V222 PolarHBondContact O-N 3.16Å; V222-V224 VanDerWaalsContact C-N 3.28Å; V222-V224 PolarHBondContact O-N 3Å; V222-Q225 PolarHBondContact O-N 3.41Å; V222-L226 HydrophobicContact CG1-CD1 3.77Å; V222-L226 HydrophobicContact CG1-CG 4.12Å; V222-L226 VanDerWaalsContact O-CB 3.24Å; V222-L226 WeakPolarHBondContact O-CB 3.45Å; V222-L226 WeakPolarHBondContact O-CG 3.2Å; V222-L226 PolarHBondContact O-N 3.02Å
223	L	64.8	Low	62.2	Low	51 Å²	51	75.5 Å²	75.5	27%	0.267	39%	0.394	S	S	.	.	H	α-helix	trans	-62.8	-34.2	171.4	-86	167.5	0	0	0	112.5	Y201 F207 N219 V220 S227	Y201-L223 HydrophobicContact CD1-CD2 4.34Å; Y201-L223 HydrophobicContact CE1-CD2 3.97Å; F207-L223 HydrophobicContact CB-CD1 3.94Å; F207-L223 HydrophobicContact CB-CD2 4.21Å; F207-L223 HydrophobicContact CB-CG 4.34Å; F207-L223 HydrophobicContact CD1-CD1 4.3Å; F207-L223 HydrophobicContact CD1-CG 4.21Å; F207-L223 HydrophobicContact CD2-CD2 3.61Å; F207-L223 HydrophobicContact CD2-CG 4.05Å; F207-L223 HydrophobicContact CE2-CD2 4.09Å; F207-L223 HydrophobicContact CE2-CG 4.39Å; F207-L223 HydrophobicContact CG-CD1 4.04Å; F207-L223 HydrophobicContact CG-CD2 3.92Å; F207-L223 HydrophobicContact CG-CG 3.95Å; N219-L223 WeakPolarHBondContact O-CB 3.13Å; N219-L223 WeakPolarHBondContact O-CD1 3.4Å; N219-L223 WeakPolarHBondContact O-CG 3.4Å; N219-L223 PolarHBondContact O-N 2.93Å; V220-L223 PolarHBondContact O-N 3.35Å; L223-S227 WeakPolarHBondContact O-CB 3.41Å; L223-S227 PolarHBondContact O-N 3.29Å; L223-S227 PolarHBondContact O-OG 3.17Å
224	V	68.5	Low	63.7	Low	58 Å²	58	74 Å²	74	35%	0.352	39%	0.391	S	S	.	.	H	α-helix	trans	-67	-52.1	174.2	170.1	0	0	0	0	110.2	V220 D221 V222 L226 S227 E228	V220-V224 WeakPolarHBondContact O-CG2 3.46Å; V220-V224 PolarHBondContact O-N 2.76Å; D221-V224 PolarHBondContact O-N 3.04Å; V222-V224 VanDerWaalsContact C-N 3.28Å; V222-V224 PolarHBondContact O-N 3Å; V224-L226 VanDerWaalsContact C-N 3.3Å; V224-L226 PolarHBondContact O-N 3.47Å; V224-S227 WeakPolarHBondContact O-CA 3.29Å; V224-S227 WeakPolarHBondContact O-CB 3.3Å; V224-S227 PolarHBondContact O-N 2.58Å; V224-S227 PolarHBondContact O-OG 3.22Å; V224-E228 PolarHBondContact O-N 2.87Å
225	Q	66.2	Low	65.7	Low	66 Å²	66	70.8 Å²	70.8	31%	0.308	38%	0.379	S	S	.	.	H	α-helix	trans	-58.8	-41.2	177.5	-170.7	178.3	-5.8	0	0	112	A188 D221 V222 S227 E228 E229	A188-Q225 PolarHBondContact O-NE2 2.84Å; D221-Q225 PolarHBondContact O-N 2.71Å; V222-Q225 PolarHBondContact O-N 3.41Å; Q225-S227 VanDerWaalsContact C-N 3.33Å; Q225-S227 PolarHBondContact O-N 3.33Å; Q225-E228 PolarHBondContact O-N 2.73Å; Q225-E229 PolarHBondContact O-N 3.37Å
226	L	66.4	Low	67.5	Low	8 Å²	8	70.4 Å²	70.4	4%	0.042	38%	0.375	C	S	.	.	H	α-helix	trans	-64.4	-34.9	172.4	-72.2	169.9	0	0	0	112.3	I190 L198 F207 V222 V224 E228 E229 F230	I190-L226 HydrophobicContact CD1-CD2 3.63Å; I190-L226 HydrophobicContact CG1-CD2 4.4Å; L198-L226 HydrophobicContact CB-CD1 4.41Å; L198-L226 HydrophobicContact CD1-CD1 4.22Å; L198-L226 HydrophobicContact CD1-CD2 4.32Å; L198-L226 HydrophobicContact CD2-CD2 3.93Å; F207-L226 HydrophobicContact CE2-CD1 3.75Å; F207-L226 HydrophobicContact CZ-CD1 3.98Å; V222-L226 HydrophobicContact CG1-CD1 3.77Å; V222-L226 HydrophobicContact CG1-CG 4.12Å; V222-L226 VanDerWaalsContact O-CB 3.24Å; V222-L226 WeakPolarHBondContact O-CB 3.45Å; V222-L226 WeakPolarHBondContact O-CG 3.2Å; V222-L226 PolarHBondContact O-N 3.02Å; V224-L226 VanDerWaalsContact C-N 3.3Å; V224-L226 PolarHBondContact O-N 3.47Å; L226-E228 VanDerWaalsContact C-N 3.33Å; L226-E229 PolarHBondContact O-N 3.48Å; L226-F230 HydrophobicContact CB-CD2 4.46Å; L226-F230 HydrophobicContact CD2-CD2 3.71Å; L226-F230 HydrophobicContact CD2-CE2 3.65Å; L226-F230 WeakPolarHBondContact O-CA 3.34Å; L226-F230 VanDerWaalsContact O-CB 3.29Å; L226-F230 WeakPolarHBondContact O-CB 3.39Å; L226-F230 WeakPolarHBondContact O-CD2 3.47Å; L226-F230 PolarHBondContact O-N 3.03Å
227	S	68.4	Low	69.4	Low	36 Å²	36	69.1 Å²	69.1	25%	0.252	38%	0.376	S	S	.	.	H	α-helix	trans	-71.6	-26.5	176	76.3	0	0	0	0	113.4	L223 V224 Q225 G231	L223-S227 WeakPolarHBondContact O-CB 3.41Å; L223-S227 PolarHBondContact O-N 3.29Å; L223-S227 PolarHBondContact O-OG 3.17Å; V224-S227 WeakPolarHBondContact O-CA 3.29Å; V224-S227 WeakPolarHBondContact O-CB 3.3Å; V224-S227 PolarHBondContact O-N 2.58Å; V224-S227 PolarHBondContact O-OG 3.22Å; Q225-S227 VanDerWaalsContact C-N 3.33Å; Q225-S227 PolarHBondContact O-N 3.33Å; S227-G231 CarbonylContact O-C 3.6Å; S227-G231 WeakPolarHBondContact O-CA 3.36Å; S227-G231 PolarHBondContact O-N 2.97Å; S227-G231 VanDerWaalsContact O-N 3.17Å
228	E	68.1	Low	71.4	Confident	156 Å²	156	65.2 Å²	65.2	73%	0.729	36%	0.362	S	S	*	.	H	α-helix	trans	-72	-35	174.3	-68.9	-179.4	163.9	0	0	112	V224 Q225 L226	V224-E228 PolarHBondContact O-N 2.87Å; Q225-E228 PolarHBondContact O-N 2.73Å; L226-E228 VanDerWaalsContact C-N 3.33Å
229	E	66.6	Low	73.2	Confident	88 Å²	88	59.5 Å²	59.5	41%	0.411	34%	0.336	S	S	.	.	H	α-helix	trans	-94.6	-43.5	-178.2	-65.8	-176.1	163.7	0	0	114.2	T187 Q225 L226	T187-E229 WeakPolarHBondContact CB-OE2 3.32Å; T187-E229 VanDerWaalsContact CG2-OE1 3.23Å; T187-E229 WeakPolarHBondContact CG2-OE1 3.4Å; T187-E229 WeakPolarHBondContact CG2-OE2 3.37Å; T187-E229 VanDerWaalsContact OG1-CD 3.22Å; T187-E229 PolarHBondContact OG1-OE1 3.03Å; T187-E229 VanDerWaalsContact OG1-OE1 3.12Å; T187-E229 PolarHBondContact OG1-OE2 3.41Å; Q225-E229 PolarHBondContact O-N 3.37Å; L226-E229 PolarHBondContact O-N 3.48Å
230	F	69.3	Low	74.9	Confident	10 Å²	10	58.9 Å²	58.9	4%	0.044	33%	0.332	C	S	.	.	H	α-helix	trans	-98.7	-10.2	-174.6	-62.2	-95.6	0	0	0	112.9	C164 P165 F166 F167 V185 I190 L198 L226	C164-F230 PolarHBondContact SG-O 2.75Å; P165-F230 WeakPolarHBondContact CD-O 2.99Å; F166-F230 HydrophobicContact CB-CB 4.48Å; F166-F230 HydrophobicContact CB-CD1 3.86Å; F166-F230 HydrophobicContact CB-CG 4.49Å; F166-F230 AromaticContact CD1-CD1 3.56Å; F166-F230 HydrophobicContact CD1-CD1 3.56Å; F166-F230 AromaticContact CD1-CE1 3.48Å; F166-F230 HydrophobicContact CD1-CE1 3.48Å; F166-F230 VanDerWaalsContact CD1-CE1 3.48Å; F166-F230 HydrophobicContact CE1-CD1 4.27Å; F166-F230 AromaticContact CE1-CE1 3.7Å; F166-F230 HydrophobicContact CE1-CE1 3.7Å; F166-F230 AromaticContact CG-CD1 3.79Å; F166-F230 HydrophobicContact CG-CD1 3.79Å; F166-F230 AromaticContact CG-CE1 3.98Å; F166-F230 HydrophobicContact CG-CE1 3.98Å; F166-F230 HydrophobicContact CZ-CE1 4.35Å; F167-F230 HydrophobicContact CE2-CD1 4.42Å; F167-F230 HydrophobicContact CE2-CE1 4.44Å; V185-F230 HydrophobicContact CG1-CZ 4.33Å; I190-F230 HydrophobicContact CD1-CE2 4Å; I190-F230 HydrophobicContact CD1-CZ 4.42Å; L198-F230 HydrophobicContact CD2-CD1 4.35Å; L198-F230 HydrophobicContact CD2-CE1 4.13Å; L198-F230 HydrophobicContact CD2-CE2 4.35Å; L198-F230 HydrophobicContact CD2-CZ 4.14Å; L226-F230 HydrophobicContact CB-CD2 4.46Å; L226-F230 HydrophobicContact CD2-CD2 3.71Å; L226-F230 HydrophobicContact CD2-CE2 3.65Å; L226-F230 WeakPolarHBondContact O-CA 3.34Å; L226-F230 VanDerWaalsContact O-CB 3.29Å; L226-F230 WeakPolarHBondContact O-CB 3.39Å; L226-F230 WeakPolarHBondContact O-CD2 3.47Å; L226-F230 PolarHBondContact O-N 3.03Å
231	G	67	Low	76.4	Confident	28 Å²	28	59.7 Å²	59.7	29%	0.289	33%	0.331	S	S	.	.			trans	82.2	148.3	-172.9	0	0	0	0	0	112.8	S227 P233	S227-G231 CarbonylContact O-C 3.6Å; S227-G231 WeakPolarHBondContact O-CA 3.36Å; S227-G231 PolarHBondContact O-N 2.97Å; S227-G231 VanDerWaalsContact O-N 3.17Å; G231-P233 VanDerWaalsContact O-CD 3.3Å; G231-P233 WeakPolarHBondContact O-CD 3.26Å
232	T	65.5	Low	77.9	Confident	113 Å²	113	54.9 Å²	54.9	69%	0.693	31%	0.309	S	S	*	.			trans	-67.6	116.9	171.4	-40.9	0	0	0	0	110.1
233	P	70.4	Confident	79.4	Confident	27 Å²	27	54 Å²	54	18%	0.175	30%	0.303	C	S	.	.			trans	-76.3	158	178.8	33	-35.9	0	0	0	111.4	R163 Y201 G231	R163-P233 WeakPolarHBondContact O-CB 3.29Å; Y201-P233 HydrophobicContact CE1-CG 3.72Å; Y201-P233 WeakPolarHBondContact OH-CG 3.49Å; G231-P233 VanDerWaalsContact O-CD 3.3Å; G231-P233 WeakPolarHBondContact O-CD 3.26Å
234	N	83.2	Confident	80.8	Confident	104 Å²	104	53.5 Å²	53.5	56%	0.556	30%	0.299	S	S	*	.			trans	-75	-176.8	173.3	-56.8	-64.8	0	0	0	110.8	R163 A238 D239	R163-N234 PolarHBondContact NH1-O 3.3Å; N234-A238 HydrophobicContact CB-CB 4.15Å; N234-D239 WeakPolarHBondContact CB-OD1 3.21Å; N234-D239 PolarHBondContact N-OD2 3.21Å; N234-D239 PolarHBondContact ND2-OD1 3.29Å
235	S	88.9	Confident	82.1	Confident	71 Å²	71	54.8 Å²	54.8	50%	0.497	30%	0.304	S	S	.	.			trans	-59.6	147.7	165.2	64.7	0	0	0	0	110.4	E237 A238 D239	S235-E237 PolarHBondContact O-N 3.04Å; S235-A238 PolarHBondContact O-N 3.23Å; S235-A238 VanDerWaalsContact O-N 3.08Å; S235-A238 VanDerWaalsContact OG-CB 3.29Å; S235-A238 WeakPolarHBondContact OG-CB 3.37Å; S235-A238 PolarHBondContact OG-N 2.74Å; S235-D239 PolarHBondContact O-N 3.35Å
236	L	91	Very high	83.4	Confident	20 Å²	20	60 Å²	60	11%	0.105	32%	0.322	C	S	.	.	H	α-helix	trans	-54.6	-41.7	179.4	179.6	63.5	0	0	0	111.6	Q129 L132 Y203 M240	Q129-L236 HydrophobicContact CB-CD2 4.04Å; Q129-L236 HydrophobicContact CG-CD2 4.03Å; L132-L236 HydrophobicContact CD1-CD1 4.06Å; L132-L236 HydrophobicContact CD1-CD2 4.22Å; L132-L236 HydrophobicContact CD1-CG 4.44Å; Y203-L236 WeakPolarHBondContact O-CD1 3.33Å; Y203-L236 WeakPolarHBondContact O-CD2 3.39Å; L236-M240 HydrophobicContact CD1-CE 3.99Å; L236-M240 HydrophobicContact CD1-CG 4.08Å; L236-M240 HydrophobicContact CG-CG 4.43Å; L236-M240 VanDerWaalsContact O-CB 3.27Å; L236-M240 WeakPolarHBondContact O-CB 3.36Å; L236-M240 WeakPolarHBondContact O-CG 3.2Å; L236-M240 PolarHBondContact O-N 3.09Å
237	E	92.3	Very high	84.7	Confident	125 Å²	125	61 Å²	61	58%	0.584	33%	0.327	S	S	*	.	H	α-helix	trans	-59.1	-46.1	175.4	-173.9	-172.2	170.6	0	0	112.7	S235 M240 K241	S235-E237 PolarHBondContact O-N 3.04Å; E237-M240 PolarHBondContact O-N 3.36Å; E237-K241 WeakPolarHBondContact O-CB 3.44Å; E237-K241 PolarHBondContact O-N 2.73Å
238	A	93.6	Very high	85.7	Confident	49 Å²	49	62.1 Å²	62.1	41%	0.405	33%	0.334	S	S	.	.	H	α-helix	trans	-67.1	-43.2	-177.6	0	0	0	0	0	112.3	N234 S235 G242	N234-A238 HydrophobicContact CB-CB 4.15Å; S235-A238 PolarHBondContact O-N 3.23Å; S235-A238 VanDerWaalsContact O-N 3.08Å; S235-A238 VanDerWaalsContact OG-CB 3.29Å; S235-A238 WeakPolarHBondContact OG-CB 3.37Å; S235-A238 PolarHBondContact OG-N 2.74Å; A238-G242 PolarHBondContact O-N 2.8Å
239	D	94.3	Very high	86.8	Confident	17 Å²	17	58.3 Å²	58.3	9%	0.091	31%	0.314	C	S	.	.	H	α-helix	trans	-72.7	-33.1	177.8	-72.8	-25	0	0	0	112.4	R163 N234 S235 G242 L243	R163-D239 IonicContact CZ-OD2 3.35Å; R163-D239 IonicContact NH1-OD2 2.84Å; R163-D239 PolarHBondContact NH1-OD2 3.48Å; N234-D239 WeakPolarHBondContact CB-OD1 3.21Å; N234-D239 PolarHBondContact N-OD2 3.21Å; N234-D239 PolarHBondContact ND2-OD1 3.29Å; S235-D239 PolarHBondContact O-N 3.35Å; D239-G242 CarbonylContact O-C 3.52Å; D239-G242 PolarHBondContact O-N 3.47Å; D239-L243 PolarHBondContact O-N 2.89Å
240	M	95.8	Very high	88	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-72.5	-35.6	174.8	-71.7	-70.2	169.8	0	0	112.2	L128 L132 I159 R163 L236 E237 G242 L243 F244 I300 Y353	L128-M240 HydrophobicContact CD2-CB 3.94Å; L128-M240 HydrophobicContact CD2-CG 4.05Å; L132-M240 HydrophobicContact CD1-CE 3.62Å; L132-M240 HydrophobicContact CD1-CG 4.45Å; L132-M240 HydrophobicContact CD1-SD 4.31Å; L132-M240 HydrophobicContact CD2-CE 4.22Å; I159-M240 HydrophobicContact CB-CE 4.41Å; I159-M240 HydrophobicContact CG1-CE 4.11Å; I159-M240 HydrophobicContact CG2-CE 3.8Å; R163-M240 HydrophobicContact CG-CE 4.33Å; L236-M240 HydrophobicContact CD1-CE 3.99Å; L236-M240 HydrophobicContact CD1-CG 4.08Å; L236-M240 HydrophobicContact CG-CG 4.43Å; L236-M240 VanDerWaalsContact O-CB 3.27Å; L236-M240 WeakPolarHBondContact O-CB 3.36Å; L236-M240 WeakPolarHBondContact O-CG 3.2Å; L236-M240 PolarHBondContact O-N 3.09Å; E237-M240 PolarHBondContact O-N 3.36Å; M240-G242 VanDerWaalsContact C-N 3.34Å; M240-L243 PolarHBondContact O-N 3.48Å; M240-L243 HydrophobicContact SD-CD2 4.11Å; M240-F244 PolarHBondContact O-N 2.76Å; M240-I300 HydrophobicContact SD-CD1 4.24Å; M240-Y353 WeakPolarHBondContact CB-O 3.29Å
241	K	95.4	Very high	89.1	Confident	83 Å²	83	58.3 Å²	58.3	36%	0.361	31%	0.311	S	S	.	.	H	α-helix	trans	-63.8	-40.8	166.9	-163.2	-158.8	-179.8	-58.9	0	111	E237 L243 F244 D245 T354	E237-K241 WeakPolarHBondContact O-CB 3.44Å; E237-K241 PolarHBondContact O-N 2.73Å; K241-L243 VanDerWaalsContact C-N 3.33Å; K241-L243 PolarHBondContact O-N 3.1Å; K241-F244 WeakPolarHBondContact O-CB 3.49Å; K241-F244 PolarHBondContact O-N 2.89Å; K241-F244 VanDerWaalsContact O-N 3.16Å; K241-D245 IonicContact NZ-OD1 3.73Å; K241-D245 PolarHBondContact NZ-OD1 3.32Å; K241-D245 IonicContact NZ-OD2 3.72Å; K241-D245 PolarHBondContact NZ-OD2 2.79Å; K241-D245 WeakPolarHBondContact O-CB 3.39Å; K241-D245 VanDerWaalsContact O-CG 3.23Å; K241-D245 PolarHBondContact O-N 3.2Å; K241-T354 HydrophobicContact CB-CG2 4.31Å; K241-T354 HydrophobicContact CG-CG2 4.16Å
242	G	95.1	Very high	90.3	Very high	17 Å²	17	57 Å²	57	18%	0.175	30%	0.298	C	S	.	.	H	α-helix	trans	-59.5	-41.7	172.4	0	0	0	0	0	112.8	A238 D239 M240 F244 D245 Y246	A238-G242 PolarHBondContact O-N 2.8Å; D239-G242 CarbonylContact O-C 3.52Å; D239-G242 PolarHBondContact O-N 3.47Å; M240-G242 VanDerWaalsContact C-N 3.34Å; G242-F244 VanDerWaalsContact C-N 3.3Å; G242-F244 PolarHBondContact O-N 3.42Å; G242-D245 PolarHBondContact O-N 3.05Å; G242-Y246 WeakPolarHBondContact O-CB 3.35Å; G242-Y246 WeakPolarHBondContact O-CD2 3.33Å; G242-Y246 PolarHBondContact O-N 2.85Å
243	L	95.9	Very high	91.7	Very high	7 Å²	7	53 Å²	53	4%	0.037	27%	0.272	C	S	.	.	H	α-helix	trans	-63	-36.5	174.6	-177.3	60.2	0	0	0	112	A158 A162 D239 M240 K241 M247 C248 Y353	A158-L243 HydrophobicContact CB-CD1 4.22Å; A158-L243 HydrophobicContact CB-CD2 4.39Å; A162-L243 HydrophobicContact CB-CB 4.08Å; A162-L243 HydrophobicContact CB-CD1 4.35Å; A162-L243 HydrophobicContact CB-CD2 4.41Å; D239-L243 PolarHBondContact O-N 2.89Å; M240-L243 PolarHBondContact O-N 3.48Å; M240-L243 HydrophobicContact SD-CD2 4.11Å; K241-L243 VanDerWaalsContact C-N 3.33Å; K241-L243 PolarHBondContact O-N 3.1Å; L243-M247 WeakPolarHBondContact O-CA 3.38Å; L243-M247 PolarHBondContact O-N 3.03Å; L243-C248 WeakPolarHBondContact CD1-O 3.29Å; L243-Y353 HydrophobicContact CD2-CE1 4.34Å; L243-Y353 HydrophobicContact CG-CD1 4.48Å; L243-Y353 HydrophobicContact CG-CE1 4.21Å
244	F	95.9	Very high	92.8	Very high	40 Å²	40	52 Å²	52	18%	0.175	27%	0.265	C	S	.	.	H	α-helix	trans	-67.4	-49	171.9	179.3	-101.7	0	0	0	112.4	M240 K241 G242 Y246 M247 L349 H350 Y353	M240-F244 PolarHBondContact O-N 2.76Å; K241-F244 WeakPolarHBondContact O-CB 3.49Å; K241-F244 PolarHBondContact O-N 2.89Å; K241-F244 VanDerWaalsContact O-N 3.16Å; G242-F244 VanDerWaalsContact C-N 3.3Å; G242-F244 PolarHBondContact O-N 3.42Å; F244-Y246 VanDerWaalsContact C-N 3.32Å; F244-Y246 PolarHBondContact O-N 3.16Å; F244-M247 HydrophobicContact CD2-CE 3.68Å; F244-M247 HydrophobicContact CE2-CE 4.07Å; F244-M247 HydrophobicContact CG-CE 4.45Å; F244-L349 HydrophobicContact CE2-CB 3.92Å; F244-H350 HydrophobicContact CE1-CB 4.43Å; F244-H350 AromaticContact CE1-CD2 3.84Å; F244-H350 HydrophobicContact CZ-CB 4.13Å; F244-Y353 HydrophobicContact CB-CD1 3.92Å; F244-Y353 HydrophobicContact CB-CG 3.88Å; F244-Y353 AromaticContact CD2-CD2 3.86Å; F244-Y353 HydrophobicContact CD2-CD2 3.86Å; F244-Y353 HydrophobicContact CD2-CE2 4.22Å; F244-Y353 HydrophobicContact CD2-CG 4.03Å; F244-Y353 HydrophobicContact CG-CG 4.36Å
245	D	95.1	Very high	93.2	Very high	85 Å²	85	47 Å²	47	46%	0.455	24%	0.238	S	C	.	.	H	α-helix	trans	-64.7	-32.7	-176.5	-68.7	-10.9	0	0	0	112.7	K241 G242	K241-D245 IonicContact NZ-OD1 3.73Å; K241-D245 PolarHBondContact NZ-OD1 3.32Å; K241-D245 IonicContact NZ-OD2 3.72Å; K241-D245 PolarHBondContact NZ-OD2 2.79Å; K241-D245 WeakPolarHBondContact O-CB 3.39Å; K241-D245 VanDerWaalsContact O-CG 3.23Å; K241-D245 PolarHBondContact O-N 3.2Å; G242-D245 PolarHBondContact O-N 3.05Å
246	Y	93.6	Very high	93.3	Very high	177 Å²	177	44.4 Å²	44.4	69%	0.694	22%	0.218	S	C	*	.	H	α-helix	trans	-103.5	-20	-176.2	-59.2	-53.4	0	0	0	115.4	G242 F244 C248	G242-Y246 WeakPolarHBondContact O-CB 3.35Å; G242-Y246 WeakPolarHBondContact O-CD2 3.33Å; G242-Y246 PolarHBondContact O-N 2.85Å; F244-Y246 VanDerWaalsContact C-N 3.32Å; F244-Y246 PolarHBondContact O-N 3.16Å; Y246-C248 PolarHBondContact O-N 2.82Å; Y246-C248 VanDerWaalsContact O-N 3.13Å
247	M	93.3	Very high	93	Very high	27 Å²	27	45.5 Å²	45.5	13%	0.133	23%	0.227	C	C	.	.			trans	50.3	34.9	-177.4	-72.7	-70.9	162.7	0	0	114.4	L243 F244 Y250 R295	L243-M247 WeakPolarHBondContact O-CA 3.38Å; L243-M247 PolarHBondContact O-N 3.03Å; F244-M247 HydrophobicContact CD2-CE 3.68Å; F244-M247 HydrophobicContact CE2-CE 4.07Å; F244-M247 HydrophobicContact CG-CE 4.45Å; M247-Y250 WeakPolarHBondContact O-CD1 3.36Å; M247-Y250 PolarHBondContact O-N 3.25Å; M247-R295 HydrophobicContact CB-CB 4.11Å; M247-R295 WeakPolarHBondContact CE-O 3.49Å; M247-R295 HydrophobicContact CG-CB 3.9Å; M247-R295 HydrophobicContact SD-CB 3.79Å; M247-R295 VanDerWaalsContact SD-O 3.4Å
248	C	90	Very high	92.2	Very high	61 Å²	61	40.9 Å²	40.9	41%	0.412	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	130.3	177.9	-64.4	0	0	0	0	111.2	L243 Y246 H297	L243-C248 WeakPolarHBondContact CD1-O 3.29Å; Y246-C248 PolarHBondContact O-N 2.82Å; Y246-C248 VanDerWaalsContact O-N 3.13Å; C248-H297 PolarHBondContact O-NE2 3.07Å; C248-H297 VanDerWaalsContact O-NE2 3.1Å
249	Y	89.9	Confident	90.6	Very high	75 Å²	75	44.9 Å²	44.9	29%	0.294	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.8	27.4	-174.4	-52.2	-85.9	0	0	0	114.9	A161 D251 H297	A161-Y249 HydrophobicContact CB-CD2 3.95Å; A161-Y249 HydrophobicContact CB-CE2 3.38Å; Y249-D251 PolarHBondContact O-N 2.87Å; Y249-H297 PolarHBondContact O-CD2 2.93Å; Y249-H297 VanDerWaalsContact O-CD2 3.29Å
250	Y	93	Very high	88.8	Confident	84 Å²	84	48 Å²	48	33%	0.329	25%	0.246	S	C	.	.			trans	-56.3	137	169.6	80.1	-80	0	0	0	111.5	M247 L253 R295 H297 P330	M247-Y250 WeakPolarHBondContact O-CD1 3.36Å; M247-Y250 PolarHBondContact O-N 3.25Å; Y250-L253 HydrophobicContact CD2-CD2 4.1Å; Y250-L253 HydrophobicContact CE2-CD2 3.78Å; Y250-L253 HydrophobicContact CE2-CG 4.37Å; Y250-R295 HydrophobicContact CD1-CG 4.33Å; Y250-R295 HydrophobicContact CD2-CB 3.9Å; Y250-R295 HydrophobicContact CD2-CG 3.63Å; Y250-R295 HydrophobicContact CE2-CG 3.86Å; Y250-R295 HydrophobicContact CG-CB 3.91Å; Y250-R295 HydrophobicContact CG-CG 3.88Å; Y250-H297 PolarHBondContact N-NE2 3.02Å; Y250-P330 HydrophobicContact CE2-CB 4.31Å; Y250-P330 HydrophobicContact CE2-CG 4.26Å
251	D	91.7	Very high	86.6	Confident	15 Å²	15	52 Å²	52	8%	0.08	27%	0.265	C	S	.	.			trans	-134.7	2.4	-174.6	68.7	-15.3	0	0	0	112.9	Y177 Y249 A296 H297 K298 P330 T331	Y177-D251 HydrophobicContact CE2-CB 3.74Å; Y177-D251 PolarHBondContact OH-OD2 3.2Å; Y249-D251 PolarHBondContact O-N 2.87Å; D251-A296 PolarHBondContact N-O 3.23Å; D251-H297 WeakPolarHBondContact OD1-CA 3.3Å; D251-K298 WeakPolarHBondContact O-CE 3.4Å; D251-K298 WeakPolarHBondContact OD1-CG 3.5Å; D251-K298 PolarHBondContact OD1-N 2.99Å; D251-K298 WeakPolarHBondContact OD2-CD 3.14Å; D251-K298 WeakPolarHBondContact OD2-CE 3.47Å; D251-K298 WeakPolarHBondContact OD2-CG 3.5Å; D251-P330 CarbonylContact O-C 3.54Å; D251-P330 WeakPolarHBondContact O-CA 3.41Å; D251-T331 PolarHBondContact O-N 3.04Å
252	A	93.3	Very high	84.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.3	171	0	0	0	0	0	111.2	A296 K298 L301 T331	A252-A296 HydrophobicContact CB-CB 4.36Å; A252-A296 PolarHBondContact N-O 3.44Å; A252-A296 PolarHBondContact O-N 2.78Å; A252-K298 HydrophobicContact CB-CG 4.22Å; A252-L301 HydrophobicContact CB-CD1 4.16Å; A252-T331 WeakPolarHBondContact CA-O 3.37Å
253	L	94.1	Very high	82.2	Confident	30 Å²	30	60.8 Å²	60.8	16%	0.157	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	122.7	172	-71.6	177.7	0	0	0	109.3	Y250 D293 L294 R295 P330 T331 R332 I333	Y250-L253 HydrophobicContact CD2-CD2 4.1Å; Y250-L253 HydrophobicContact CE2-CD2 3.78Å; Y250-L253 HydrophobicContact CE2-CG 4.37Å; L253-D293 HydrophobicContact CB-CB 4.27Å; L253-D293 HydrophobicContact CD1-CB 4.39Å; L253-D293 HydrophobicContact CD2-CB 4.22Å; L253-L294 CarbonylContact C-O 3.58Å; L253-L294 WeakPolarHBondContact CA-O 3.21Å; L253-R295 HydrophobicContact CD2-CG 3.92Å; L253-P330 HydrophobicContact CD1-CB 4.49Å; L253-P330 HydrophobicContact CD1-CG 3.8Å; L253-P330 HydrophobicContact CG-CB 4.21Å; L253-P330 HydrophobicContact CG-CG 4.04Å; L253-T331 PolarHBondContact N-O 3.21Å; L253-R332 HydrophobicContact CB-CG 4.41Å; L253-I333 PolarHBondContact O-N 3.24Å
254	L	93.7	Very high	79.8	Confident	4 Å²	4	66.9 Å²	66.9	2%	0.021	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	109.5	171.4	-55.6	-171.7	0	0	0	108.9	L294 A296 L301 I333 L335 V345 L349	L254-L294 HydrophobicContact CB-CB 4.33Å; L254-L294 PolarHBondContact N-O 2.67Å; L254-L294 PolarHBondContact O-N 3.07Å; L254-A296 HydrophobicContact CG-CB 4.43Å; L254-L301 HydrophobicContact CD2-CD1 4.23Å; L254-I333 HydrophobicContact CD2-CB 3.87Å; L254-I333 HydrophobicContact CD2-CD1 3.96Å; L254-I333 HydrophobicContact CD2-CG1 4.42Å; L254-I333 HydrophobicContact CD2-CG2 4.11Å; L254-L335 HydrophobicContact CB-CD1 4.27Å; L254-L335 HydrophobicContact CD1-CD1 4.29Å; L254-V345 HydrophobicContact CD1-CG2 4.11Å; L254-L349 HydrophobicContact CD1-CD1 4.21Å; L254-L349 HydrophobicContact CD1-CD2 3.92Å; L254-L349 HydrophobicContact CD1-CG 4.29Å
255	S	91.7	Very high	77.1	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	159.3	174.9	58.6	0	0	0	0	110.3	D293 R332 I333 V334 L335	S255-D293 WeakPolarHBondContact CB-OD1 3.21Å; S255-R332 PolarHBondContact OG-NE 2.69Å; S255-I333 PolarHBondContact N-O 3.26Å; S255-I333 PolarHBondContact OG-O 3.12Å; S255-V334 WeakPolarHBondContact OG-CA 3.37Å; S255-L335 PolarHBondContact O-N 3.48Å
256	F	89.9	Confident	74.4	Confident	16 Å²	16	69.4 Å²	69.4	7%	0.07	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	151	176	-67.8	-90.1	0	0	0	109.7	L294 L335 E337 I340 R342 V345	F256-L294 HydrophobicContact CE2-CD1 4.27Å; F256-L335 WeakPolarHBondContact CA-O 3.36Å; F256-L335 HydrophobicContact CD1-CB 4.07Å; F256-L335 HydrophobicContact CE1-CB 3.99Å; F256-L335 HydrophobicContact CE1-CD1 4.02Å; F256-L335 HydrophobicContact CZ-CD1 3.97Å; F256-E337 HydrophobicContact CD1-CB 4.4Å; F256-I340 WeakPolarHBondContact CE1-O 3.5Å; F256-R342 HydrophobicContact CD1-CB 4.04Å; F256-R342 HydrophobicContact CD1-CG 4.41Å; F256-R342 HydrophobicContact CD2-CB 4.41Å; F256-R342 HydrophobicContact CD2-CG 3.89Å; F256-R342 HydrophobicContact CE1-CB 4.01Å; F256-R342 HydrophobicContact CE1-CG 4.32Å; F256-R342 HydrophobicContact CE2-CB 4.39Å; F256-R342 HydrophobicContact CE2-CG 3.8Å; F256-R342 HydrophobicContact CG-CB 4.26Å; F256-R342 HydrophobicContact CG-CG 4.21Å; F256-R342 HydrophobicContact CZ-CB 4.2Å; F256-R342 HydrophobicContact CZ-CG 4.03Å; F256-V345 HydrophobicContact CE2-CG1 4.14Å; F256-V345 HydrophobicContact CZ-CB 3.78Å; F256-V345 HydrophobicContact CZ-CG1 3.74Å; F256-V345 HydrophobicContact CZ-CG2 3.95Å
257	S	85.1	Confident	71.9	Confident	43 Å²	43	67.9 Å²	67.9	30%	0.301	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128	167	57.1	0	0	0	0	109.4	V334 L335 E337	S257-V334 WeakPolarHBondContact OG-CG1 3.07Å; S257-L335 PolarHBondContact N-O 3.45Å; S257-E337 PolarHBondContact O-N 2.85Å
258	S	75.9	Confident	69.3	Low	28 Å²	28	75.8 Å²	75.8	20%	0.196	42%	0.422	C	S	.	.			trans	-105.1	151.5	171.5	76	0	0	0	0	111.5	S260 E261	S258-S260 PolarHBondContact O-N 3.39Å; S258-E261 WeakPolarHBondContact CA-OE1 3.27Å; S258-E261 VanDerWaalsContact CB-OE1 3.23Å; S258-E261 WeakPolarHBondContact CB-OE1 3.35Å; S258-E261 PolarHBondContact N-OE1 3.18Å; S258-E261 PolarHBondContact N-OE2 3.42Å; S258-E261 PolarHBondContact O-N 2.85Å; S258-E261 PolarHBondContact OG-OE1 3.13Å
259	D	60.3	Low	66.8	Low	133 Å²	133	83 Å²	83	71%	0.711	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-19.7	174.1	-78.9	-33.7	0	0	0	113.3
260	S	56.3	Low	64.2	Low	82 Å²	82	83.5 Å²	83.5	57%	0.573	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-40.6	179.1	-49.4	0	0	0	0	112.4	S258 M262 I263	S258-S260 PolarHBondContact O-N 3.39Å; S260-M262 PolarHBondContact O-N 3.29Å; S260-I263 PolarHBondContact O-N 3.29Å; S260-I263 VanDerWaalsContact O-N 3.11Å
261	E	50.1	Low	61.2	Low	84 Å²	84	84.4 Å²	84.4	39%	0.393	49%	0.493	S	S	.	.	H	α-helix	trans	-63.3	-30.8	-178.3	-68.8	141.7	-123.8	0	0	112.1	S258 I263 G265	S258-E261 WeakPolarHBondContact CA-OE1 3.27Å; S258-E261 VanDerWaalsContact CB-OE1 3.23Å; S258-E261 WeakPolarHBondContact CB-OE1 3.35Å; S258-E261 PolarHBondContact N-OE1 3.18Å; S258-E261 PolarHBondContact N-OE2 3.42Å; S258-E261 PolarHBondContact O-N 2.85Å; S258-E261 PolarHBondContact OG-OE1 3.13Å; E261-I263 PolarHBondContact O-N 3Å; E261-G265 PolarHBondContact O-N 3.34Å
262	M	49.1	Very low	58.5	Low	164 Å²	164	90.4 Å²	90.4	81%	0.808	53%	0.531	S	S	*	.	H	α-helix	trans	-67	-13.5	178.2	-67.5	-90.6	-88.3	0	0	113.2	S260	S260-M262 PolarHBondContact O-N 3.29Å
263	I	47.8	Very low	55.8	Low	122 Å²	122	95.4 Å²	95.4	63%	0.626	57%	0.572	S	S	*	*	H	α-helix	trans	-94.9	-49.6	179.4	-59.8	177.5	0	0	0	110.9	S260 E261 G265 S266	S260-I263 PolarHBondContact O-N 3.29Å; S260-I263 VanDerWaalsContact O-N 3.11Å; E261-I263 PolarHBondContact O-N 3Å; I263-G265 PolarHBondContact O-N 2.88Å; I263-S266 PolarHBondContact O-OG 2.95Å
264	D	45.4	Very low	52.7	Low	134 Å²	134	98.7 Å²	98.7	72%	0.717	60%	0.603	S	S	*	*	H	α-helix	trans	-75.3	-21.7	-176.2	-84.7	-27.7	0	0	0	114.1	S266 N267	D264-S266 PolarHBondContact O-N 3.34Å; D264-N267 PolarHBondContact O-N 3.15Å
265	G	40.8	Very low	50.1	Low	76 Å²	76	105 Å²	105	78%	0.784	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-0.2	175.1	0	0	0	0	0	115.8	E261 I263	E261-G265 PolarHBondContact O-N 3.34Å; I263-G265 PolarHBondContact O-N 2.88Å
266	S	38.2	Very low	47.6	Very low	102 Å²	102	110.9 Å²	110.9	71%	0.713	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	-16.4	-177.2	62.4	0	0	0	0	115.4	I263 D264	I263-S266 PolarHBondContact O-OG 2.95Å; D264-S266 PolarHBondContact O-N 3.34Å
267	N	39.8	Very low	45	Very low	146 Å²	146	116.3 Å²	116.3	78%	0.781	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	-16.6	-161	-133.4	3.6	0	0	0	117.4	D264	D264-N267 PolarHBondContact O-N 3.15Å
268	E	40.2	Very low	42.6	Very low	193 Å²	193	118.3 Å²	118.3	90%	0.902	74%	0.742	S	S	*	*			trans	-99.3	94.2	-179.4	-68.3	-128.8	137.5	0	0	114
269	R	37.2	Very low	40.3	Very low	212 Å²	212	120.9 Å²	120.9	80%	0.8	77%	0.773	S	S	*	*			trans	-136.3	90.8	158.4	-84.5	-166.9	174.8	-163.2	1.3	110
270	G	34	Very low	39.3	Very low	86 Å²	86	123.7 Å²	123.7	89%	0.887	79%	0.787	S	S	*	*			trans	-171.9	18.2	-173.6	0	0	0	0	0	121.1
271	A	31.5	Very low	38	Very low	102 Å²	102	123.6 Å²	123.6	84%	0.843	80%	0.799	S	S	*	*			trans	-141.8	147.8	173.7	0	0	0	0	0	112.6
272	V	35.2	Very low	37.2	Very low	142 Å²	142	125.1 Å²	125.1	86%	0.861	82%	0.819	S	S	*	*			trans	-123.3	137.5	-177.6	-75.7	0	0	0	0	112.6
273	A	35.7	Very low	36.3	Very low	105 Å²	105	122.8 Å²	122.8	87%	0.868	82%	0.819	S	S	*	*			trans	37	107.2	152.4	0	0	0	0	0	119.6
274	A	30	Very low	35.5	Very low	99 Å²	99	121.1 Å²	121.1	82%	0.818	83%	0.832	S	S	*	*			trans	-144.8	131	147.6	0	0	0	0	0	110.6
275	V	39.3	Very low	34.5	Very low	137 Å²	137	118.3 Å²	118.3	83%	0.83	83%	0.834	S	S	*	*			trans	-105.6	130.7	170.4	174.5	0	0	0	0	108.6
276	P	39.1	Very low	34.3	Very low	122 Å²	122	119.2 Å²	119.2	79%	0.792	84%	0.843	S	S	*	*			trans	-115.1	128.5	161.6	34.2	-23.7	0	0	0	112
277	T	34.7	Very low	33.8	Very low	130 Å²	130	117.5 Å²	117.5	80%	0.798	84%	0.842	S	S	*	*			trans	-91.1	127.3	173	48.1	0	0	0	0	111.9
278	G	34	Very low	33.7	Very low	85 Å²	85	115.6 Å²	115.6	88%	0.876	85%	0.847	S	S	*	*			trans	68.4	117.1	147.1	0	0	0	0	0	118.9
279	G	27.2	Very low	33.5	Very low	82 Å²	82	111.4 Å²	111.4	85%	0.845	83%	0.834	S	S	*	*			trans	-168	124.2	165.2	0	0	0	0	0	111.5
280	L	39.3	Very low	33.7	Very low	192 Å²	192	106.3 Å²	106.3	100%	1.005	83%	0.828	S	S	*	*			trans	-95.6	124.1	177.1	-148.5	78.9	0	0	0	109.4
281	G	29.4	Very low	34.8	Very low	81 Å²	81	107.8 Å²	107.8	84%	0.835	81%	0.812	S	S	*	*			trans	-160.7	145.2	-179.5	0	0	0	0	0	110.9
282	S	33.5	Very low	36.6	Very low	116 Å²	116	109.1 Å²	109.1	81%	0.811	80%	0.801	S	S	*	*			trans	-115.5	165.5	-165.5	-165.3	0	0	0	0	114.2
283	S	30.7	Very low	39	Very low	115 Å²	115	104.3 Å²	104.3	80%	0.804	77%	0.771	S	S	*	*			trans	70.5	126.7	165.4	73.1	0	0	0	0	119.7
284	G	29.6	Very low	41.6	Very low	87 Å²	87	101 Å²	101	90%	0.897	74%	0.738	S	S	*	*				103.7	75.1	126.1	0	0	0	0	0	117.9
285	G	26.4	Very low	44.7	Very low	75 Å²	75	102.3 Å²	102.3	77%	0.773	72%	0.722	S	S	*	*			trans	173.5	115.8	164.3	0	0	0	0	0	113	G287	G285-G287 PolarHBondContact O-N 3.32Å
286	G	35.7	Very low	47.4	Very low	94 Å²	94	95.8 Å²	95.8	97%	0.969	68%	0.682	S	S	*	*			trans	-80.5	100.7	174.4	0	0	0	0	0	111.2
287	G	27.4	Very low	50.1	Low	66 Å²	66	90 Å²	90	68%	0.68	65%	0.645	S	S	*	*			trans	-115.1	141.6	162.9	0	0	0	0	0	109.2	G285 T289	G285-G287 PolarHBondContact O-N 3.32Å; G287-T289 PolarHBondContact O-N 2.89Å
288	A	38.2	Very low	53	Low	107 Å²	107	84.2 Å²	84.2	88%	0.884	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-64.4	132.1	-179.6	0	0	0	0	0	110.9
289	T	35.2	Very low	56	Low	104 Å²	104	80.4 Å²	80.4	64%	0.638	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-76.1	136	171.6	41.9	0	0	0	0	110.1	G287	G287-T289 PolarHBondContact O-N 2.89Å
290	P	41.1	Very low	59.3	Low	105 Å²	105	76.5 Å²	76.5	68%	0.682	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-74.1	146.8	175.1	31.4	-34.5	0	0	0	111	E292	P290-E292 PolarHBondContact O-N 3.11Å
291	E	57.2	Low	62.1	Low	118 Å²	118	67.4 Å²	67.4	55%	0.551	48%	0.481	S	S	*	.			trans	37	54.5	151.3	-70.5	171.7	-131.9	0	0	118.5	D293	E291-D293 PolarHBondContact O-N 3.15Å; E291-D293 VanDerWaalsContact O-N 3.08Å
292	E	68.9	Low	65.3	Low	129 Å²	129	63.5 Å²	63.5	60%	0.603	44%	0.441	S	S	*	.			trans	-71.2	103.9	161.8	-70	-173.9	-168.5	0	0	110.2	P290 L294 R342	P290-E292 PolarHBondContact O-N 3.11Å; E292-L294 PolarHBondContact O-N 3.12Å; E292-R342 PolarHBondContact O-NH2 2.84Å
293	D	85.7	Confident	68.3	Low	42 Å²	42	58.3 Å²	58.3	23%	0.225	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-57.6	125.9	166.5	-89.2	11.8	0	0	0	109.8	L253 S255 E291 R332	L253-D293 HydrophobicContact CB-CB 4.27Å; L253-D293 HydrophobicContact CD1-CB 4.39Å; L253-D293 HydrophobicContact CD2-CB 4.22Å; S255-D293 WeakPolarHBondContact CB-OD1 3.21Å; E291-D293 PolarHBondContact O-N 3.15Å; E291-D293 VanDerWaalsContact O-N 3.08Å; D293-R332 IonicContact OD1-CZ 3.92Å; D293-R332 IonicContact OD1-NE 2.62Å; D293-R332 IonicContact OD1-NH2 2.73Å; D293-R332 PolarHBondContact OD1-NH2 3.3Å; D293-R332 IonicContact OD2-CZ 3.25Å; D293-R332 IonicContact OD2-NE 3.81Å; D293-R332 PolarHBondContact OD2-NE 2.76Å; D293-R332 IonicContact OD2-NH2 2.8Å; D293-R332 PolarHBondContact OD2-NH2 3.46Å
294	L	91.5	Very high	71.5	Confident	34 Å²	34	53 Å²	53	18%	0.178	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	130.9	-173.8	-62.7	175.2	0	0	0	111.7	L253 L254 F256 E292 V345 L349	L253-L294 CarbonylContact C-O 3.58Å; L253-L294 WeakPolarHBondContact CA-O 3.21Å; L254-L294 HydrophobicContact CB-CB 4.33Å; L254-L294 PolarHBondContact N-O 2.67Å; L254-L294 PolarHBondContact O-N 3.07Å; F256-L294 HydrophobicContact CE2-CD1 4.27Å; E292-L294 PolarHBondContact O-N 3.12Å; L294-V345 HydrophobicContact CD1-CB 4.22Å; L294-V345 HydrophobicContact CD1-CG1 3.22Å; L294-V345 HydrophobicContact CD1-CG2 3.95Å; L294-L349 HydrophobicContact CB-CD1 4.39Å
295	R	95.3	Very high	74.7	Confident	127 Å²	127	48.9 Å²	48.9	48%	0.479	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	142.7	-178.4	-62.6	178.1	-174.6	167.4	6.4	111.6	M247 Y250 L253	M247-R295 HydrophobicContact CB-CB 4.11Å; M247-R295 WeakPolarHBondContact CE-O 3.49Å; M247-R295 HydrophobicContact CG-CB 3.9Å; M247-R295 HydrophobicContact SD-CB 3.79Å; M247-R295 VanDerWaalsContact SD-O 3.4Å; Y250-R295 HydrophobicContact CD1-CG 4.33Å; Y250-R295 HydrophobicContact CD2-CB 3.9Å; Y250-R295 HydrophobicContact CD2-CG 3.63Å; Y250-R295 HydrophobicContact CE2-CG 3.86Å; Y250-R295 HydrophobicContact CG-CB 3.91Å; Y250-R295 HydrophobicContact CG-CG 3.88Å; L253-R295 HydrophobicContact CD2-CG 3.92Å
296	A	96.3	Very high	78	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	171.4	174.6	0	0	0	0	0	111.5	D251 A252 L254 L301 L349	D251-A296 PolarHBondContact N-O 3.23Å; A252-A296 HydrophobicContact CB-CB 4.36Å; A252-A296 PolarHBondContact N-O 3.44Å; A252-A296 PolarHBondContact O-N 2.78Å; L254-A296 HydrophobicContact CG-CB 4.43Å; A296-L301 HydrophobicContact CB-CD1 3.87Å; A296-L301 HydrophobicContact CB-CD2 4.28Å; A296-L301 HydrophobicContact CB-CG 4.14Å; A296-L349 HydrophobicContact CB-CD2 4.21Å
297	H	96	Very high	80.9	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	26%	0.262	C	S	.	.			trans	-114	124.7	176.4	-57.3	90.9	0	0	0	110.1	A158 C248 Y249 Y250 D251 A299 I300 L301 Y353	A158-H297 VanDerWaalsContact CB-CD2 3.47Å; A158-H297 WeakPolarHBondContact CB-CD2 3.29Å; C248-H297 PolarHBondContact O-NE2 3.07Å; C248-H297 VanDerWaalsContact O-NE2 3.1Å; Y249-H297 PolarHBondContact O-CD2 2.93Å; Y249-H297 VanDerWaalsContact O-CD2 3.29Å; Y250-H297 PolarHBondContact N-NE2 3.02Å; D251-H297 WeakPolarHBondContact OD1-CA 3.3Å; H297-A299 PolarHBondContact O-N 3.47Å; H297-I300 HydrophobicContact CB-CB 4.35Å; H297-I300 HydrophobicContact CB-CG1 4.03Å; H297-I300 PolarHBondContact O-N 3.49Å; H297-L301 WeakPolarHBondContact O-CG 3.39Å; H297-L301 PolarHBondContact O-N 3.4Å; H297-Y353 PolarHBondContact N-OH 3.07Å; H297-Y353 VanDerWaalsContact N-OH 3.11Å; H297-Y353 AromaticContact ND1-CE1 3.46Å; H297-Y353 WeakPolarHBondContact ND1-CE1 3.45Å; H297-Y353 AromaticContact ND1-CZ 3.57Å; H297-Y353 PolarHBondContact ND1-OH 3.28Å
298	K	95.3	Very high	84.2	Confident	8 Å²	8	42 Å²	42	4%	0.035	23%	0.231	C	C	.	.	H	α-helix	trans	-52.8	-40	175.9	-66.4	176.6	-151.5	175.9	0	112	C141 Y177 D251 A252 I300 L301 S302 L312 E321 T331	C141-K298 HydrophobicContact CB-CB 3.94Å; Y177-K298 WeakPolarHBondContact OH-CD 3.47Å; Y177-K298 WeakPolarHBondContact OH-CE 3.28Å; Y177-K298 PolarHBondContact OH-NZ 2.93Å; D251-K298 WeakPolarHBondContact O-CE 3.4Å; D251-K298 WeakPolarHBondContact OD1-CG 3.5Å; D251-K298 PolarHBondContact OD1-N 2.99Å; D251-K298 WeakPolarHBondContact OD2-CD 3.14Å; D251-K298 WeakPolarHBondContact OD2-CE 3.47Å; D251-K298 WeakPolarHBondContact OD2-CG 3.5Å; A252-K298 HydrophobicContact CB-CG 4.22Å; K298-I300 PolarHBondContact O-N 3.05Å; K298-L301 PolarHBondContact O-N 2.86Å; K298-S302 WeakPolarHBondContact O-CB 3.48Å; K298-S302 PolarHBondContact O-N 2.99Å; K298-S302 PolarHBondContact O-OG 3.24Å; K298-L312 HydrophobicContact CB-CD1 3.98Å; K298-L312 HydrophobicContact CD-CD2 4.26Å; K298-L312 HydrophobicContact CG-CD1 4.2Å; K298-L312 HydrophobicContact CG-CD2 3.99Å; K298-E321 IonicContact NZ-OE1 3.75Å; K298-T331 WeakPolarHBondContact CE-OG1 3.21Å; K298-T331 PolarHBondContact NZ-OG1 3.08Å
299	A	95.8	Very high	87	Confident	5 Å²	5	39.7 Å²	39.7	4%	0.041	20%	0.199	C	C	.	.	H	α-helix	trans	-53.8	-50.5	175.4	0	0	0	0	0	111.9	L135 H156 I159 H297 S302 A303	L135-A299 HydrophobicContact CD2-CB 4.11Å; H156-A299 HydrophobicContact CB-CB 4.24Å; I159-A299 HydrophobicContact CD1-CB 4.25Å; H297-A299 PolarHBondContact O-N 3.47Å; A299-S302 PolarHBondContact O-OG 3.42Å; A299-A303 VanDerWaalsContact O-CB 3.3Å; A299-A303 WeakPolarHBondContact O-CB 3.38Å; A299-A303 PolarHBondContact O-N 2.89Å
300	I	97.8	Very high	89.9	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-73.7	-44.4	-179.1	-55	-59	0	0	0	111	L132 I159 M240 H297 K298 S302 A303 R304 M352 Y353	L132-I300 HydrophobicContact CD2-CD1 3.9Å; I159-I300 HydrophobicContact CD1-CD1 4.18Å; I159-I300 HydrophobicContact CG1-CD1 4.42Å; M240-I300 HydrophobicContact SD-CD1 4.24Å; H297-I300 HydrophobicContact CB-CB 4.35Å; H297-I300 HydrophobicContact CB-CG1 4.03Å; H297-I300 PolarHBondContact O-N 3.49Å; K298-I300 PolarHBondContact O-N 3.05Å; I300-S302 VanDerWaalsContact C-N 3.32Å; I300-S302 PolarHBondContact O-N 2.87Å; I300-A303 PolarHBondContact O-N 3.27Å; I300-R304 HydrophobicContact CG2-CG 3.99Å; I300-R304 WeakPolarHBondContact O-CB 3.22Å; I300-R304 WeakPolarHBondContact O-CG 3.21Å; I300-R304 PolarHBondContact O-N 3.49Å; I300-M352 HydrophobicContact CG2-CB 4.17Å; I300-Y353 HydrophobicContact CB-CE1 4.21Å; I300-Y353 HydrophobicContact CB-CE2 4.29Å; I300-Y353 HydrophobicContact CG1-CD1 4.25Å; I300-Y353 HydrophobicContact CG1-CE1 3.77Å; I300-Y353 HydrophobicContact CG2-CD1 4.28Å; I300-Y353 HydrophobicContact CG2-CD2 3.85Å; I300-Y353 HydrophobicContact CG2-CE1 4.16Å; I300-Y353 HydrophobicContact CG2-CE2 3.73Å; I300-Y353 HydrophobicContact CG2-CG 4.13Å
301	L	97.3	Very high	92.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-57.5	-44.3	176.4	-66.4	178.8	0	0	0	111.8	A252 L254 A296 H297 K298 S305 F308 I333 L349 M352	A252-L301 HydrophobicContact CB-CD1 4.16Å; L254-L301 HydrophobicContact CD2-CD1 4.23Å; A296-L301 HydrophobicContact CB-CD1 3.87Å; A296-L301 HydrophobicContact CB-CD2 4.28Å; A296-L301 HydrophobicContact CB-CG 4.14Å; H297-L301 WeakPolarHBondContact O-CG 3.39Å; H297-L301 PolarHBondContact O-N 3.4Å; K298-L301 PolarHBondContact O-N 2.86Å; L301-S305 WeakPolarHBondContact O-CB 3.47Å; L301-S305 PolarHBondContact O-N 3.1Å; L301-F308 HydrophobicContact CB-CB 3.99Å; L301-F308 HydrophobicContact CB-CD2 4.45Å; L301-F308 HydrophobicContact CB-CG 4.29Å; L301-F308 HydrophobicContact CD2-CD2 4.16Å; L301-F308 HydrophobicContact CD2-CE2 4.35Å; L301-I333 HydrophobicContact CD1-CD1 4.08Å; L301-L349 HydrophobicContact CD2-CD2 4.18Å; L301-M352 HydrophobicContact CD2-SD 3.74Å
302	S	96.6	Very high	94.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-80.3	-23.4	-178.6	67.1	0	0	0	0	114.4	K298 A299 I300 R309	K298-S302 WeakPolarHBondContact O-CB 3.48Å; K298-S302 PolarHBondContact O-N 2.99Å; K298-S302 PolarHBondContact O-OG 3.24Å; A299-S302 PolarHBondContact O-OG 3.42Å; I300-S302 VanDerWaalsContact C-N 3.32Å; I300-S302 PolarHBondContact O-N 2.87Å; S302-R309 WeakPolarHBondContact O-CB 3.37Å; S302-R309 WeakPolarHBondContact O-CD 3.49Å; S302-R309 PolarHBondContact O-NH1 2.93Å
303	A	97	Very high	95.2	Very high	7 Å²	7	26.7 Å²	26.7	6%	0.058	13%	0.126	C	C	.	.	H	α-helix	trans	-67	-56.4	167.4	0	0	0	0	0	110.2	D131 L135 A299 I300 R309	D131-A303 HydrophobicContact CB-CB 4.29Å; L135-A303 HydrophobicContact CB-CB 3.99Å; L135-A303 HydrophobicContact CD1-CB 4.22Å; L135-A303 HydrophobicContact CD2-CB 4.17Å; L135-A303 HydrophobicContact CG-CB 4.34Å; A299-A303 VanDerWaalsContact O-CB 3.3Å; A299-A303 WeakPolarHBondContact O-CB 3.38Å; A299-A303 PolarHBondContact O-N 2.89Å; I300-A303 PolarHBondContact O-N 3.27Å; A303-R309 PolarHBondContact O-NH1 3.05Å; A303-R309 VanDerWaalsContact O-NH1 3.17Å
304	R	97.1	Very high	95.4	Very high	4 Å²	4	31.7 Å²	31.7	2%	0.015	14%	0.142	C	C	.	.	H	α-helix	trans	-83.4	-17	-164	-53.6	-69.7	-82.4	143.8	-1.9	114.5	P126 D131 I300 C351 M352 D355 F404	P126-R304 PolarHBondContact O-NH1 3.47Å; P126-R304 VanDerWaalsContact O-NH1 3.15Å; D131-R304 WeakPolarHBondContact OD2-CD 3.29Å; D131-R304 IonicContact OD2-CZ 2.78Å; D131-R304 IonicContact OD2-NE 2.67Å; D131-R304 IonicContact OD2-NH1 3.51Å; D131-R304 PolarHBondContact OD2-NH1 3.32Å; I300-R304 HydrophobicContact CG2-CG 3.99Å; I300-R304 WeakPolarHBondContact O-CB 3.22Å; I300-R304 WeakPolarHBondContact O-CG 3.21Å; I300-R304 PolarHBondContact O-N 3.49Å; R304-C351 PolarHBondContact NH2-O 3.45Å; R304-C351 VanDerWaalsContact NH2-O 3.08Å; R304-M352 HydrophobicContact CB-CB 4.29Å; R304-M352 HydrophobicContact CB-CG 3.97Å; R304-M352 HydrophobicContact CG-CB 4.26Å; R304-M352 HydrophobicContact CG-CG 4.49Å; R304-M352 WeakPolarHBondContact CG-O 3.31Å; R304-M352 PolarHBondContact NE-O 2.91Å; R304-D355 IonicContact CZ-OD1 2.66Å; R304-D355 IonicContact NH1-OD1 2.94Å; R304-D355 PolarHBondContact NH1-OD1 3.34Å; R304-D355 IonicContact NH2-OD1 3.2Å; R304-D355 PolarHBondContact NH2-OD1 2.8Å; R304-F404 HydrophobicContact CB-CD2 4.47Å; R304-F404 HydrophobicContact CB-CE2 4.12Å; R304-F404 WeakPolarHBondContact O-CD2 3.44Å
305	S	97.3	Very high	95.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	14%	0.143	C	C	.	.			trans	-134.2	114.8	179.2	171	0	0	0	0	111.6	L301 F307 F308 R309 L402	L301-S305 WeakPolarHBondContact O-CB 3.47Å; L301-S305 PolarHBondContact O-N 3.1Å; S305-F307 PolarHBondContact O-N 3.48Å; S305-F307 WeakPolarHBondContact OG-CB 3.37Å; S305-F307 PolarHBondContact OG-N 3.37Å; S305-F308 PolarHBondContact O-N 3.47Å; S305-F308 PolarHBondContact OG-N 2.94Å; S305-F308 VanDerWaalsContact OG-N 3.15Å; S305-R309 WeakPolarHBondContact O-CB 3.39Å; S305-R309 PolarHBondContact O-N 2.99Å; S305-L402 WeakPolarHBondContact CB-O 3.5Å; S305-L402 PolarHBondContact OG-O 3.13Å
306	P	96.4	Very high	94.8	Very high	27 Å²	27	30 Å²	30	18%	0.175	14%	0.138	C	C	.	.	H	α-helix	trans	-54.3	-36.6	167.4	-24	31.5	0	0	0	113.2	R309 N310 E403	P306-R309 PolarHBondContact O-N 3.01Å; P306-N310 VanDerWaalsContact O-CB 3.29Å; P306-N310 WeakPolarHBondContact O-CB 3.25Å; P306-N310 VanDerWaalsContact O-CG 3.24Å; P306-N310 PolarHBondContact O-N 3.31Å; P306-N310 PolarHBondContact O-ND2 3.36Å; P306-E403 HydrophobicContact CB-CB 3.85Å; P306-E403 HydrophobicContact CB-CG 4.4Å; P306-E403 WeakPolarHBondContact CD-O 3.43Å; P306-E403 HydrophobicContact CG-CB 3.66Å
307	F	96.6	Very high	94.4	Very high	58 Å²	58	38.2 Å²	38.2	25%	0.254	17%	0.169	S	C	.	.	H	α-helix	trans	-58.2	-56.2	174.3	171.7	-92.3	0	0	0	111.8	S305 R309 N310 L311 F401 L402	S305-F307 PolarHBondContact O-N 3.48Å; S305-F307 WeakPolarHBondContact OG-CB 3.37Å; S305-F307 PolarHBondContact OG-N 3.37Å; F307-R309 VanDerWaalsContact C-N 3.34Å; F307-R309 PolarHBondContact O-N 2.87Å; F307-N310 PolarHBondContact O-N 3.27Å; F307-L311 PolarHBondContact O-N 3.03Å; F307-F401 HydrophobicContact CD2-CE1 4.28Å; F307-F401 HydrophobicContact CD2-CZ 4.31Å; F307-F401 HydrophobicContact CE1-CE1 4.29Å; F307-F401 AromaticContact CE2-CE1 3.82Å; F307-F401 HydrophobicContact CE2-CE1 3.82Å; F307-F401 HydrophobicContact CE2-CE2 4.49Å; F307-F401 AromaticContact CE2-CZ 3.64Å; F307-F401 HydrophobicContact CE2-CZ 3.64Å; F307-F401 AromaticContact CZ-CE1 3.83Å; F307-F401 HydrophobicContact CZ-CE1 3.83Å; F307-F401 AromaticContact CZ-CZ 3.94Å; F307-F401 HydrophobicContact CZ-CZ 3.94Å; F307-L402 HydrophobicContact CD1-CD2 3.6Å; F307-L402 HydrophobicContact CE1-CD2 4.07Å; F307-L402 HydrophobicContact CG-CD2 4.22Å
308	F	96.7	Very high	93.9	Very high	5 Å²	5	42.1 Å²	42.1	2%	0.022	19%	0.193	C	C	.	.	H	α-helix	trans	-66.3	-34.8	179.5	-73.7	-58.5	0	0	0	112.4	L301 S305 L311 L312 I333 L335 M352 L402	L301-F308 HydrophobicContact CB-CB 3.99Å; L301-F308 HydrophobicContact CB-CD2 4.45Å; L301-F308 HydrophobicContact CB-CG 4.29Å; L301-F308 HydrophobicContact CD2-CD2 4.16Å; L301-F308 HydrophobicContact CD2-CE2 4.35Å; S305-F308 PolarHBondContact O-N 3.47Å; S305-F308 PolarHBondContact OG-N 2.94Å; S305-F308 VanDerWaalsContact OG-N 3.15Å; F308-L311 HydrophobicContact CD1-CD2 4.23Å; F308-L311 PolarHBondContact O-N 3.37Å; F308-L312 WeakPolarHBondContact O-CB 3.43Å; F308-L312 VanDerWaalsContact O-CG 3.3Å; F308-L312 WeakPolarHBondContact O-CG 3.4Å; F308-L312 PolarHBondContact O-N 3.39Å; F308-I333 HydrophobicContact CD1-CD1 4.47Å; F308-I333 HydrophobicContact CE1-CG2 4.25Å; F308-L335 HydrophobicContact CE1-CD2 4.09Å; F308-L335 HydrophobicContact CZ-CD2 4.19Å; F308-M352 HydrophobicContact CD2-CE 4.13Å; F308-M352 HydrophobicContact CE2-CE 4.11Å; F308-L402 HydrophobicContact CD2-CD2 4.27Å; F308-L402 HydrophobicContact CE2-CD1 4.33Å; F308-L402 HydrophobicContact CE2-CD2 3.61Å; F308-L402 HydrophobicContact CZ-CD2 3.89Å
309	R	96.1	Very high	93	Very high	58 Å²	58	43.3 Å²	43.3	22%	0.219	21%	0.208	C	C	.	.	H	α-helix	trans	-57.9	-49	171.7	-175.5	165.6	55	-117.2	11	112	Y140 S302 A303 S305 P306 F307 L311 L312 Q313	Y140-R309 HydrophobicContact CD2-CG 4.45Å; S302-R309 WeakPolarHBondContact O-CB 3.37Å; S302-R309 WeakPolarHBondContact O-CD 3.49Å; S302-R309 PolarHBondContact O-NH1 2.93Å; A303-R309 PolarHBondContact O-NH1 3.05Å; A303-R309 VanDerWaalsContact O-NH1 3.17Å; S305-R309 WeakPolarHBondContact O-CB 3.39Å; S305-R309 PolarHBondContact O-N 2.99Å; P306-R309 PolarHBondContact O-N 3.01Å; F307-R309 VanDerWaalsContact C-N 3.34Å; F307-R309 PolarHBondContact O-N 2.87Å; R309-L311 VanDerWaalsContact C-N 3.33Å; R309-L311 PolarHBondContact O-N 2.78Å; R309-L312 PolarHBondContact O-N 3.31Å; R309-Q313 WeakPolarHBondContact O-CB 3.33Å; R309-Q313 VanDerWaalsContact O-CG 3.29Å; R309-Q313 WeakPolarHBondContact O-CG 3.48Å; R309-Q313 PolarHBondContact O-N 3.38Å
310	N	95.8	Very high	92.2	Very high	76 Å²	76	47.5 Å²	47.5	41%	0.406	23%	0.227	S	C	.	.	H	α-helix	trans	-67.1	-33.4	179.6	-76.1	-39.4	0	0	0	112.5	P306 F307 R314	P306-N310 VanDerWaalsContact O-CB 3.29Å; P306-N310 WeakPolarHBondContact O-CB 3.25Å; P306-N310 VanDerWaalsContact O-CG 3.24Å; P306-N310 PolarHBondContact O-N 3.31Å; P306-N310 PolarHBondContact O-ND2 3.36Å; F307-N310 PolarHBondContact O-N 3.27Å; N310-R314 WeakPolarHBondContact O-CB 3.47Å; N310-R314 PolarHBondContact O-N 3.11Å
311	L	93.8	Very high	91.1	Very high	58 Å²	58	48.1 Å²	48.1	30%	0.304	23%	0.23	S	C	.	.	H	α-helix	trans	-66	-52.7	173.2	-177.7	65.9	0	0	0	111.6	F307 F308 R309 R314 R315 I333	F307-L311 PolarHBondContact O-N 3.03Å; F308-L311 HydrophobicContact CD1-CD2 4.23Å; F308-L311 PolarHBondContact O-N 3.37Å; R309-L311 VanDerWaalsContact C-N 3.33Å; R309-L311 PolarHBondContact O-N 2.78Å; L311-R314 WeakPolarHBondContact O-CB 3.44Å; L311-R314 PolarHBondContact O-N 3.41Å; L311-R314 VanDerWaalsContact O-N 3.08Å; L311-R315 PolarHBondContact O-N 2.94Å; L311-R315 VanDerWaalsContact O-N 3.15Å; L311-I333 HydrophobicContact CD2-CG2 4.03Å
312	L	93.1	Very high	89.7	Confident	7 Å²	7	54 Å²	54	4%	0.037	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-43.8	-178.9	-71.3	166.4	0	0	0	111.8	K298 F308 R309 R314 R315 I316 T331 I333	K298-L312 HydrophobicContact CB-CD1 3.98Å; K298-L312 HydrophobicContact CD-CD2 4.26Å; K298-L312 HydrophobicContact CG-CD1 4.2Å; K298-L312 HydrophobicContact CG-CD2 3.99Å; F308-L312 WeakPolarHBondContact O-CB 3.43Å; F308-L312 VanDerWaalsContact O-CG 3.3Å; F308-L312 WeakPolarHBondContact O-CG 3.4Å; F308-L312 PolarHBondContact O-N 3.39Å; R309-L312 PolarHBondContact O-N 3.31Å; L312-R314 PolarHBondContact O-N 3.02Å; L312-R315 PolarHBondContact O-N 3.11Å; L312-I316 WeakPolarHBondContact O-CG1 3.46Å; L312-I316 PolarHBondContact O-N 3.2Å; L312-T331 HydrophobicContact CD2-CG2 4.06Å; L312-I333 HydrophobicContact CD2-CD1 4.44Å
313	Q	91.5	Very high	88.3	Confident	42 Å²	42	58 Å²	58	20%	0.196	28%	0.283	C	S	.	.	H	α-helix	trans	-60.5	-30.1	173.3	-73.8	-175.2	15.6	0	0	113	Y140 R309 R317	Y140-Q313 VanDerWaalsContact CD1-NE2 3.33Å; R309-Q313 WeakPolarHBondContact O-CB 3.33Å; R309-Q313 VanDerWaalsContact O-CG 3.29Å; R309-Q313 WeakPolarHBondContact O-CG 3.48Å; R309-Q313 PolarHBondContact O-N 3.38Å; Q313-R317 VanDerWaalsContact O-CG 3.29Å; Q313-R317 WeakPolarHBondContact O-CG 3.35Å; Q313-R317 PolarHBondContact O-N 3.34Å; Q313-R317 VanDerWaalsContact O-N 3.1Å; Q313-R317 PolarHBondContact O-NE 2.92Å
314	R	90.9	Very high	87	Confident	148 Å²	148	59 Å²	59	56%	0.558	29%	0.286	S	S	*	.	H	α-helix	trans	-69.4	-45.3	175.5	-162.4	-175.4	-56.7	174	3.6	110.9	N310 L311 L312 I316 R317 T318	N310-R314 WeakPolarHBondContact O-CB 3.47Å; N310-R314 PolarHBondContact O-N 3.11Å; L311-R314 WeakPolarHBondContact O-CB 3.44Å; L311-R314 PolarHBondContact O-N 3.41Å; L311-R314 VanDerWaalsContact O-N 3.08Å; L312-R314 PolarHBondContact O-N 3.02Å; R314-I316 VanDerWaalsContact C-N 3.28Å; R314-I316 PolarHBondContact O-N 2.82Å; R314-R317 PolarHBondContact O-N 2.83Å; R314-R317 VanDerWaalsContact O-N 3.09Å; R314-T318 PolarHBondContact O-N 3.45Å; R314-T318 PolarHBondContact O-OG1 2.75Å
315	R	88.4	Confident	85.5	Confident	53 Å²	53	62.4 Å²	62.4	20%	0.2	30%	0.299	C	S	.	.	H	α-helix	trans	-61.6	-33.5	175.9	-167.9	174.6	-78.4	-179.1	14.8	112.9	L311 L312 T318 G319 E320 E321 E324 R332	L311-R315 PolarHBondContact O-N 2.94Å; L311-R315 VanDerWaalsContact O-N 3.15Å; L312-R315 PolarHBondContact O-N 3.11Å; R315-T318 WeakPolarHBondContact CA-OG1 3.49Å; R315-T318 PolarHBondContact O-OG1 3.42Å; R315-G319 PolarHBondContact O-N 3.22Å; R315-E320 HydrophobicContact CG-CB 3.44Å; R315-E320 VanDerWaalsContact CG-CB 3.44Å; R315-E320 HydrophobicContact CG-CG 4.37Å; R315-E320 IonicContact NE-OE2 3.95Å; R315-E320 PolarHBondContact NE-OE2 3.13Å; R315-E320 PolarHBondContact O-N 2.82Å; R315-E321 HydrophobicContact CG-CB 4.21Å; R315-E321 PolarHBondContact O-N 3.02Å; R315-E324 IonicContact CZ-OE1 2.97Å; R315-E324 IonicContact NH1-OE1 3.95Å; R315-E324 PolarHBondContact NH1-OE1 3.42Å; R315-E324 IonicContact NH1-OE2 2.87Å; R315-R332 PolarHBondContact NH1-O 3.18Å; R315-R332 PolarHBondContact NH2-O 2.85Å
316	I	84.9	Confident	83.9	Confident	72 Å²	72	67.5 Å²	67.5	37%	0.369	33%	0.331	S	S	.	.	H	α-helix	trans	-67.2	-45.9	171.9	-66.5	165.3	0	0	0	110.6	L312 R314 T318 G319 E321	L312-I316 WeakPolarHBondContact O-CG1 3.46Å; L312-I316 PolarHBondContact O-N 3.2Å; R314-I316 VanDerWaalsContact C-N 3.28Å; R314-I316 PolarHBondContact O-N 2.82Å; I316-T318 VanDerWaalsContact C-N 3.34Å; I316-T318 PolarHBondContact O-N 3.15Å; I316-G319 PolarHBondContact O-N 3.08Å; I316-E321 HydrophobicContact CG1-CB 3.96Å; I316-E321 HydrophobicContact CG1-CG 3.87Å
317	R	87.1	Confident	82.3	Confident	173 Å²	173	72 Å²	72	65%	0.653	35%	0.353	S	S	*	.	H	α-helix	trans	-68.2	-26.2	-179.8	-72.1	177.6	-125.8	153.1	-3.6	114.3	Q313 R314	Q313-R317 VanDerWaalsContact O-CG 3.29Å; Q313-R317 WeakPolarHBondContact O-CG 3.35Å; Q313-R317 PolarHBondContact O-N 3.34Å; Q313-R317 VanDerWaalsContact O-N 3.1Å; Q313-R317 PolarHBondContact O-NE 2.92Å; R314-R317 PolarHBondContact O-N 2.83Å; R314-R317 VanDerWaalsContact O-N 3.09Å
318	T	86	Confident	81.1	Confident	82 Å²	82	76.6 Å²	76.6	50%	0.503	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-10	174.8	51.8	0	0	0	0	113.7	R314 R315 I316 E320	R314-T318 PolarHBondContact O-N 3.45Å; R314-T318 PolarHBondContact O-OG1 2.75Å; R315-T318 WeakPolarHBondContact CA-OG1 3.49Å; R315-T318 PolarHBondContact O-OG1 3.42Å; I316-T318 VanDerWaalsContact C-N 3.34Å; I316-T318 PolarHBondContact O-N 3.15Å; T318-E320 VanDerWaalsContact CB-OE1 3.26Å; T318-E320 WeakPolarHBondContact CB-OE1 3.39Å; T318-E320 PolarHBondContact O-N 2.65Å; T318-E320 VanDerWaalsContact OG1-CD 3.27Å; T318-E320 PolarHBondContact OG1-OE1 3.49Å
319	G	77.6	Confident	80.3	Confident	34 Å²	34	79.5 Å²	79.5	35%	0.351	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	-1.5	-178.9	0	0	0	0	0	114.8	R315 I316 E321 M322	R315-G319 PolarHBondContact O-N 3.22Å; I316-G319 PolarHBondContact O-N 3.08Å; G319-E321 PolarHBondContact O-N 2.91Å; G319-M322 WeakPolarHBondContact O-CB 3.4Å; G319-M322 PolarHBondContact O-N 2.88Å; G319-M322 VanDerWaalsContact O-N 3.14Å
320	E	77.7	Confident	79.9	Confident	93 Å²	93	78.9 Å²	78.9	44%	0.435	40%	0.396	S	S	.	.	H	α-helix	trans	-53.6	-43	169.8	-75.8	160.7	-116.4	0	0	111.3	R315 T318 M322 T323 E324	R315-E320 HydrophobicContact CG-CB 3.44Å; R315-E320 VanDerWaalsContact CG-CB 3.44Å; R315-E320 HydrophobicContact CG-CG 4.37Å; R315-E320 IonicContact NE-OE2 3.95Å; R315-E320 PolarHBondContact NE-OE2 3.13Å; R315-E320 PolarHBondContact O-N 2.82Å; T318-E320 VanDerWaalsContact CB-OE1 3.26Å; T318-E320 WeakPolarHBondContact CB-OE1 3.39Å; T318-E320 PolarHBondContact O-N 2.65Å; T318-E320 VanDerWaalsContact OG1-CD 3.27Å; T318-E320 PolarHBondContact OG1-OE1 3.49Å; E320-M322 PolarHBondContact O-N 3.28Å; E320-T323 PolarHBondContact O-N 2.96Å; E320-T323 VanDerWaalsContact O-N 3.13Å; E320-T323 PolarHBondContact O-OG1 3.42Å; E320-E324 PolarHBondContact O-N 3.1Å
321	E	74.4	Confident	79.6	Confident	14 Å²	14	75.3 Å²	75.3	7%	0.065	38%	0.377	C	S	.	.	H	α-helix	trans	-66	-25.1	-178.5	-162.9	-98.5	-176.5	0	0	112.7	K298 R315 I316 G319 E324 R325	K298-E321 IonicContact NZ-OE1 3.75Å; R315-E321 HydrophobicContact CG-CB 4.21Å; R315-E321 PolarHBondContact O-N 3.02Å; I316-E321 HydrophobicContact CG1-CB 3.96Å; I316-E321 HydrophobicContact CG1-CG 3.87Å; G319-E321 PolarHBondContact O-N 2.91Å; E321-E324 PolarHBondContact O-N 3.25Å; E321-R325 WeakPolarHBondContact O-CG 3.26Å; E321-R325 PolarHBondContact O-N 3.04Å; E321-R325 IonicContact OE1-CZ 3.12Å; E321-R325 IonicContact OE1-NE 2.69Å; E321-R325 PolarHBondContact OE1-NE 3.45Å; E321-R325 IonicContact OE1-NH2 2.7Å; E321-R325 PolarHBondContact OE1-NH2 2.85Å; E321-R325 IonicContact OE2-CZ 3.3Å; E321-R325 IonicContact OE2-NE 2.88Å; E321-R325 PolarHBondContact OE2-NE 3.43Å; E321-R325 IonicContact OE2-NH2 2.67Å; E321-R325 PolarHBondContact OE2-NH2 3.08Å
322	M	69.3	Low	79.5	Confident	124 Å²	124	77.8 Å²	77.8	61%	0.611	38%	0.382	S	S	*	.	H	α-helix	trans	-69.4	-32.8	175.4	-169.9	66.5	174.9	0	0	112.2	G319 E320 T326	G319-M322 WeakPolarHBondContact O-CB 3.4Å; G319-M322 PolarHBondContact O-N 2.88Å; G319-M322 VanDerWaalsContact O-N 3.14Å; E320-M322 PolarHBondContact O-N 3.28Å; M322-T326 WeakPolarHBondContact O-CB 3.47Å; M322-T326 PolarHBondContact O-N 3.33Å; M322-T326 VanDerWaalsContact O-N 3.12Å; M322-T326 PolarHBondContact O-OG1 3.47Å
323	T	65.9	Low	79.4	Confident	83 Å²	83	77.6 Å²	77.6	51%	0.509	38%	0.382	S	S	.	.	H	α-helix	trans	-75.5	-39.1	175.2	71.8	0	0	0	0	110.7	E320 R325 T326 L327	E320-T323 PolarHBondContact O-N 2.96Å; E320-T323 VanDerWaalsContact O-N 3.13Å; E320-T323 PolarHBondContact O-OG1 3.42Å; T323-R325 PolarHBondContact O-N 3.31Å; T323-T326 PolarHBondContact O-N 2.99Å; T323-L327 WeakPolarHBondContact O-CB 3.37Å; T323-L327 WeakPolarHBondContact O-CG 3.21Å; T323-L327 PolarHBondContact O-N 3.46Å
324	E	69.6	Low	79.5	Confident	27 Å²	27	79.5 Å²	79.5	13%	0.126	40%	0.396	C	S	.	.	H	α-helix	trans	-59.4	-44.3	172.6	-65.6	-179.7	156.1	0	0	111.8	R315 E320 E321 L327 Q328 T329 T331	R315-E324 IonicContact CZ-OE1 2.97Å; R315-E324 IonicContact NH1-OE1 3.95Å; R315-E324 PolarHBondContact NH1-OE1 3.42Å; R315-E324 IonicContact NH1-OE2 2.87Å; E320-E324 PolarHBondContact O-N 3.1Å; E321-E324 PolarHBondContact O-N 3.25Å; E324-L327 PolarHBondContact O-N 2.98Å; E324-Q328 PolarHBondContact O-N 2.96Å; E324-T329 WeakPolarHBondContact CA-OG1 3.38Å; E324-T329 PolarHBondContact O-N 3.15Å; E324-T329 VanDerWaalsContact O-N 3.16Å; E324-T329 PolarHBondContact O-OG1 3.41Å; E324-T331 WeakPolarHBondContact OE2-CB 3.28Å; E324-T331 WeakPolarHBondContact OE2-CG2 3.48Å; E324-T331 PolarHBondContact OE2-OG1 3.32Å
325	R	67.2	Low	79.5	Confident	77 Å²	77	72.9 Å²	72.9	29%	0.291	37%	0.372	S	S	.	.	H	α-helix	trans	-57.3	-48.3	171.8	-75	-173.8	-167.4	-137.7	-11.2	112.2	Y177 E321 T323 L327 Q328	Y177-R325 HydrophobicContact CD1-CG 3.83Å; Y177-R325 HydrophobicContact CE1-CG 4.36Å; E321-R325 WeakPolarHBondContact O-CG 3.26Å; E321-R325 PolarHBondContact O-N 3.04Å; E321-R325 IonicContact OE1-CZ 3.12Å; E321-R325 IonicContact OE1-NE 2.69Å; E321-R325 PolarHBondContact OE1-NE 3.45Å; E321-R325 IonicContact OE1-NH2 2.7Å; E321-R325 PolarHBondContact OE1-NH2 2.85Å; E321-R325 IonicContact OE2-CZ 3.3Å; E321-R325 IonicContact OE2-NE 2.88Å; E321-R325 PolarHBondContact OE2-NE 3.43Å; E321-R325 IonicContact OE2-NH2 2.67Å; E321-R325 PolarHBondContact OE2-NH2 3.08Å; T323-R325 PolarHBondContact O-N 3.31Å; R325-L327 PolarHBondContact O-N 3.31Å; R325-Q328 PolarHBondContact O-N 2.83Å
326	T	62.3	Low	79.6	Confident	107 Å²	107	73.7 Å²	73.7	66%	0.656	38%	0.38	S	S	*	.	H	α-helix	trans	-62.6	-33.1	-178	-57.3	0	0	0	0	112	M322 T323	M322-T326 WeakPolarHBondContact O-CB 3.47Å; M322-T326 PolarHBondContact O-N 3.33Å; M322-T326 VanDerWaalsContact O-N 3.12Å; M322-T326 PolarHBondContact O-OG1 3.47Å; T323-T326 PolarHBondContact O-N 2.99Å
327	L	62.6	Low	79.8	Confident	122 Å²	122	71.7 Å²	71.7	64%	0.639	37%	0.369	S	S	*	.	H	α-helix	trans	-91.7	-5	179.6	-64	173.3	0	0	0	113.9	T323 E324 R325 T329	T323-L327 WeakPolarHBondContact O-CB 3.37Å; T323-L327 WeakPolarHBondContact O-CG 3.21Å; T323-L327 PolarHBondContact O-N 3.46Å; E324-L327 PolarHBondContact O-N 2.98Å; R325-L327 PolarHBondContact O-N 3.31Å; L327-T329 HydrophobicContact CB-CG2 3.91Å; L327-T329 PolarHBondContact O-N 2.85Å
328	Q	71.7	Confident	79.8	Confident	154 Å²	154	67.9 Å²	67.9	72%	0.72	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	28	-173.4	-55.3	-175.8	2.2	0	0	113.6	E324 R325	E324-Q328 PolarHBondContact O-N 2.96Å; R325-Q328 PolarHBondContact O-N 2.83Å
329	T	81	Confident	80	Confident	66 Å²	66	67.5 Å²	67.5	41%	0.405	36%	0.363	S	S	.	.			trans	-90.7	135.2	-178.8	48.9	0	0	0	0	111.1	E324 L327	E324-T329 WeakPolarHBondContact CA-OG1 3.38Å; E324-T329 PolarHBondContact O-N 3.15Å; E324-T329 VanDerWaalsContact O-N 3.16Å; E324-T329 PolarHBondContact O-OG1 3.41Å; L327-T329 HydrophobicContact CB-CG2 3.91Å; L327-T329 PolarHBondContact O-N 2.85Å
330	P	86.9	Confident	80.7	Confident	44 Å²	44	66.2 Å²	66.2	29%	0.286	35%	0.348	S	S	.	.			trans	-65.3	141.6	173.5	29	-34.8	0	0	0	110.8	Y250 D251 L253 R332	Y250-P330 HydrophobicContact CE2-CB 4.31Å; Y250-P330 HydrophobicContact CE2-CG 4.26Å; D251-P330 CarbonylContact O-C 3.54Å; D251-P330 WeakPolarHBondContact O-CA 3.41Å; L253-P330 HydrophobicContact CD1-CB 4.49Å; L253-P330 HydrophobicContact CD1-CG 3.8Å; L253-P330 HydrophobicContact CG-CB 4.21Å; L253-P330 HydrophobicContact CG-CG 4.04Å; P330-R332 PolarHBondContact O-N 3.26Å; P330-R332 VanDerWaalsContact O-N 3.11Å
331	T	89.8	Confident	81.3	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.006	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	105.7	-177.4	-64.2	0	0	0	0	110.1	D251 A252 L253 K298 L312 E324 I333	D251-T331 PolarHBondContact O-N 3.04Å; A252-T331 WeakPolarHBondContact CA-O 3.37Å; L253-T331 PolarHBondContact N-O 3.21Å; K298-T331 WeakPolarHBondContact CE-OG1 3.21Å; K298-T331 PolarHBondContact NZ-OG1 3.08Å; L312-T331 HydrophobicContact CD2-CG2 4.06Å; E324-T331 WeakPolarHBondContact OE2-CB 3.28Å; E324-T331 WeakPolarHBondContact OE2-CG2 3.48Å; E324-T331 PolarHBondContact OE2-OG1 3.32Å; T331-I333 HydrophobicContact CG2-CG1 4.43Å; T331-I333 PolarHBondContact O-N 2.98Å
332	R	91.1	Very high	82	Confident	110 Å²	110	64.7 Å²	64.7	42%	0.415	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	125.6	175.6	-158.2	-179.4	-162.8	-128.7	4.8	110.1	L253 S255 D293 R315 P330	L253-R332 HydrophobicContact CB-CG 4.41Å; S255-R332 PolarHBondContact OG-NE 2.69Å; D293-R332 IonicContact OD1-CZ 3.92Å; D293-R332 IonicContact OD1-NE 2.62Å; D293-R332 IonicContact OD1-NH2 2.73Å; D293-R332 PolarHBondContact OD1-NH2 3.3Å; D293-R332 IonicContact OD2-CZ 3.25Å; D293-R332 IonicContact OD2-NE 3.81Å; D293-R332 PolarHBondContact OD2-NE 2.76Å; D293-R332 IonicContact OD2-NH2 2.8Å; D293-R332 PolarHBondContact OD2-NH2 3.46Å; R315-R332 PolarHBondContact NH1-O 3.18Å; R315-R332 PolarHBondContact NH2-O 2.85Å; P330-R332 PolarHBondContact O-N 3.26Å; P330-R332 VanDerWaalsContact O-N 3.11Å
333	I	92.6	Very high	83	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.021	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.3	174	-60.2	174.6	0	0	0	106.2	L253 L254 S255 L301 F308 L311 L312 T331 L335	L253-I333 PolarHBondContact O-N 3.24Å; L254-I333 HydrophobicContact CD2-CB 3.87Å; L254-I333 HydrophobicContact CD2-CD1 3.96Å; L254-I333 HydrophobicContact CD2-CG1 4.42Å; L254-I333 HydrophobicContact CD2-CG2 4.11Å; S255-I333 PolarHBondContact N-O 3.26Å; S255-I333 PolarHBondContact OG-O 3.12Å; L301-I333 HydrophobicContact CD1-CD1 4.08Å; F308-I333 HydrophobicContact CD1-CD1 4.47Å; F308-I333 HydrophobicContact CE1-CG2 4.25Å; L311-I333 HydrophobicContact CD2-CG2 4.03Å; L312-I333 HydrophobicContact CD2-CD1 4.44Å; T331-I333 HydrophobicContact CG2-CG1 4.43Å; T331-I333 PolarHBondContact O-N 2.98Å; I333-L335 HydrophobicContact CG2-CD2 3.92Å
334	V	91.7	Very high	84.3	Confident	81 Å²	81	56.8 Å²	56.8	49%	0.491	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.5	174.5	-171.4	0	0	0	0	108.2	S255 S257	S255-V334 WeakPolarHBondContact OG-CA 3.37Å; S257-V334 WeakPolarHBondContact OG-CG1 3.07Å
335	L	92	Very high	85.5	Confident	10 Å²	10	55.6 Å²	55.6	5%	0.052	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.4	175	-56.8	-177.1	0	0	0	109.2	L254 S255 F256 S257 F308 I333 E337 I340	L254-L335 HydrophobicContact CB-CD1 4.27Å; L254-L335 HydrophobicContact CD1-CD1 4.29Å; S255-L335 PolarHBondContact O-N 3.48Å; F256-L335 WeakPolarHBondContact CA-O 3.36Å; F256-L335 HydrophobicContact CD1-CB 4.07Å; F256-L335 HydrophobicContact CE1-CB 3.99Å; F256-L335 HydrophobicContact CE1-CD1 4.02Å; F256-L335 HydrophobicContact CZ-CD1 3.97Å; S257-L335 PolarHBondContact N-O 3.45Å; F308-L335 HydrophobicContact CE1-CD2 4.09Å; F308-L335 HydrophobicContact CZ-CD2 4.19Å; I333-L335 HydrophobicContact CG2-CD2 3.92Å; L335-E337 PolarHBondContact O-N 2.81Å; L335-I340 HydrophobicContact CD2-CD1 4.44Å
336	D	90.3	Very high	86.8	Confident	69 Å²	69	55.2 Å²	55.2	37%	0.369	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	117	170.9	-177.2	-25.6	0	0	0	109.1	S338 I339 I340	D336-S338 VanDerWaalsContact CG-OG 3.29Å; D336-S338 PolarHBondContact O-N 3.37Å; D336-S338 WeakPolarHBondContact OD1-CA 3.41Å; D336-S338 VanDerWaalsContact OD1-CB 3.25Å; D336-S338 WeakPolarHBondContact OD1-CB 3.49Å; D336-S338 PolarHBondContact OD1-N 2.76Å; D336-S338 PolarHBondContact OD1-OG 2.71Å; D336-S338 PolarHBondContact OD2-OG 2.79Å; D336-I339 HydrophobicContact CB-CB 4.36Å; D336-I339 HydrophobicContact CB-CD1 4.06Å; D336-I339 HydrophobicContact CB-CG1 4.11Å; D336-I339 PolarHBondContact O-N 3.18Å; D336-I339 VanDerWaalsContact O-N 3.13Å; D336-I340 PolarHBondContact O-N 2.92Å
337	E	89.4	Confident	88.4	Confident	31 Å²	31	50.1 Å²	50.1	15%	0.145	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-18.9	-177	-168.8	166.1	-149.7	0	0	113	F256 S257 L335 I339 P341 R342 S368	F256-E337 HydrophobicContact CD1-CB 4.4Å; S257-E337 PolarHBondContact O-N 2.85Å; L335-E337 PolarHBondContact O-N 2.81Å; E337-I339 VanDerWaalsContact C-N 3.32Å; E337-P341 WeakPolarHBondContact O-CA 3.28Å; E337-R342 WeakPolarHBondContact OE1-CB 3.15Å; E337-R342 PolarHBondContact OE1-N 3.47Å; E337-S368 WeakPolarHBondContact OE1-CB 3.46Å; E337-S368 PolarHBondContact OE1-OG 3.43Å
338	S	87.2	Confident	90.1	Very high	92 Å²	92	44.6 Å²	44.6	64%	0.643	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-25.9	172.9	78.4	0	0	0	0	112.9	D336	D336-S338 VanDerWaalsContact CG-OG 3.29Å; D336-S338 PolarHBondContact O-N 3.37Å; D336-S338 WeakPolarHBondContact OD1-CA 3.41Å; D336-S338 VanDerWaalsContact OD1-CB 3.25Å; D336-S338 WeakPolarHBondContact OD1-CB 3.49Å; D336-S338 PolarHBondContact OD1-N 2.76Å; D336-S338 PolarHBondContact OD1-OG 2.71Å; D336-S338 PolarHBondContact OD2-OG 2.79Å
339	I	89.6	Confident	91.2	Very high	75 Å²	75	37.7 Å²	37.7	39%	0.385	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-42.1	179.6	-54.4	178.5	0	0	0	110.9	D336 E337 F401	D336-I339 HydrophobicContact CB-CB 4.36Å; D336-I339 HydrophobicContact CB-CD1 4.06Å; D336-I339 HydrophobicContact CB-CG1 4.11Å; D336-I339 PolarHBondContact O-N 3.18Å; D336-I339 VanDerWaalsContact O-N 3.13Å; E337-I339 VanDerWaalsContact C-N 3.32Å; I339-F401 HydrophobicContact CG2-CD1 4.11Å; I339-F401 HydrophobicContact CG2-CD2 4.3Å; I339-F401 HydrophobicContact CG2-CE1 3.92Å; I339-F401 HydrophobicContact CG2-CE2 4.1Å; I339-F401 HydrophobicContact CG2-CG 4.31Å; I339-F401 HydrophobicContact CG2-CZ 3.91Å
340	I	92.4	Very high	92	Very high	6 Å²	6	35.8 Å²	35.8	3%	0.031	19%	0.186	C	C	.	.	S	Bend	trans	-126.5	86.2	178.4	-52.3	-174.8	0	0	0	108.8	F256 L335 D336 R342 I348 I398 F401 L402	F256-I340 WeakPolarHBondContact CE1-O 3.5Å; L335-I340 HydrophobicContact CD2-CD1 4.44Å; D336-I340 PolarHBondContact O-N 2.92Å; I340-R342 PolarHBondContact O-N 3.25Å; I340-I348 HydrophobicContact CG2-CD1 4Å; I340-I398 HydrophobicContact CG1-CG2 4.19Å; I340-I398 HydrophobicContact CG2-CG2 4.19Å; I340-F401 HydrophobicContact CD1-CD1 4.29Å; I340-F401 HydrophobicContact CD1-CE1 4.17Å; I340-L402 HydrophobicContact CD1-CD1 4.46Å; I340-L402 HydrophobicContact CD1-CD2 3.87Å; I340-L402 HydrophobicContact CD1-CG 4.34Å
341	P	91	Very high	92.6	Very high	24 Å²	24	33.7 Å²	33.7	16%	0.156	17%	0.172	C	C	.	.			trans	-55.6	132	178.6	-28.8	36.4	0	0	0	112.6	E337 K343 Y344	E337-P341 WeakPolarHBondContact O-CA 3.28Å; P341-K343 HydrophobicContact CB-CD 4.47Å; P341-K343 HydrophobicContact CB-CG 3.73Å; P341-K343 PolarHBondContact O-N 2.8Å; P341-Y344 HydrophobicContact CB-CD2 4.22Å; P341-Y344 HydrophobicContact CG-CD2 4.49Å; P341-Y344 PolarHBondContact O-N 2.97Å
342	R	88.5	Confident	93	Very high	52 Å²	52	33.7 Å²	33.7	20%	0.196	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-21.4	-177.2	-170	173.2	-172.4	165.4	6.7	113.3	F256 E292 E337 I340 Y344 V345	F256-R342 HydrophobicContact CD1-CB 4.04Å; F256-R342 HydrophobicContact CD1-CG 4.41Å; F256-R342 HydrophobicContact CD2-CB 4.41Å; F256-R342 HydrophobicContact CD2-CG 3.89Å; F256-R342 HydrophobicContact CE1-CB 4.01Å; F256-R342 HydrophobicContact CE1-CG 4.32Å; F256-R342 HydrophobicContact CE2-CB 4.39Å; F256-R342 HydrophobicContact CE2-CG 3.8Å; F256-R342 HydrophobicContact CG-CB 4.26Å; F256-R342 HydrophobicContact CG-CG 4.21Å; F256-R342 HydrophobicContact CZ-CB 4.2Å; F256-R342 HydrophobicContact CZ-CG 4.03Å; E292-R342 PolarHBondContact O-NH2 2.84Å; E337-R342 WeakPolarHBondContact OE1-CB 3.15Å; E337-R342 PolarHBondContact OE1-N 3.47Å; I340-R342 PolarHBondContact O-N 3.25Å; R342-Y344 PolarHBondContact O-N 2.78Å; R342-V345 WeakPolarHBondContact O-CG1 3.46Å
343	K	90.1	Very high	93.3	Very high	40 Å²	40	28.4 Å²	28.4	17%	0.174	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-26.8	170.7	55.6	164.5	170.8	158.1	0	114.7	P341 V362 L363 E394	P341-K343 HydrophobicContact CB-CD 4.47Å; P341-K343 HydrophobicContact CB-CG 3.73Å; P341-K343 PolarHBondContact O-N 2.8Å; K343-V362 HydrophobicContact CB-CG1 4.23Å; K343-V362 WeakPolarHBondContact O-CA 3.04Å; K343-L363 PolarHBondContact O-N 2.89Å; K343-E394 WeakPolarHBondContact CE-OE2 3.24Å; K343-E394 IonicContact NZ-OE1 2.66Å; K343-E394 PolarHBondContact NZ-OE1 3.07Å; K343-E394 IonicContact NZ-OE2 2.96Å; K343-E394 PolarHBondContact NZ-OE2 3.13Å
344	Y	94.4	Very high	93.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-18.8	-172.8	-69.8	-54.8	0	0	0	116.3	P341 R342 Q346 V347 I348 V362 E391 E394 L395 I398	P341-Y344 HydrophobicContact CB-CD2 4.22Å; P341-Y344 HydrophobicContact CG-CD2 4.49Å; P341-Y344 PolarHBondContact O-N 2.97Å; R342-Y344 PolarHBondContact O-N 2.78Å; Y344-Q346 VanDerWaalsContact C-N 3.27Å; Y344-Q346 PolarHBondContact O-N 3.49Å; Y344-Q346 VanDerWaalsContact O-N 3.14Å; Y344-V347 WeakPolarHBondContact O-CB 3.48Å; Y344-V347 PolarHBondContact O-N 2.76Å; Y344-I348 WeakPolarHBondContact O-CG1 3.4Å; Y344-I348 PolarHBondContact O-N 2.76Å; Y344-I348 VanDerWaalsContact O-N 3.13Å; Y344-V362 HydrophobicContact CD1-CG2 4.05Å; Y344-V362 HydrophobicContact CE1-CG1 4.22Å; Y344-V362 HydrophobicContact CE1-CG2 3.98Å; Y344-E391 HydrophobicContact CE1-CB 4.17Å; Y344-E391 HydrophobicContact CE1-CG 4.48Å; Y344-E391 WeakPolarHBondContact OH-CA 3.45Å; Y344-E394 HydrophobicContact CE2-CB 3.86Å; Y344-E394 WeakPolarHBondContact CE2-OE2 3.32Å; Y344-E394 PolarHBondContact OH-OE1 2.85Å; Y344-E394 PolarHBondContact OH-OE2 2.71Å; Y344-L395 HydrophobicContact CD1-CB 4.44Å; Y344-L395 HydrophobicContact CD1-CD1 4.16Å; Y344-L395 HydrophobicContact CD1-CD2 4.48Å; Y344-L395 HydrophobicContact CG-CD1 4.07Å; Y344-I398 HydrophobicContact CD2-CD1 3.57Å; Y344-I398 HydrophobicContact CE2-CD1 4.32Å; Y344-I398 HydrophobicContact CG-CD1 4.19Å
345	V	93.4	Very high	93.7	Very high	3 Å²	3	27.1 Å²	27.1	2%	0.018	14%	0.143	C	C	.	.	H	α-helix	trans	-59.8	-31.6	-168.4	66.3	0	0	0	0	114.3	L254 F256 L294 R342 I348 L349	L254-V345 HydrophobicContact CD1-CG2 4.11Å; F256-V345 HydrophobicContact CE2-CG1 4.14Å; F256-V345 HydrophobicContact CZ-CB 3.78Å; F256-V345 HydrophobicContact CZ-CG1 3.74Å; F256-V345 HydrophobicContact CZ-CG2 3.95Å; L294-V345 HydrophobicContact CD1-CB 4.22Å; L294-V345 HydrophobicContact CD1-CG1 3.22Å; L294-V345 HydrophobicContact CD1-CG2 3.95Å; R342-V345 WeakPolarHBondContact O-CG1 3.46Å; V345-I348 PolarHBondContact O-N 2.79Å; V345-L349 HydrophobicContact CG2-CD1 4.12Å; V345-L349 HydrophobicContact CG2-CG 4.28Å; V345-L349 WeakPolarHBondContact O-CB 3.45Å; V345-L349 WeakPolarHBondContact O-CG 3.23Å; V345-L349 PolarHBondContact O-N 3.49Å
346	Q	93.9	Very high	93.9	Very high	69 Å²	69	30.2 Å²	30.2	32%	0.322	16%	0.162	S	C	.	.	H	α-helix	trans	-68.5	-35.3	175.4	-69.9	-167.5	-4.7	0	0	112.4	Y344 H350 L361 L363	Y344-Q346 VanDerWaalsContact C-N 3.27Å; Y344-Q346 PolarHBondContact O-N 3.49Å; Y344-Q346 VanDerWaalsContact O-N 3.14Å; Q346-H350 WeakPolarHBondContact O-CB 3.22Å; Q346-H350 PolarHBondContact O-N 3.38Å; Q346-L361 HydrophobicContact CB-CB 4.21Å; Q346-L363 HydrophobicContact CG-CD1 4.23Å; Q346-L363 HydrophobicContact CG-CG 4.47Å
347	V	96.8	Very high	94.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.7	-44.7	173.3	-167.1	0	0	0	0	110.6	Y344 H350 C351 V357 D358 L359 L361 V362 L395	Y344-V347 WeakPolarHBondContact O-CB 3.48Å; Y344-V347 PolarHBondContact O-N 2.76Å; V347-H350 PolarHBondContact O-N 2.96Å; V347-C351 WeakPolarHBondContact O-CB 3.32Å; V347-C351 PolarHBondContact O-N 3.27Å; V347-V357 HydrophobicContact CG1-CG1 3.9Å; V347-D358 WeakPolarHBondContact CG1-O 3.46Å; V347-L359 HydrophobicContact CG1-CD2 4.43Å; V347-L361 HydrophobicContact CG2-CB 4.1Å; V347-V362 HydrophobicContact CG2-CG2 3.76Å; V347-L395 HydrophobicContact CB-CD2 4.17Å; V347-L395 HydrophobicContact CG1-CD2 3.69Å
348	I	97.5	Very high	94.4	Very high	6 Å²	6	29.4 Å²	29.4	3%	0.031	16%	0.16	C	C	.	.	H	α-helix	trans	-60.9	-52.5	178.9	-60	170.5	0	0	0	110	I340 Y344 V345 C351 M352 L395 I398 L402 L407	I340-I348 HydrophobicContact CG2-CD1 4Å; Y344-I348 WeakPolarHBondContact O-CG1 3.4Å; Y344-I348 PolarHBondContact O-N 2.76Å; Y344-I348 VanDerWaalsContact O-N 3.13Å; V345-I348 PolarHBondContact O-N 2.79Å; I348-C351 PolarHBondContact O-N 2.97Å; I348-M352 HydrophobicContact CG2-CE 3.91Å; I348-M352 HydrophobicContact CG2-SD 4.46Å; I348-M352 WeakPolarHBondContact O-CG 3.27Å; I348-M352 PolarHBondContact O-N 3.43Å; I348-M352 VanDerWaalsContact O-N 3.08Å; I348-L395 HydrophobicContact CD1-CD1 4.17Å; I348-L395 HydrophobicContact CG1-CD1 3.75Å; I348-I398 HydrophobicContact CD1-CG2 3.66Å; I348-L402 HydrophobicContact CD1-CD1 4.26Å; I348-L402 HydrophobicContact CG2-CD1 3.77Å; I348-L407 HydrophobicContact CB-CD2 4.38Å; I348-L407 HydrophobicContact CG1-CD2 3.88Å; I348-L407 HydrophobicContact CG2-CD2 4.27Å
349	L	96.7	Very high	94.8	Very high	9 Å²	9	25.2 Å²	25.2	5%	0.047	13%	0.13	C	C	.	.	H	α-helix	trans	-61.9	-46.6	178.3	-73.8	173.7	0	0	0	111.3	F244 L254 L294 A296 L301 V345 C351 M352 Y353	F244-L349 HydrophobicContact CE2-CB 3.92Å; L254-L349 HydrophobicContact CD1-CD1 4.21Å; L254-L349 HydrophobicContact CD1-CD2 3.92Å; L254-L349 HydrophobicContact CD1-CG 4.29Å; L294-L349 HydrophobicContact CB-CD1 4.39Å; A296-L349 HydrophobicContact CB-CD2 4.21Å; L301-L349 HydrophobicContact CD2-CD2 4.18Å; V345-L349 HydrophobicContact CG2-CD1 4.12Å; V345-L349 HydrophobicContact CG2-CG 4.28Å; V345-L349 WeakPolarHBondContact O-CB 3.45Å; V345-L349 WeakPolarHBondContact O-CG 3.23Å; V345-L349 PolarHBondContact O-N 3.49Å; L349-C351 VanDerWaalsContact C-N 3.34Å; L349-C351 PolarHBondContact O-N 2.94Å; L349-M352 WeakPolarHBondContact O-CB 3.18Å; L349-M352 PolarHBondContact O-N 3.08Å; L349-M352 VanDerWaalsContact O-N 3.08Å; L349-Y353 VanDerWaalsContact O-CD2 3.24Å; L349-Y353 WeakPolarHBondContact O-CD2 3.41Å; L349-Y353 PolarHBondContact O-N 2.73Å
350	H	97.4	Very high	94.9	Very high	25 Å²	25	24.4 Å²	24.4	12%	0.116	14%	0.14	C	C	.	.	H	α-helix	trans	-55.2	-48.6	178.2	-177.2	-90.7	0	0	0	111.9	F244 Q346 V347 M352 Y353 T354 V356 L361	F244-H350 HydrophobicContact CE1-CB 4.43Å; F244-H350 AromaticContact CE1-CD2 3.84Å; F244-H350 HydrophobicContact CZ-CB 4.13Å; Q346-H350 WeakPolarHBondContact O-CB 3.22Å; Q346-H350 PolarHBondContact O-N 3.38Å; V347-H350 PolarHBondContact O-N 2.96Å; H350-M352 VanDerWaalsContact C-N 3.29Å; H350-M352 PolarHBondContact O-N 3.42Å; H350-Y353 PolarHBondContact O-N 3.2Å; H350-Y353 VanDerWaalsContact O-N 3.12Å; H350-T354 PolarHBondContact CE1-OG1 3.47Å; H350-T354 VanDerWaalsContact CE1-OG1 3.23Å; H350-T354 PolarHBondContact ND1-OG1 3.4Å; H350-T354 WeakPolarHBondContact O-CB 3.44Å; H350-T354 PolarHBondContact O-N 3.41Å; H350-T354 VanDerWaalsContact O-N 3.07Å; H350-T354 PolarHBondContact O-OG1 3.2Å; H350-V356 PolarHBondContact ND1-O 3.15Å; H350-L361 HydrophobicContact CB-CD1 3.5Å; H350-L361 VanDerWaalsContact CB-CD1 3.5Å
351	C	98.2	Very high	94.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.7	-34.5	177.9	-177.5	0	0	0	0	112.7	R304 V347 I348 L349 Y353 T354 D355 V356 V357 F404 L407	R304-C351 PolarHBondContact NH2-O 3.45Å; R304-C351 VanDerWaalsContact NH2-O 3.08Å; V347-C351 WeakPolarHBondContact O-CB 3.32Å; V347-C351 PolarHBondContact O-N 3.27Å; I348-C351 PolarHBondContact O-N 2.97Å; L349-C351 VanDerWaalsContact C-N 3.34Å; L349-C351 PolarHBondContact O-N 2.94Å; C351-Y353 VanDerWaalsContact C-N 3.27Å; C351-Y353 PolarHBondContact O-N 3.44Å; C351-T354 PolarHBondContact O-N 2.94Å; C351-D355 WeakPolarHBondContact O-CA 3.42Å; C351-D355 PolarHBondContact O-N 2.89Å; C351-V356 VanDerWaalsContact CA-O 3.32Å; C351-V356 WeakPolarHBondContact CA-O 3.39Å; C351-V356 WeakPolarHBondContact CB-O 3.2Å; C351-V356 PolarHBondContact N-O 3.36Å; C351-V357 HydrophobicContact CB-CG2 4.23Å; C351-F404 HydrophobicContact CB-CE1 4.07Å; C351-F404 HydrophobicContact CB-CZ 4.29Å; C351-L407 HydrophobicContact CB-CD1 4.24Å
352	M	97.9	Very high	94.9	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-61.4	-31.3	175.2	-74	-179.1	174	0	0	113.3	I300 L301 R304 F308 I348 L349 H350 F404	I300-M352 HydrophobicContact CG2-CB 4.17Å; L301-M352 HydrophobicContact CD2-SD 3.74Å; R304-M352 HydrophobicContact CB-CB 4.29Å; R304-M352 HydrophobicContact CB-CG 3.97Å; R304-M352 HydrophobicContact CG-CB 4.26Å; R304-M352 HydrophobicContact CG-CG 4.49Å; R304-M352 WeakPolarHBondContact CG-O 3.31Å; R304-M352 PolarHBondContact NE-O 2.91Å; F308-M352 HydrophobicContact CD2-CE 4.13Å; F308-M352 HydrophobicContact CE2-CE 4.11Å; I348-M352 HydrophobicContact CG2-CE 3.91Å; I348-M352 HydrophobicContact CG2-SD 4.46Å; I348-M352 WeakPolarHBondContact O-CG 3.27Å; I348-M352 PolarHBondContact O-N 3.43Å; I348-M352 VanDerWaalsContact O-N 3.08Å; L349-M352 WeakPolarHBondContact O-CB 3.18Å; L349-M352 PolarHBondContact O-N 3.08Å; L349-M352 VanDerWaalsContact O-N 3.08Å; H350-M352 VanDerWaalsContact C-N 3.29Å; H350-M352 PolarHBondContact O-N 3.42Å; M352-F404 HydrophobicContact CB-CE1 4.46Å; M352-F404 HydrophobicContact CB-CZ 4.42Å; M352-F404 HydrophobicContact CE-CD1 3.93Å; M352-F404 HydrophobicContact CE-CE1 4.25Å; M352-F404 HydrophobicContact CE-CG 4.45Å; M352-F404 HydrophobicContact CG-CD1 4.12Å; M352-F404 HydrophobicContact CG-CE1 3.49Å; M352-F404 VanDerWaalsContact CG-CE1 3.49Å; M352-F404 HydrophobicContact CG-CZ 3.76Å
353	Y	97.9	Very high	94.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-101.6	-8.6	-178.6	-67.4	-114.1	0	0	0	114	L128 M240 L243 F244 H297 I300 L349 H350 C351	L128-Y353 WeakPolarHBondContact CD2-O 3.27Å; M240-Y353 WeakPolarHBondContact CB-O 3.29Å; L243-Y353 HydrophobicContact CD2-CE1 4.34Å; L243-Y353 HydrophobicContact CG-CD1 4.48Å; L243-Y353 HydrophobicContact CG-CE1 4.21Å; F244-Y353 HydrophobicContact CB-CD1 3.92Å; F244-Y353 HydrophobicContact CB-CG 3.88Å; F244-Y353 AromaticContact CD2-CD2 3.86Å; F244-Y353 HydrophobicContact CD2-CD2 3.86Å; F244-Y353 HydrophobicContact CD2-CE2 4.22Å; F244-Y353 HydrophobicContact CD2-CG 4.03Å; F244-Y353 HydrophobicContact CG-CG 4.36Å; H297-Y353 PolarHBondContact N-OH 3.07Å; H297-Y353 VanDerWaalsContact N-OH 3.11Å; H297-Y353 AromaticContact ND1-CE1 3.46Å; H297-Y353 WeakPolarHBondContact ND1-CE1 3.45Å; H297-Y353 AromaticContact ND1-CZ 3.57Å; H297-Y353 PolarHBondContact ND1-OH 3.28Å; I300-Y353 HydrophobicContact CB-CE1 4.21Å; I300-Y353 HydrophobicContact CB-CE2 4.29Å; I300-Y353 HydrophobicContact CG1-CD1 4.25Å; I300-Y353 HydrophobicContact CG1-CE1 3.77Å; I300-Y353 HydrophobicContact CG2-CD1 4.28Å; I300-Y353 HydrophobicContact CG2-CD2 3.85Å; I300-Y353 HydrophobicContact CG2-CE1 4.16Å; I300-Y353 HydrophobicContact CG2-CE2 3.73Å; I300-Y353 HydrophobicContact CG2-CG 4.13Å; L349-Y353 VanDerWaalsContact O-CD2 3.24Å; L349-Y353 WeakPolarHBondContact O-CD2 3.41Å; L349-Y353 PolarHBondContact O-N 2.73Å; H350-Y353 PolarHBondContact O-N 3.2Å; H350-Y353 VanDerWaalsContact O-N 3.12Å; C351-Y353 VanDerWaalsContact C-N 3.27Å; C351-Y353 PolarHBondContact O-N 3.44Å
354	T	96.6	Very high	93.8	Very high	13 Å²	13	32.7 Å²	32.7	8%	0.08	18%	0.176	C	C	.	.	H	α-helix	trans	-135.3	-5.9	-170.2	64.5	0	0	0	0	115.5	K241 H350 C351 V356	K241-T354 HydrophobicContact CB-CG2 4.31Å; K241-T354 HydrophobicContact CG-CG2 4.16Å; H350-T354 PolarHBondContact CE1-OG1 3.47Å; H350-T354 VanDerWaalsContact CE1-OG1 3.23Å; H350-T354 PolarHBondContact ND1-OG1 3.4Å; H350-T354 WeakPolarHBondContact O-CB 3.44Å; H350-T354 PolarHBondContact O-N 3.41Å; H350-T354 VanDerWaalsContact O-N 3.07Å; H350-T354 PolarHBondContact O-OG1 3.2Å; C351-T354 PolarHBondContact O-N 2.94Å; T354-V356 PolarHBondContact O-N 2.93Å; T354-V356 PolarHBondContact OG1-N 3.04Å; T354-V356 VanDerWaalsContact OG1-N 3.15Å
355	D	96.6	Very high	92	Very high	45 Å²	45	36.4 Å²	36.4	24%	0.241	21%	0.214	C	C	.	.	S	Bend	trans	61.4	-5.9	-164.4	-76.9	-43.6	0	0	0	115	S127 L128 R304 C351 M406	S127-D355 WeakPolarHBondContact CA-OD2 3.34Å; L128-D355 VanDerWaalsContact CB-OD2 3.32Å; L128-D355 WeakPolarHBondContact CB-OD2 3.42Å; L128-D355 PolarHBondContact N-OD1 3.37Å; L128-D355 PolarHBondContact N-OD2 2.88Å; R304-D355 IonicContact CZ-OD1 2.66Å; R304-D355 IonicContact NH1-OD1 2.94Å; R304-D355 PolarHBondContact NH1-OD1 3.34Å; R304-D355 IonicContact NH2-OD1 3.2Å; R304-D355 PolarHBondContact NH2-OD1 2.8Å; C351-D355 WeakPolarHBondContact O-CA 3.42Å; C351-D355 PolarHBondContact O-N 2.89Å; D355-M406 HydrophobicContact CB-CE 3.88Å; D355-M406 WeakPolarHBondContact OD1-CE 3.4Å; D355-M406 WeakPolarHBondContact OD1-CG 3.28Å
356	V	95.8	Very high	90.1	Very high	74 Å²	74	37.2 Å²	37.2	45%	0.448	22%	0.22	S	C	.	.			trans	-97.9	126.1	-172.8	175.1	0	0	0	0	113.3	H350 C351 T354	H350-V356 PolarHBondContact ND1-O 3.15Å; C351-V356 VanDerWaalsContact CA-O 3.32Å; C351-V356 WeakPolarHBondContact CA-O 3.39Å; C351-V356 WeakPolarHBondContact CB-O 3.2Å; C351-V356 PolarHBondContact N-O 3.36Å; T354-V356 PolarHBondContact O-N 2.93Å; T354-V356 PolarHBondContact OG1-N 3.04Å; T354-V356 VanDerWaalsContact OG1-N 3.15Å
357	V	96.7	Very high	87.9	Confident	19 Å²	19	38.9 Å²	38.9	12%	0.115	24%	0.237	C	C	.	.			trans	-92.3	95.8	173.7	-175.4	0	0	0	0	110.3	V347 C351 L395 L407 I414	V347-V357 HydrophobicContact CG1-CG1 3.9Å; C351-V357 HydrophobicContact CB-CG2 4.23Å; V357-L395 HydrophobicContact CG1-CD2 4.17Å; V357-L407 HydrophobicContact CB-CD1 4.42Å; V357-L407 HydrophobicContact CG1-CD1 3.91Å; V357-L407 HydrophobicContact CG2-CD1 3.68Å; V357-I414 HydrophobicContact CB-CD1 4.41Å; V357-I414 HydrophobicContact CG1-CD1 4Å
358	D	94.6	Very high	85.6	Confident	65 Å²	65	40.8 Å²	40.8	35%	0.348	25%	0.25	S	S	.	.			trans	-102.7	105.5	174.6	-175.8	22	0	0	0	112.9	V347 G360 L361	V347-D358 WeakPolarHBondContact CG1-O 3.46Å; D358-G360 PolarHBondContact O-N 2.99Å; D358-G360 WeakPolarHBondContact OD1-CA 3.44Å; D358-G360 PolarHBondContact OD1-N 3.45Å; D358-L361 HydrophobicContact CB-CD1 4.35Å; D358-L361 HydrophobicContact CB-CG 4.27Å; D358-L361 WeakPolarHBondContact O-CB 3.39Å; D358-L361 PolarHBondContact O-N 3.31Å; D358-L361 VanDerWaalsContact O-N 3.09Å
359	L	93.9	Very high	83.2	Confident	4 Å²	4	43.6 Å²	43.6	2%	0.021	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-69.3	-5.8	172.4	-63.9	175.1	0	0	0	113.8	V347 L361 V362 R388 E391 A392 L395 I414	V347-L359 HydrophobicContact CG1-CD2 4.43Å; L359-L361 PolarHBondContact O-N 3.07Å; L359-V362 HydrophobicContact CB-CG2 4.28Å; L359-V362 HydrophobicContact CD2-CG2 3.92Å; L359-V362 WeakPolarHBondContact O-CG2 3.47Å; L359-V362 PolarHBondContact O-N 3.38Å; L359-R388 HydrophobicContact CD1-CG 3.63Å; L359-R388 WeakPolarHBondContact CD1-O 3.43Å; L359-E391 HydrophobicContact CD2-CB 4.42Å; L359-A392 HydrophobicContact CD1-CB 4.22Å; L359-L395 HydrophobicContact CD2-CD2 3.73Å; L359-I414 HydrophobicContact CD1-CD1 4Å; L359-I414 HydrophobicContact CD1-CG2 3.88Å; L359-I414 HydrophobicContact CG-CD1 4.21Å
360	G	92.1	Very high	80.6	Confident	58 Å²	58	48 Å²	48	60%	0.598	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-61.9	-23.5	164.1	0	0	0	0	0	113.3	D358 V362	D358-G360 PolarHBondContact O-N 2.99Å; D358-G360 WeakPolarHBondContact OD1-CA 3.44Å; D358-G360 PolarHBondContact OD1-N 3.45Å; G360-V362 VanDerWaalsContact C-N 3.33Å
361	L	92.6	Very high	78.2	Confident	46 Å²	46	51.2 Å²	51.2	24%	0.241	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-88.3	9.2	177.6	-53.3	177.2	0	0	0	113.7	Q346 V347 H350 D358 L359 L363	Q346-L361 HydrophobicContact CB-CB 4.21Å; V347-L361 HydrophobicContact CG2-CB 4.1Å; H350-L361 HydrophobicContact CB-CD1 3.5Å; H350-L361 VanDerWaalsContact CB-CD1 3.5Å; D358-L361 HydrophobicContact CB-CD1 4.35Å; D358-L361 HydrophobicContact CB-CG 4.27Å; D358-L361 WeakPolarHBondContact O-CB 3.39Å; D358-L361 PolarHBondContact O-N 3.31Å; D358-L361 VanDerWaalsContact O-N 3.09Å; L359-L361 PolarHBondContact O-N 3.07Å; L361-L363 PolarHBondContact O-N 3.12Å
362	V	90.9	Very high	75.7	Confident	13 Å²	13	58 Å²	58	8%	0.079	36%	0.361	C	S	.	.			trans	-70.8	122.2	172.8	177.1	0	0	0	0	109.4	K343 Y344 V347 L359 G360 R364	K343-V362 HydrophobicContact CB-CG1 4.23Å; K343-V362 WeakPolarHBondContact O-CA 3.04Å; Y344-V362 HydrophobicContact CD1-CG2 4.05Å; Y344-V362 HydrophobicContact CE1-CG1 4.22Å; Y344-V362 HydrophobicContact CE1-CG2 3.98Å; V347-V362 HydrophobicContact CG2-CG2 3.76Å; L359-V362 HydrophobicContact CB-CG2 4.28Å; L359-V362 HydrophobicContact CD2-CG2 3.92Å; L359-V362 WeakPolarHBondContact O-CG2 3.47Å; L359-V362 PolarHBondContact O-N 3.38Å; G360-V362 VanDerWaalsContact C-N 3.33Å; V362-R364 HydrophobicContact CB-CG 4.45Å; V362-R364 HydrophobicContact CG1-CG 3.95Å; V362-R364 PolarHBondContact O-N 3.34Å
363	L	85.1	Confident	73.5	Confident	60 Å²	60	60.1 Å²	60.1	31%	0.314	38%	0.383	S	S	.	.			trans	-76.3	72	-178.3	-61.5	174.8	0	0	0	111.7	K343 Q346 L361 G365 S366	K343-L363 PolarHBondContact O-N 2.89Å; Q346-L363 HydrophobicContact CG-CD1 4.23Å; Q346-L363 HydrophobicContact CG-CG 4.47Å; L361-L363 PolarHBondContact O-N 3.12Å; L363-G365 VanDerWaalsContact C-N 3.33Å; L363-G365 PolarHBondContact O-N 3.08Å; L363-S366 PolarHBondContact O-N 3.34Å; L363-S366 VanDerWaalsContact O-N 3.12Å
364	R	71.7	Confident	71.3	Confident	176 Å²	176	64.2 Å²	64.2	66%	0.664	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	86.5	176.3	-63.8	-172.1	-175	138.8	-0.8	110.6	V362 E391	V362-R364 HydrophobicContact CB-CG 4.45Å; V362-R364 HydrophobicContact CG1-CG 3.95Å; V362-R364 PolarHBondContact O-N 3.34Å; R364-E391 IonicContact CZ-OE1 3.62Å; R364-E391 VanDerWaalsContact CZ-OE1 3.29Å; R364-E391 IonicContact CZ-OE2 2.91Å; R364-E391 IonicContact NE-OE1 3.89Å; R364-E391 PolarHBondContact NE-OE1 2.56Å; R364-E391 IonicContact NE-OE2 3.84Å; R364-E391 IonicContact NH2-OE1 2.78Å; R364-E391 PolarHBondContact NH2-OE1 3.15Å; R364-E391 IonicContact NH2-OE2 3.21Å; R364-E391 PolarHBondContact NH2-OE2 3.17Å
365	G	55.5	Low	68.8	Low	78 Å²	78	68 Å²	68	80%	0.804	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	151.1	-5.1	-172.3	0	0	0	0	0	114	L363	L363-G365 VanDerWaalsContact C-N 3.33Å; L363-G365 PolarHBondContact O-N 3.08Å
366	S	53.5	Low	66.5	Low	20 Å²	20	72.5 Å²	72.5	14%	0.14	45%	0.445	C	S	.	.			trans	-64.5	139.1	168.6	-138	0	0	0	0	110.8	L363 S368 S369	L363-S366 PolarHBondContact O-N 3.34Å; L363-S366 VanDerWaalsContact O-N 3.12Å; S366-S368 PolarHBondContact O-N 3.49Å; S366-S368 VanDerWaalsContact O-N 3.07Å; S366-S369 PolarHBondContact O-N 2.68Å
367	P	48.1	Very low	64.1	Low	105 Å²	105	70 Å²	70	68%	0.682	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-65.7	-12.5	-174.3	26.5	-35.1	0	0	0	114.3	S369 C370	P367-S369 PolarHBondContact O-N 3.36Å; P367-C370 WeakPolarHBondContact O-CB 3.44Å; P367-C370 PolarHBondContact O-N 3.3Å
368	S	48.7	Very low	61.8	Low	40 Å²	40	76.2 Å²	76.2	28%	0.28	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-73.1	9.5	176.1	43.2	0	0	0	0	115.5	E337 S366	E337-S368 WeakPolarHBondContact OE1-CB 3.46Å; E337-S368 PolarHBondContact OE1-OG 3.43Å; S366-S368 PolarHBondContact O-N 3.49Å; S366-S368 VanDerWaalsContact O-N 3.07Å
369	S	46.5	Very low	59.6	Low	64 Å²	64	79 Å²	79	45%	0.448	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-72.7	-18.6	164	73	0	0	0	0	113.2	S366 P367 S371 E374	S366-S369 PolarHBondContact O-N 2.68Å; P367-S369 PolarHBondContact O-N 3.36Å; S369-S371 VanDerWaalsContact C-N 3.28Å; S369-S371 PolarHBondContact O-N 2.93Å; S369-E374 VanDerWaalsContact CB-OE1 3.23Å; S369-E374 WeakPolarHBondContact CB-OE1 3.45Å; S369-E374 PolarHBondContact OG-OE1 3.16Å
370	C	41.9	Very low	57.3	Low	101 Å²	101	82.3 Å²	82.3	68%	0.682	51%	0.507	S	S	*	.			trans	-75.2	56.9	-172.4	-67.9	0	0	0	0	115.1	P367	P367-C370 WeakPolarHBondContact O-CB 3.44Å; P367-C370 PolarHBondContact O-N 3.3Å
371	S	46.8	Very low	54.8	Low	93 Å²	93	82.9 Å²	82.9	65%	0.65	51%	0.513	S	S	*	.	S	Bend	trans	-134.7	93.1	171.6	-168.8	0	0	0	0	113	S369 G373	S369-S371 VanDerWaalsContact C-N 3.28Å; S369-S371 PolarHBondContact O-N 2.93Å; S371-G373 PolarHBondContact O-N 3.12Å
372	L	46.6	Very low	52.3	Low	142 Å²	142	85.3 Å²	85.3	74%	0.743	53%	0.532	S	S	*	.	S	Bend	trans	55.7	-37.9	168.5	-63.9	173.4	0	0	0	119.2	E374 V375 Q376	L372-E374 VanDerWaalsContact C-N 3.3Å; L372-E374 PolarHBondContact O-N 2.73Å; L372-V375 WeakPolarHBondContact O-CB 3.44Å; L372-V375 PolarHBondContact O-N 2.84Å; L372-V375 VanDerWaalsContact O-N 3.07Å; L372-Q376 PolarHBondContact O-N 3.23Å; L372-Q376 VanDerWaalsContact O-N 3.09Å
373	G	52	Low	50	Low	46 Å²	46	96.2 Å²	96.2	47%	0.474	57%	0.572	S	S	.	*	H	α-helix	trans	-59.9	-35.2	-179.2	0	0	0	0	0	113.5	S371 V375 Q376 A377	S371-G373 PolarHBondContact O-N 3.12Å; G373-V375 VanDerWaalsContact C-N 3.34Å; G373-V375 PolarHBondContact O-N 2.82Å; G373-Q376 PolarHBondContact O-N 2.67Å; G373-A377 WeakPolarHBondContact O-CB 3.4Å; G373-A377 PolarHBondContact O-N 3.33Å
374	E	50.7	Low	48	Very low	87 Å²	87	96.7 Å²	96.7	41%	0.407	59%	0.591	S	S	.	*	H	α-helix	trans	-61.9	-40.4	173.8	-65.6	-175.1	175.8	0	0	112	S369 L372 A377 L378	S369-E374 VanDerWaalsContact CB-OE1 3.23Å; S369-E374 WeakPolarHBondContact CB-OE1 3.45Å; S369-E374 PolarHBondContact OG-OE1 3.16Å; L372-E374 VanDerWaalsContact C-N 3.3Å; L372-E374 PolarHBondContact O-N 2.73Å; E374-A377 PolarHBondContact O-N 3.31Å; E374-L378 WeakPolarHBondContact O-CB 3.4Å; E374-L378 VanDerWaalsContact O-CG 3.23Å; E374-L378 WeakPolarHBondContact O-CG 3.48Å; E374-L378 PolarHBondContact O-N 3.42Å
375	V	45.4	Very low	47.1	Very low	93 Å²	93	92 Å²	92	56%	0.564	59%	0.59	S	S	*	*	H	α-helix	trans	-68	-42	177	-174.5	0	0	0	0	110.5	L372 G373 A377 L378 V379	L372-V375 WeakPolarHBondContact O-CB 3.44Å; L372-V375 PolarHBondContact O-N 2.84Å; L372-V375 VanDerWaalsContact O-N 3.07Å; G373-V375 VanDerWaalsContact C-N 3.34Å; G373-V375 PolarHBondContact O-N 2.82Å; V375-A377 PolarHBondContact O-N 3.44Å; V375-L378 PolarHBondContact O-N 2.89Å; V375-V379 WeakPolarHBondContact O-CG2 3.15Å; V375-V379 PolarHBondContact O-N 2.99Å; V375-V379 VanDerWaalsContact O-N 3.13Å
376	Q	46.9	Very low	47.4	Very low	139 Å²	139	90.4 Å²	90.4	65%	0.65	57%	0.567	S	S	*	*	H	α-helix	trans	-61.5	-42	174.6	-165.8	86.2	26.8	0	0	111.5	L372 G373 V379 S380	L372-Q376 PolarHBondContact O-N 3.23Å; L372-Q376 VanDerWaalsContact O-N 3.09Å; G373-Q376 PolarHBondContact O-N 2.67Å; Q376-V379 PolarHBondContact O-N 3.13Å; Q376-S380 WeakPolarHBondContact O-CB 3.49Å; Q376-S380 PolarHBondContact O-N 2.9Å; Q376-S380 PolarHBondContact O-OG 2.92Å
377	A	46.9	Very low	48.8	Very low	22 Å²	22	92.7 Å²	92.7	18%	0.182	58%	0.58	C	S	.	*	H	α-helix	trans	-67.9	-44.3	178.9	0	0	0	0	0	112.2	G373 E374 V375 V379 S380 G381	G373-A377 WeakPolarHBondContact O-CB 3.4Å; G373-A377 PolarHBondContact O-N 3.33Å; E374-A377 PolarHBondContact O-N 3.31Å; V375-A377 PolarHBondContact O-N 3.44Å; A377-V379 VanDerWaalsContact C-N 3.27Å; A377-V379 PolarHBondContact O-N 3.3Å; A377-S380 PolarHBondContact O-N 3.04Å; A377-G381 PolarHBondContact O-N 3.09Å
378	L	48	Very low	50.8	Low	149 Å²	149	93.2 Å²	93.2	78%	0.78	57%	0.568	S	S	*	*	H	α-helix	trans	-59.8	-35.5	175.4	-73.8	168.4	0	0	0	112.6	E374 V375	E374-L378 WeakPolarHBondContact O-CB 3.4Å; E374-L378 VanDerWaalsContact O-CG 3.23Å; E374-L378 WeakPolarHBondContact O-CG 3.48Å; E374-L378 PolarHBondContact O-N 3.42Å; V375-L378 PolarHBondContact O-N 2.89Å
379	V	47.7	Very low	52.8	Low	124 Å²	124	92.1 Å²	92.1	75%	0.752	56%	0.56	S	S	*	*	H	α-helix	trans	-74.9	-28.3	173.5	172.5	0	0	0	0	112.5	V375 Q376 A377	V375-V379 WeakPolarHBondContact O-CG2 3.15Å; V375-V379 PolarHBondContact O-N 2.99Å; V375-V379 VanDerWaalsContact O-N 3.13Å; Q376-V379 PolarHBondContact O-N 3.13Å; A377-V379 VanDerWaalsContact C-N 3.27Å; A377-V379 PolarHBondContact O-N 3.3Å
380	S	46.5	Very low	55	Low	73 Å²	73	93.7 Å²	93.7	51%	0.51	56%	0.56	S	S	.	*	H	α-helix	trans	-90.5	-11.4	-175.2	-55.7	0	0	0	0	114.6	Q376 A377 C382	Q376-S380 WeakPolarHBondContact O-CB 3.49Å; Q376-S380 PolarHBondContact O-N 2.9Å; Q376-S380 PolarHBondContact O-OG 2.92Å; A377-S380 PolarHBondContact O-N 3.04Å; S380-C382 PolarHBondContact O-N 3.11Å
381	G	38	Very low	57.4	Low	70 Å²	70	89.1 Å²	89.1	72%	0.722	53%	0.529	S	S	*	.			trans	75	-14.6	177.2	0	0	0	0	0	115.7	A377	A377-G381 PolarHBondContact O-N 3.09Å
382	C	41.8	Very low	59.8	Low	97 Å²	97	84.7 Å²	84.7	66%	0.655	50%	0.498	S	S	*	.	S	Bend	trans	-66.9	134.8	164.9	-64.9	0	0	0	0	109.7	S380 G384	S380-C382 PolarHBondContact O-N 3.11Å; C382-G384 PolarHBondContact O-N 3.32Å
383	R	40.9	Very low	62.1	Low	241 Å²	241	78.9 Å²	78.9	91%	0.909	47%	0.467	S	S	*	.			trans	-64.8	122.1	-174.6	-66.4	-177.3	178.2	-140.2	-0.4	110.6	A385	R383-A385 VanDerWaalsContact C-N 3.26Å; R383-A385 PolarHBondContact O-N 3.31Å
384	G	43.9	Very low	64.1	Low	70 Å²	70	79.9 Å²	79.9	72%	0.722	46%	0.46	S	S	*	.	S	Bend	trans	-69.5	75.2	176	0	0	0	0	0	113.2	C382	C382-G384 PolarHBondContact O-N 3.32Å
385	A	52.2	Low	66.3	Low	77 Å²	77	75.8 Å²	75.8	64%	0.636	44%	0.441	S	S	*	.	S	Bend	trans	-136.9	120.1	160.7	0	0	0	0	0	106.5	R383 T387	R383-A385 VanDerWaalsContact C-N 3.26Å; R383-A385 PolarHBondContact O-N 3.31Å; A385-T387 PolarHBondContact O-N 3.34Å
386	S	63.3	Low	68.8	Low	45 Å²	45	72.2 Å²	72.2	32%	0.315	42%	0.417	S	S	.	.			trans	-52.9	128.2	178.1	-171.4	0	0	0	0	109.5	E390	S386-E390 WeakPolarHBondContact OG-CB 3.39Å
387	T	82.1	Confident	71.1	Confident	69 Å²	69	68.7 Å²	68.7	42%	0.423	40%	0.4	S	S	.	.			trans	-68.4	155.2	178.6	62.5	0	0	0	0	110.2	A385 T389 E390 E391	A385-T387 PolarHBondContact O-N 3.34Å; T387-T389 PolarHBondContact O-N 3.46Å; T387-E390 VanDerWaalsContact CB-OE2 3.26Å; T387-E390 WeakPolarHBondContact CB-OE2 3.43Å; T387-E390 VanDerWaalsContact CG2-OE2 3.29Å; T387-E390 WeakPolarHBondContact CG2-OE2 3.15Å; T387-E390 PolarHBondContact N-OE2 3.15Å; T387-E390 PolarHBondContact O-N 2.77Å; T387-E390 VanDerWaalsContact OG1-CD 3.26Å; T387-E390 WeakPolarHBondContact OG1-CG 3.4Å; T387-E390 PolarHBondContact OG1-N 3.26Å; T387-E390 PolarHBondContact OG1-OE2 3.25Å; T387-E391 WeakPolarHBondContact O-CG 3.45Å; T387-E391 PolarHBondContact O-N 3.06Å
388	R	89.2	Confident	73.5	Confident	115 Å²	115	68.1 Å²	68.1	43%	0.434	39%	0.394	S	S	.	.	H	α-helix	trans	-52	-30.9	173.5	-175.7	-179	168.9	96.4	-5.5	112	L359 A392 I414	L359-R388 HydrophobicContact CD1-CG 3.63Å; L359-R388 WeakPolarHBondContact CD1-O 3.43Å; R388-A392 WeakPolarHBondContact O-CB 3.46Å; R388-A392 PolarHBondContact O-N 3.2Å; R388-A392 VanDerWaalsContact O-N 3.15Å; R388-I414 HydrophobicContact CG-CG2 4.04Å
389	T	91.7	Very high	75.9	Confident	18 Å²	18	61.1 Å²	61.1	11%	0.11	36%	0.358	C	S	.	.	H	α-helix	trans	-72.1	-47.8	176.4	-44.9	0	0	0	0	112.2	T387 E391 A392 M393 V415 S418 I427	T387-T389 PolarHBondContact O-N 3.46Å; T389-E391 VanDerWaalsContact C-N 3.34Å; T389-A392 PolarHBondContact O-N 2.88Å; T389-M393 HydrophobicContact CG2-CE 3.99Å; T389-M393 WeakPolarHBondContact O-CG 3.46Å; T389-M393 PolarHBondContact O-N 2.88Å; T389-V415 HydrophobicContact CG2-CG1 4.11Å; T389-V415 HydrophobicContact CG2-CG2 4.27Å; T389-S418 WeakPolarHBondContact CG2-OG 3.39Å; T389-S418 VanDerWaalsContact OG1-CB 3.29Å; T389-S418 WeakPolarHBondContact OG1-CB 3.42Å; T389-S418 PolarHBondContact OG1-OG 2.8Å; T389-I427 HydrophobicContact CG2-CD1 3.97Å; T389-I427 HydrophobicContact CG2-CG1 3.99Å
390	E	91.8	Very high	78.2	Confident	96 Å²	96	59.1 Å²	59.1	45%	0.449	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-40.4	176.4	-71.3	156.8	141.9	0	0	111.1	S386 T387 A392 M393 E394	S386-E390 WeakPolarHBondContact OG-CB 3.39Å; T387-E390 VanDerWaalsContact CB-OE2 3.26Å; T387-E390 WeakPolarHBondContact CB-OE2 3.43Å; T387-E390 VanDerWaalsContact CG2-OE2 3.29Å; T387-E390 WeakPolarHBondContact CG2-OE2 3.15Å; T387-E390 PolarHBondContact N-OE2 3.15Å; T387-E390 PolarHBondContact O-N 2.77Å; T387-E390 VanDerWaalsContact OG1-CD 3.26Å; T387-E390 WeakPolarHBondContact OG1-CG 3.4Å; T387-E390 PolarHBondContact OG1-N 3.26Å; T387-E390 PolarHBondContact OG1-OE2 3.25Å; E390-A392 VanDerWaalsContact C-N 3.29Å; E390-A392 PolarHBondContact O-N 2.95Å; E390-M393 PolarHBondContact O-N 2.99Å; E390-M393 VanDerWaalsContact O-N 3.14Å; E390-E394 PolarHBondContact O-N 3.08Å
391	E	93.3	Very high	80.5	Confident	5 Å²	5	59.9 Å²	59.9	2%	0.023	34%	0.337	C	S	.	.	H	α-helix	trans	-59.7	-39	173.7	-69.5	173.7	148.9	0	0	112.2	Y344 L359 R364 T387 T389 L395	Y344-E391 HydrophobicContact CE1-CB 4.17Å; Y344-E391 HydrophobicContact CE1-CG 4.48Å; Y344-E391 WeakPolarHBondContact OH-CA 3.45Å; L359-E391 HydrophobicContact CD2-CB 4.42Å; R364-E391 IonicContact CZ-OE1 3.62Å; R364-E391 VanDerWaalsContact CZ-OE1 3.29Å; R364-E391 IonicContact CZ-OE2 2.91Å; R364-E391 IonicContact NE-OE1 3.89Å; R364-E391 PolarHBondContact NE-OE1 2.56Å; R364-E391 IonicContact NE-OE2 3.84Å; R364-E391 IonicContact NH2-OE1 2.78Å; R364-E391 PolarHBondContact NH2-OE1 3.15Å; R364-E391 IonicContact NH2-OE2 3.21Å; R364-E391 PolarHBondContact NH2-OE2 3.17Å; T387-E391 WeakPolarHBondContact O-CG 3.45Å; T387-E391 PolarHBondContact O-N 3.06Å; T389-E391 VanDerWaalsContact C-N 3.34Å; E391-L395 WeakPolarHBondContact O-CB 3.43Å; E391-L395 PolarHBondContact O-N 2.67Å
392	A	96.4	Very high	83.3	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-71.3	-35.6	174.4	0	0	0	0	0	112.9	L359 R388 T389 E390 L395 Y396 C411 I414 V415	L359-A392 HydrophobicContact CD1-CB 4.22Å; R388-A392 WeakPolarHBondContact O-CB 3.46Å; R388-A392 PolarHBondContact O-N 3.2Å; R388-A392 VanDerWaalsContact O-N 3.15Å; T389-A392 PolarHBondContact O-N 2.88Å; E390-A392 VanDerWaalsContact C-N 3.29Å; E390-A392 PolarHBondContact O-N 2.95Å; A392-L395 PolarHBondContact O-N 3.49Å; A392-Y396 WeakPolarHBondContact O-CB 3.35Å; A392-Y396 PolarHBondContact O-N 2.71Å; A392-C411 HydrophobicContact CB-CB 4.48Å; A392-C411 WeakPolarHBondContact O-CB 3.32Å; A392-I414 HydrophobicContact CB-CB 4.27Å; A392-I414 HydrophobicContact CB-CG2 3.9Å; A392-V415 HydrophobicContact CB-CG2 3.66Å
393	M	95.8	Very high	85.9	Confident	20 Å²	20	56.7 Å²	56.7	10%	0.099	29%	0.293	C	S	.	.	H	α-helix	trans	-65.8	-43.2	174.3	-70.8	177.3	178.5	0	0	112.1	T389 E390 H397 V415 I427 W430	T389-M393 HydrophobicContact CG2-CE 3.99Å; T389-M393 WeakPolarHBondContact O-CG 3.46Å; T389-M393 PolarHBondContact O-N 2.88Å; E390-M393 PolarHBondContact O-N 2.99Å; E390-M393 VanDerWaalsContact O-N 3.14Å; M393-H397 PolarHBondContact O-CE1 2.88Å; M393-H397 VanDerWaalsContact O-CE1 3.3Å; M393-H397 PolarHBondContact O-ND1 2.83Å; M393-H397 VanDerWaalsContact O-ND1 3.09Å; M393-V415 HydrophobicContact CE-CG1 4.25Å; M393-V415 HydrophobicContact CG-CG2 4.19Å; M393-I427 HydrophobicContact CE-CB 4.16Å; M393-I427 HydrophobicContact CE-CG1 3.56Å; M393-W430 HydrophobicContact CB-CD2 4.36Å; M393-W430 HydrophobicContact CB-CZ2 4.34Å; M393-W430 HydrophobicContact CE-CB 3.87Å; M393-W430 HydrophobicContact CE-CD2 3.99Å; M393-W430 HydrophobicContact CE-CE3 3.9Å; M393-W430 HydrophobicContact CE-CG 4.01Å; M393-W430 HydrophobicContact CG-CD2 3.68Å; M393-W430 HydrophobicContact CG-CE3 4.06Å; M393-W430 HydrophobicContact CG-CG 4Å; M393-W430 HydrophobicContact CG-CZ2 4.17Å; M393-W430 HydrophobicContact CG-CZ3 4.46Å; M393-W430 HydrophobicContact SD-CB 3.86Å; M393-W430 HydrophobicContact SD-CD2 3.93Å; M393-W430 HydrophobicContact SD-CE3 4.4Å; M393-W430 HydrophobicContact SD-CG 3.67Å
394	E	94.4	Very high	88.6	Confident	68 Å²	68	45.3 Å²	45.3	32%	0.318	25%	0.251	S	S	.	.	H	α-helix	trans	-61	-49.9	173.3	-72.9	-173.8	-122.4	0	0	110.8	K343 Y344 E390 Y396 H397 I398	K343-E394 WeakPolarHBondContact CE-OE2 3.24Å; K343-E394 IonicContact NZ-OE1 2.66Å; K343-E394 PolarHBondContact NZ-OE1 3.07Å; K343-E394 IonicContact NZ-OE2 2.96Å; K343-E394 PolarHBondContact NZ-OE2 3.13Å; Y344-E394 HydrophobicContact CE2-CB 3.86Å; Y344-E394 WeakPolarHBondContact CE2-OE2 3.32Å; Y344-E394 PolarHBondContact OH-OE1 2.85Å; Y344-E394 PolarHBondContact OH-OE2 2.71Å; E390-E394 PolarHBondContact O-N 3.08Å; E394-Y396 VanDerWaalsContact C-N 3.29Å; E394-Y396 PolarHBondContact O-N 3.02Å; E394-H397 PolarHBondContact O-N 3.21Å; E394-H397 VanDerWaalsContact O-N 3.17Å; E394-I398 PolarHBondContact O-N 2.95Å
395	L	96.2	Very high	91.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.6	-30.7	-178.3	-170.6	57.3	0	0	0	113.1	Y344 V347 I348 V357 L359 E391 A392 I398 A399 L407 C411	Y344-L395 HydrophobicContact CD1-CB 4.44Å; Y344-L395 HydrophobicContact CD1-CD1 4.16Å; Y344-L395 HydrophobicContact CD1-CD2 4.48Å; Y344-L395 HydrophobicContact CG-CD1 4.07Å; V347-L395 HydrophobicContact CB-CD2 4.17Å; V347-L395 HydrophobicContact CG1-CD2 3.69Å; I348-L395 HydrophobicContact CD1-CD1 4.17Å; I348-L395 HydrophobicContact CG1-CD1 3.75Å; V357-L395 HydrophobicContact CG1-CD2 4.17Å; L359-L395 HydrophobicContact CD2-CD2 3.73Å; E391-L395 WeakPolarHBondContact O-CB 3.43Å; E391-L395 PolarHBondContact O-N 2.67Å; A392-L395 PolarHBondContact O-N 3.49Å; L395-I398 HydrophobicContact CD1-CD1 4.46Å; L395-I398 PolarHBondContact O-N 3.13Å; L395-A399 WeakPolarHBondContact O-CB 3.47Å; L395-A399 PolarHBondContact O-N 3.25Å; L395-L407 HydrophobicContact CD1-CD1 4.36Å; L395-L407 HydrophobicContact CD1-CD2 4.1Å; L395-L407 HydrophobicContact CD2-CD1 3.94Å; L395-L407 HydrophobicContact CG-CD1 4.01Å; L395-L407 HydrophobicContact CG-CD2 4.38Å; L395-L407 HydrophobicContact CG-CG 4.35Å; L395-C411 VanDerWaalsContact CG-SG 3.58Å
396	Y	97.6	Very high	93.2	Very high	19 Å²	19	42.4 Å²	42.4	8%	0.075	21%	0.211	C	C	.	.	H	α-helix	trans	-59.9	-45.1	172.2	-179.1	-98.6	0	0	0	112.4	A392 E394 I398 A399 L400 A408 C411 E412 W430 S437	A392-Y396 WeakPolarHBondContact O-CB 3.35Å; A392-Y396 PolarHBondContact O-N 2.71Å; E394-Y396 VanDerWaalsContact C-N 3.29Å; E394-Y396 PolarHBondContact O-N 3.02Å; Y396-I398 VanDerWaalsContact C-N 3.33Å; Y396-I398 PolarHBondContact O-N 3.49Å; Y396-A399 WeakPolarHBondContact O-CB 3.47Å; Y396-A399 PolarHBondContact O-N 2.92Å; Y396-L400 HydrophobicContact CD1-CD1 4.05Å; Y396-L400 HydrophobicContact CD1-CG 4.32Å; Y396-L400 HydrophobicContact CE1-CD1 3.54Å; Y396-L400 HydrophobicContact CE1-CG 4.04Å; Y396-L400 WeakPolarHBondContact O-CG 3.06Å; Y396-L400 PolarHBondContact O-N 3.13Å; Y396-A408 HydrophobicContact CD2-CB 4.1Å; Y396-A408 WeakPolarHBondContact CD2-O 3.34Å; Y396-A408 HydrophobicContact CE2-CB 4.03Å; Y396-C411 HydrophobicContact CD2-CB 4.28Å; Y396-E412 HydrophobicContact CD2-CG 3.92Å; Y396-E412 HydrophobicContact CE2-CG 3.45Å; Y396-E412 VanDerWaalsContact CE2-CG 3.45Å; Y396-E412 WeakPolarHBondContact CE2-OE1 3.41Å; Y396-E412 PolarHBondContact OH-OE1 2.87Å; Y396-W430 HydrophobicContact CD1-CH2 4.04Å; Y396-W430 AromaticContact CD1-CZ2 3.5Å; Y396-W430 HydrophobicContact CD1-CZ2 3.5Å; Y396-W430 VanDerWaalsContact CD1-CZ2 3.5Å; Y396-W430 HydrophobicContact CE1-CH2 4.35Å; Y396-W430 HydrophobicContact CE1-CZ2 4.05Å; Y396-W430 HydrophobicContact CG-CH2 4.14Å; Y396-W430 AromaticContact CG-CZ2 3.86Å; Y396-W430 HydrophobicContact CG-CZ2 3.86Å; Y396-S437 WeakPolarHBondContact OH-CA 3.23Å; Y396-S437 WeakPolarHBondContact OH-CB 3.43Å
397	H	96.1	Very high	94.9	Very high	64 Å²	64	40.3 Å²	40.3	30%	0.296	20%	0.196	S	C	.	.	H	α-helix	trans	-65.2	-38.4	178.2	-54.1	131.6	0	0	0	111.6	M393 E394 A399 L400 F401 W430 Y435	M393-H397 PolarHBondContact O-CE1 2.88Å; M393-H397 VanDerWaalsContact O-CE1 3.3Å; M393-H397 PolarHBondContact O-ND1 2.83Å; M393-H397 VanDerWaalsContact O-ND1 3.09Å; E394-H397 PolarHBondContact O-N 3.21Å; E394-H397 VanDerWaalsContact O-N 3.17Å; H397-A399 VanDerWaalsContact C-N 3.33Å; H397-L400 PolarHBondContact O-N 3.33Å; H397-F401 PolarHBondContact O-N 3.41Å; H397-W430 AromaticContact CE1-CD1 3.92Å; H397-W430 AromaticContact CE1-NE1 3.24Å; H397-W430 PolarHBondContact CE1-NE1 3.35Å; H397-W430 AromaticContact NE2-CD1 3.83Å; H397-W430 AromaticContact NE2-CE2 3.93Å; H397-W430 AromaticContact NE2-NE1 2.95Å; H397-W430 PolarHBondContact NE2-NE1 3.5Å; H397-Y435 AromaticContact CD2-CD2 3.87Å; H397-Y435 AromaticContact NE2-CD2 3.54Å; H397-Y435 AromaticContact NE2-CE2 3.83Å
398	I	96.9	Very high	95.6	Very high	11 Å²	11	37.3 Å²	37.3	6%	0.056	18%	0.178	C	C	.	.	H	α-helix	trans	-64.1	-39.8	174.3	-58.4	168.7	0	0	0	110.5	I340 Y344 I348 E394 L395 Y396 F401 L402	I340-I398 HydrophobicContact CG1-CG2 4.19Å; I340-I398 HydrophobicContact CG2-CG2 4.19Å; Y344-I398 HydrophobicContact CD2-CD1 3.57Å; Y344-I398 HydrophobicContact CE2-CD1 4.32Å; Y344-I398 HydrophobicContact CG-CD1 4.19Å; I348-I398 HydrophobicContact CD1-CG2 3.66Å; E394-I398 PolarHBondContact O-N 2.95Å; L395-I398 HydrophobicContact CD1-CD1 4.46Å; L395-I398 PolarHBondContact O-N 3.13Å; Y396-I398 VanDerWaalsContact C-N 3.33Å; Y396-I398 PolarHBondContact O-N 3.49Å; I398-F401 PolarHBondContact O-N 2.88Å; I398-L402 HydrophobicContact CG2-CD1 4.03Å; I398-L402 HydrophobicContact CG2-CG 4.37Å; I398-L402 WeakPolarHBondContact O-CB 3.36Å; I398-L402 WeakPolarHBondContact O-CG 3.37Å; I398-L402 PolarHBondContact O-N 3.39Å
399	A	97.6	Very high	96	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-63.6	-39.5	176	0	0	0	0	0	112.6	L395 Y396 H397 E403 F404 L407 A408	L395-A399 WeakPolarHBondContact O-CB 3.47Å; L395-A399 PolarHBondContact O-N 3.25Å; Y396-A399 WeakPolarHBondContact O-CB 3.47Å; Y396-A399 PolarHBondContact O-N 2.92Å; H397-A399 VanDerWaalsContact C-N 3.33Å; A399-E403 PolarHBondContact O-N 3.05Å; A399-F404 PolarHBondContact O-N 3.14Å; A399-L407 HydrophobicContact CB-CB 3.94Å; A399-L407 HydrophobicContact CB-CD2 3.73Å; A399-L407 HydrophobicContact CB-CG 3.71Å; A399-A408 HydrophobicContact CB-CB 3.77Å
400	L	95.9	Very high	96.3	Very high	82 Å²	82	33.5 Å²	33.5	43%	0.429	17%	0.169	S	C	.	.	H	α-helix	trans	-64.4	-43.4	172.1	-67.4	-175.3	0	0	0	111.9	Y396 H397 L402 E403	Y396-L400 HydrophobicContact CD1-CD1 4.05Å; Y396-L400 HydrophobicContact CD1-CG 4.32Å; Y396-L400 HydrophobicContact CE1-CD1 3.54Å; Y396-L400 HydrophobicContact CE1-CG 4.04Å; Y396-L400 WeakPolarHBondContact O-CG 3.06Å; Y396-L400 PolarHBondContact O-N 3.13Å; H397-L400 PolarHBondContact O-N 3.33Å; L400-L402 PolarHBondContact O-N 2.97Å; L400-E403 PolarHBondContact O-N 3.32Å; L400-E403 VanDerWaalsContact O-N 3.12Å
401	F	96.1	Very high	96.6	Very high	90 Å²	90	28.9 Å²	28.9	40%	0.395	15%	0.147	S	C	.	.	H	α-helix	trans	-62.1	-40.1	176.8	174.1	-95.8	0	0	0	112.8	F307 I339 I340 H397 I398 E403	F307-F401 HydrophobicContact CD2-CE1 4.28Å; F307-F401 HydrophobicContact CD2-CZ 4.31Å; F307-F401 HydrophobicContact CE1-CE1 4.29Å; F307-F401 AromaticContact CE2-CE1 3.82Å; F307-F401 HydrophobicContact CE2-CE1 3.82Å; F307-F401 HydrophobicContact CE2-CE2 4.49Å; F307-F401 AromaticContact CE2-CZ 3.64Å; F307-F401 HydrophobicContact CE2-CZ 3.64Å; F307-F401 AromaticContact CZ-CE1 3.83Å; F307-F401 HydrophobicContact CZ-CE1 3.83Å; F307-F401 AromaticContact CZ-CZ 3.94Å; F307-F401 HydrophobicContact CZ-CZ 3.94Å; I339-F401 HydrophobicContact CG2-CD1 4.11Å; I339-F401 HydrophobicContact CG2-CD2 4.3Å; I339-F401 HydrophobicContact CG2-CE1 3.92Å; I339-F401 HydrophobicContact CG2-CE2 4.1Å; I339-F401 HydrophobicContact CG2-CG 4.31Å; I339-F401 HydrophobicContact CG2-CZ 3.91Å; I340-F401 HydrophobicContact CD1-CD1 4.29Å; I340-F401 HydrophobicContact CD1-CE1 4.17Å; H397-F401 PolarHBondContact O-N 3.41Å; I398-F401 PolarHBondContact O-N 2.88Å; F401-E403 PolarHBondContact O-N 2.96Å
402	L	96.6	Very high	96.8	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-1.6	176.2	-68	178.8	0	0	0	113.8	S305 F307 F308 I340 I348 I398 L400 F404	S305-L402 WeakPolarHBondContact CB-O 3.5Å; S305-L402 PolarHBondContact OG-O 3.13Å; F307-L402 HydrophobicContact CD1-CD2 3.6Å; F307-L402 HydrophobicContact CE1-CD2 4.07Å; F307-L402 HydrophobicContact CG-CD2 4.22Å; F308-L402 HydrophobicContact CD2-CD2 4.27Å; F308-L402 HydrophobicContact CE2-CD1 4.33Å; F308-L402 HydrophobicContact CE2-CD2 3.61Å; F308-L402 HydrophobicContact CZ-CD2 3.89Å; I340-L402 HydrophobicContact CD1-CD1 4.46Å; I340-L402 HydrophobicContact CD1-CD2 3.87Å; I340-L402 HydrophobicContact CD1-CG 4.34Å; I348-L402 HydrophobicContact CD1-CD1 4.26Å; I348-L402 HydrophobicContact CG2-CD1 3.77Å; I398-L402 HydrophobicContact CG2-CD1 4.03Å; I398-L402 HydrophobicContact CG2-CG 4.37Å; I398-L402 WeakPolarHBondContact O-CB 3.36Å; I398-L402 WeakPolarHBondContact O-CG 3.37Å; I398-L402 PolarHBondContact O-N 3.39Å; L400-L402 PolarHBondContact O-N 2.97Å; L402-F404 HydrophobicContact CB-CB 4.21Å; L402-F404 PolarHBondContact O-N 3.47Å
403	E	96.6	Very high	96.8	Very high	98 Å²	98	32.1 Å²	32.1	46%	0.458	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	29.2	-172.9	-58.9	177.2	-103.3	0	0	112.9	P306 A399 L400 F401	P306-E403 HydrophobicContact CB-CB 3.85Å; P306-E403 HydrophobicContact CB-CG 4.4Å; P306-E403 WeakPolarHBondContact CD-O 3.43Å; P306-E403 HydrophobicContact CG-CB 3.66Å; A399-E403 PolarHBondContact O-N 3.05Å; L400-E403 PolarHBondContact O-N 3.32Å; L400-E403 VanDerWaalsContact O-N 3.12Å; F401-E403 PolarHBondContact O-N 2.96Å
404	F	97.4	Very high	96.9	Very high	3 Å²	3	31.7 Å²	31.7	1%	0.013	16%	0.162	C	C	.	.			trans	-103	89.7	-171.8	-176.9	-152.1	0	0	0	111.8	R304 C351 M352 A399 L402 M406 L407 A408	R304-F404 HydrophobicContact CB-CD2 4.47Å; R304-F404 HydrophobicContact CB-CE2 4.12Å; R304-F404 WeakPolarHBondContact O-CD2 3.44Å; C351-F404 HydrophobicContact CB-CE1 4.07Å; C351-F404 HydrophobicContact CB-CZ 4.29Å; M352-F404 HydrophobicContact CB-CE1 4.46Å; M352-F404 HydrophobicContact CB-CZ 4.42Å; M352-F404 HydrophobicContact CE-CD1 3.93Å; M352-F404 HydrophobicContact CE-CE1 4.25Å; M352-F404 HydrophobicContact CE-CG 4.45Å; M352-F404 HydrophobicContact CG-CD1 4.12Å; M352-F404 HydrophobicContact CG-CE1 3.49Å; M352-F404 VanDerWaalsContact CG-CE1 3.49Å; M352-F404 HydrophobicContact CG-CZ 3.76Å; A399-F404 PolarHBondContact O-N 3.14Å; L402-F404 HydrophobicContact CB-CB 4.21Å; L402-F404 PolarHBondContact O-N 3.47Å; F404-M406 HydrophobicContact CD2-CB 4.41Å; F404-M406 HydrophobicContact CE2-CB 3.78Å; F404-M406 HydrophobicContact CE2-CG 4.47Å; F404-M406 HydrophobicContact CZ-CB 4.19Å; F404-M406 PolarHBondContact O-N 2.96Å; F404-L407 HydrophobicContact CD1-CB 3.4Å; F404-L407 HydrophobicContact CD1-CD2 3.9Å; F404-L407 HydrophobicContact CD1-CG 4.29Å; F404-L407 HydrophobicContact CE1-CB 3.59Å; F404-L407 HydrophobicContact CE1-CD2 4.37Å; F404-L407 HydrophobicContact CG-CB 4.03Å; F404-L407 HydrophobicContact CZ-CB 4.35Å; F404-L407 PolarHBondContact O-N 3.39Å; F404-A408 PolarHBondContact O-N 2.89Å
405	S	96.1	Very high	97	Very high	47 Å²	47	28.4 Å²	28.4	33%	0.329	15%	0.147	S	C	.	.	H	α-helix	trans	-70.8	-26.9	-168.6	51.1	0	0	0	0	115.7	P126 A408 Q409	P126-S405 WeakPolarHBondContact CD-OG 3.12Å; S405-A408 PolarHBondContact O-N 3.32Å; S405-Q409 WeakPolarHBondContact O-CG 3.39Å; S405-Q409 PolarHBondContact O-N 2.87Å
406	M	97.1	Very high	97.1	Very high	39 Å²	39	30.2 Å²	30.2	19%	0.192	16%	0.158	C	C	.	.	H	α-helix	trans	-63.2	-46.8	173.4	-76.1	-62.5	-50.9	0	0	111.6	A125 P126 D355 F404 A408 Q409 G410	A125-M406 HydrophobicContact CB-CG 3.95Å; A125-M406 HydrophobicContact CB-SD 3.37Å; A125-M406 WeakPolarHBondContact CB-SD 3.48Å; P126-M406 WeakPolarHBondContact O-CG 3.49Å; D355-M406 HydrophobicContact CB-CE 3.88Å; D355-M406 WeakPolarHBondContact OD1-CE 3.4Å; D355-M406 WeakPolarHBondContact OD1-CG 3.28Å; F404-M406 HydrophobicContact CD2-CB 4.41Å; F404-M406 HydrophobicContact CE2-CB 3.78Å; F404-M406 HydrophobicContact CE2-CG 4.47Å; F404-M406 HydrophobicContact CZ-CB 4.19Å; F404-M406 PolarHBondContact O-N 2.96Å; M406-A408 VanDerWaalsContact C-N 3.34Å; M406-A408 PolarHBondContact O-N 3.47Å; M406-Q409 PolarHBondContact O-N 3.31Å; M406-G410 PolarHBondContact O-N 3.44Å
407	L	98.1	Very high	97	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.6	-42.1	175.2	179	66.5	0	0	0	111.2	I348 C351 V357 L395 A399 F404 Q409 G410 C411	I348-L407 HydrophobicContact CB-CD2 4.38Å; I348-L407 HydrophobicContact CG1-CD2 3.88Å; I348-L407 HydrophobicContact CG2-CD2 4.27Å; C351-L407 HydrophobicContact CB-CD1 4.24Å; V357-L407 HydrophobicContact CB-CD1 4.42Å; V357-L407 HydrophobicContact CG1-CD1 3.91Å; V357-L407 HydrophobicContact CG2-CD1 3.68Å; L395-L407 HydrophobicContact CD1-CD1 4.36Å; L395-L407 HydrophobicContact CD1-CD2 4.1Å; L395-L407 HydrophobicContact CD2-CD1 3.94Å; L395-L407 HydrophobicContact CG-CD1 4.01Å; L395-L407 HydrophobicContact CG-CD2 4.38Å; L395-L407 HydrophobicContact CG-CG 4.35Å; A399-L407 HydrophobicContact CB-CB 3.94Å; A399-L407 HydrophobicContact CB-CD2 3.73Å; A399-L407 HydrophobicContact CB-CG 3.71Å; F404-L407 HydrophobicContact CD1-CB 3.4Å; F404-L407 HydrophobicContact CD1-CD2 3.9Å; F404-L407 HydrophobicContact CD1-CG 4.29Å; F404-L407 HydrophobicContact CE1-CB 3.59Å; F404-L407 HydrophobicContact CE1-CD2 4.37Å; F404-L407 HydrophobicContact CG-CB 4.03Å; F404-L407 HydrophobicContact CZ-CB 4.35Å; F404-L407 PolarHBondContact O-N 3.39Å; L407-Q409 PolarHBondContact O-N 2.78Å; L407-G410 PolarHBondContact O-N 2.9Å; L407-C411 PolarHBondContact O-N 3.38Å; L407-C411 PolarHBondContact O-SG 3.23Å
408	A	97.5	Very high	96.9	Very high	7 Å²	7	34.9 Å²	34.9	6%	0.058	18%	0.184	C	C	.	.	H	α-helix	trans	-59.6	-47.3	177.1	0	0	0	0	0	111.3	Y396 A399 F404 S405 M406 C411 E412	Y396-A408 HydrophobicContact CD2-CB 4.1Å; Y396-A408 WeakPolarHBondContact CD2-O 3.34Å; Y396-A408 HydrophobicContact CE2-CB 4.03Å; A399-A408 HydrophobicContact CB-CB 3.77Å; F404-A408 PolarHBondContact O-N 2.89Å; S405-A408 PolarHBondContact O-N 3.32Å; M406-A408 VanDerWaalsContact C-N 3.34Å; M406-A408 PolarHBondContact O-N 3.47Å; A408-C411 WeakPolarHBondContact O-CB 3.39Å; A408-C411 PolarHBondContact O-N 3.46Å; A408-E412 WeakPolarHBondContact O-CG 3.41Å; A408-E412 PolarHBondContact O-N 3.23Å
409	Q	97.2	Very high	96.8	Very high	35 Å²	35	35.7 Å²	35.7	16%	0.164	19%	0.188	C	C	.	.	H	α-helix	trans	-66.8	-41.3	178.6	-72	-168.7	19.8	0	0	112.8	A123 A125 S405 M406 L407 C411 E412 D413	A123-Q409 PolarHBondContact O-NE2 3.04Å; A125-Q409 HydrophobicContact CB-CG 4.37Å; S405-Q409 WeakPolarHBondContact O-CG 3.39Å; S405-Q409 PolarHBondContact O-N 2.87Å; M406-Q409 PolarHBondContact O-N 3.31Å; L407-Q409 PolarHBondContact O-N 2.78Å; Q409-C411 VanDerWaalsContact C-N 3.25Å; Q409-C411 PolarHBondContact O-N 3.19Å; Q409-E412 WeakPolarHBondContact O-CB 3.4Å; Q409-E412 PolarHBondContact O-N 2.91Å; Q409-E412 VanDerWaalsContact O-N 3.13Å; Q409-D413 PolarHBondContact O-N 3.4Å
410	G	97.7	Very high	96.6	Very high	17 Å²	17	37.8 Å²	37.8	18%	0.175	20%	0.203	C	C	.	.	H	α-helix	trans	-61	-33.9	173.1	0	0	0	0	0	113	M406 L407 I414	M406-G410 PolarHBondContact O-N 3.44Å; L407-G410 PolarHBondContact O-N 2.9Å; G410-I414 WeakPolarHBondContact O-CD1 3.4Å; G410-I414 VanDerWaalsContact O-CG1 3.25Å; G410-I414 WeakPolarHBondContact O-CG1 3.43Å; G410-I414 PolarHBondContact O-N 3.36Å; G410-I414 VanDerWaalsContact O-N 3.11Å
411	C	97.9	Very high	96.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-69.4	-42.5	171.7	-64.8	0	0	0	0	112.5	A392 L395 Y396 L407 A408 Q409 D413 I414 V415	A392-C411 HydrophobicContact CB-CB 4.48Å; A392-C411 WeakPolarHBondContact O-CB 3.32Å; L395-C411 VanDerWaalsContact CG-SG 3.58Å; Y396-C411 HydrophobicContact CD2-CB 4.28Å; L407-C411 PolarHBondContact O-N 3.38Å; L407-C411 PolarHBondContact O-SG 3.23Å; A408-C411 WeakPolarHBondContact O-CB 3.39Å; A408-C411 PolarHBondContact O-N 3.46Å; Q409-C411 VanDerWaalsContact C-N 3.25Å; Q409-C411 PolarHBondContact O-N 3.19Å; C411-D413 VanDerWaalsContact C-N 3.29Å; C411-D413 PolarHBondContact O-N 2.91Å; C411-I414 PolarHBondContact O-N 3.42Å; C411-V415 VanDerWaalsContact O-CG2 3.32Å; C411-V415 WeakPolarHBondContact O-CG2 3.45Å; C411-V415 PolarHBondContact O-N 2.74Å
412	E	97.6	Very high	96.2	Very high	16 Å²	16	37.9 Å²	37.9	8%	0.075	21%	0.208	C	C	.	.	H	α-helix	trans	-56.8	-44.2	173.7	-69	-177	158	0	0	111.8	R122 Y396 A408 Q409 V415 V416 S437 W439 V440	R122-E412 IonicContact CZ-OE2 3.64Å; R122-E412 IonicContact NE-OE2 2.67Å; R122-E412 IonicContact NH1-OE2 3.27Å; R122-E412 PolarHBondContact NH1-OE2 2.88Å; Y396-E412 HydrophobicContact CD2-CG 3.92Å; Y396-E412 HydrophobicContact CE2-CG 3.45Å; Y396-E412 VanDerWaalsContact CE2-CG 3.45Å; Y396-E412 WeakPolarHBondContact CE2-OE1 3.41Å; Y396-E412 PolarHBondContact OH-OE1 2.87Å; A408-E412 WeakPolarHBondContact O-CG 3.41Å; A408-E412 PolarHBondContact O-N 3.23Å; Q409-E412 WeakPolarHBondContact O-CB 3.4Å; Q409-E412 PolarHBondContact O-N 2.91Å; Q409-E412 VanDerWaalsContact O-N 3.13Å; E412-V415 PolarHBondContact O-N 2.92Å; E412-V416 PolarHBondContact O-N 3.13Å; E412-S437 VanDerWaalsContact OE1-CB 3.28Å; E412-S437 WeakPolarHBondContact OE1-CB 3.25Å; E412-S437 PolarHBondContact OE1-OG 3.46Å; E412-W439 HydrophobicContact CB-CE3 3.81Å; E412-W439 HydrophobicContact CB-CZ3 3.86Å; E412-W439 HydrophobicContact CG-CE3 4.46Å; E412-V440 HydrophobicContact CB-CG2 3.75Å; E412-V440 HydrophobicContact CG-CG2 3.93Å
413	D	97.4	Very high	96	Very high	57 Å²	57	38.7 Å²	38.7	31%	0.305	21%	0.214	S	C	.	.	H	α-helix	trans	-67.3	-44.5	-176.7	-64	-18.3	0	0	0	110.7	R122 Q409 C411 V415 V416 E417 W439	R122-D413 IonicContact CZ-OD1 3.89Å; R122-D413 VanDerWaalsContact CZ-OD1 3.26Å; R122-D413 IonicContact CZ-OD2 3.42Å; R122-D413 IonicContact NH1-OD1 3.99Å; R122-D413 PolarHBondContact NH1-OD1 2.91Å; R122-D413 IonicContact NH1-OD2 2.68Å; R122-D413 VanDerWaalsContact NH2-CG 3.26Å; R122-D413 IonicContact NH2-OD1 2.76Å; R122-D413 PolarHBondContact NH2-OD1 3.28Å; R122-D413 IonicContact NH2-OD2 2.71Å; R122-D413 PolarHBondContact NH2-OD2 3.2Å; Q409-D413 PolarHBondContact O-N 3.4Å; C411-D413 VanDerWaalsContact C-N 3.29Å; C411-D413 PolarHBondContact O-N 2.91Å; D413-V415 VanDerWaalsContact C-N 3.31Å; D413-V415 PolarHBondContact O-N 3.11Å; D413-V416 PolarHBondContact O-N 3.17Å; D413-V416 VanDerWaalsContact O-N 3.11Å; D413-E417 WeakPolarHBondContact O-CG 3.48Å; D413-E417 PolarHBondContact O-N 3.49Å; D413-W439 VanDerWaalsContact OD1-CH2 3.23Å; D413-W439 WeakPolarHBondContact OD1-CH2 3.17Å
414	I	96.9	Very high	95.9	Very high	10 Å²	10	34 Å²	34	5%	0.051	19%	0.192	C	C	.	.	H	α-helix	trans	-61.4	-36	174.3	-68.8	166.1	0	0	0	112.2	V357 L359 R388 A392 G410 C411 S418	V357-I414 HydrophobicContact CB-CD1 4.41Å; V357-I414 HydrophobicContact CG1-CD1 4Å; L359-I414 HydrophobicContact CD1-CD1 4Å; L359-I414 HydrophobicContact CD1-CG2 3.88Å; L359-I414 HydrophobicContact CG-CD1 4.21Å; R388-I414 HydrophobicContact CG-CG2 4.04Å; A392-I414 HydrophobicContact CB-CB 4.27Å; A392-I414 HydrophobicContact CB-CG2 3.9Å; G410-I414 WeakPolarHBondContact O-CD1 3.4Å; G410-I414 VanDerWaalsContact O-CG1 3.25Å; G410-I414 WeakPolarHBondContact O-CG1 3.43Å; G410-I414 PolarHBondContact O-N 3.36Å; G410-I414 VanDerWaalsContact O-N 3.11Å; C411-I414 PolarHBondContact O-N 3.42Å; I414-S418 PolarHBondContact O-N 3.22Å; I414-S418 PolarHBondContact O-OG 2.82Å; I414-S418 VanDerWaalsContact O-OG 3.08Å
415	V	97.1	Very high	95.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-70.3	-33	175.7	175.2	0	0	0	0	111.6	T389 A392 M393 C411 E412 D413 S418 I427 W430 V440	T389-V415 HydrophobicContact CG2-CG1 4.11Å; T389-V415 HydrophobicContact CG2-CG2 4.27Å; A392-V415 HydrophobicContact CB-CG2 3.66Å; M393-V415 HydrophobicContact CE-CG1 4.25Å; M393-V415 HydrophobicContact CG-CG2 4.19Å; C411-V415 VanDerWaalsContact O-CG2 3.32Å; C411-V415 WeakPolarHBondContact O-CG2 3.45Å; C411-V415 PolarHBondContact O-N 2.74Å; E412-V415 PolarHBondContact O-N 2.92Å; D413-V415 VanDerWaalsContact C-N 3.31Å; D413-V415 PolarHBondContact O-N 3.11Å; V415-S418 PolarHBondContact O-OG 2.98Å; V415-I427 HydrophobicContact CG1-CD1 3.98Å; V415-I427 HydrophobicContact CG1-CG1 3.86Å; V415-I427 HydrophobicContact CG1-CG2 3.92Å; V415-W430 HydrophobicContact CG1-CZ3 4.18Å; V415-V440 HydrophobicContact CG1-CG1 3.74Å
416	V	96.7	Very high	95.7	Very high	37 Å²	37	35 Å²	35	22%	0.224	20%	0.197	C	C	.	.	H	α-helix	trans	-76.5	-37	175.1	167.4	0	0	0	0	112.1	E412 D413 S418 L419 W439 V440 Q443	E412-V416 PolarHBondContact O-N 3.13Å; D413-V416 PolarHBondContact O-N 3.17Å; D413-V416 VanDerWaalsContact O-N 3.11Å; V416-S418 PolarHBondContact O-N 2.89Å; V416-L419 HydrophobicContact CB-CD1 4.39Å; V416-L419 HydrophobicContact CG1-CD1 4.22Å; V416-L419 HydrophobicContact CG2-CD1 4.27Å; V416-L419 WeakPolarHBondContact O-CB 3.48Å; V416-L419 PolarHBondContact O-N 3.23Å; V416-W439 HydrophobicContact CB-CH2 4.34Å; V416-W439 HydrophobicContact CB-CZ3 4.1Å; V416-W439 HydrophobicContact CG1-CH2 4.47Å; V416-W439 HydrophobicContact CG2-CE3 4.18Å; V416-W439 HydrophobicContact CG2-CH2 4.05Å; V416-W439 HydrophobicContact CG2-CZ3 3.46Å; V416-W439 VanDerWaalsContact CG2-CZ3 3.46Å; V416-V440 HydrophobicContact CG2-CB 4.37Å; V416-V440 HydrophobicContact CG2-CG1 4.06Å; V416-V440 HydrophobicContact CG2-CG2 4.1Å; V416-Q443 HydrophobicContact CG1-CB 4.32Å; V416-Q443 HydrophobicContact CG2-CB 3.8Å; V416-Q443 HydrophobicContact CG2-CG 4.09Å
417	E	95.9	Very high	95.7	Very high	149 Å²	149	33.2 Å²	33.2	70%	0.696	19%	0.188	S	C	*	.	H	α-helix	trans	-59.6	-30.2	171.3	-75.6	-174.9	158.4	0	0	112.7	D413	D413-E417 WeakPolarHBondContact O-CG 3.48Å; D413-E417 PolarHBondContact O-N 3.49Å
418	S	94	Very high	95.6	Very high	32 Å²	32	33.2 Å²	33.2	22%	0.224	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	13.8	179.7	66.5	0	0	0	0	114.6	T389 I414 V415 V416 S420 S423	T389-S418 WeakPolarHBondContact CG2-OG 3.39Å; T389-S418 VanDerWaalsContact OG1-CB 3.29Å; T389-S418 WeakPolarHBondContact OG1-CB 3.42Å; T389-S418 PolarHBondContact OG1-OG 2.8Å; I414-S418 PolarHBondContact O-N 3.22Å; I414-S418 PolarHBondContact O-OG 2.82Å; I414-S418 VanDerWaalsContact O-OG 3.08Å; V415-S418 PolarHBondContact O-OG 2.98Å; V416-S418 PolarHBondContact O-N 2.89Å; S418-S420 PolarHBondContact O-N 3.05Å; S418-S423 PolarHBondContact O-OG 2.78Å
419	L	94.9	Very high	95.5	Very high	28 Å²	28	37.9 Å²	37.9	15%	0.147	21%	0.207	C	C	.	.			trans	-64.6	119.3	170.2	-84	166.2	0	0	0	111.6	V416 L424 I427 Q443 A444 F447	V416-L419 HydrophobicContact CB-CD1 4.39Å; V416-L419 HydrophobicContact CG1-CD1 4.22Å; V416-L419 HydrophobicContact CG2-CD1 4.27Å; V416-L419 WeakPolarHBondContact O-CB 3.48Å; V416-L419 PolarHBondContact O-N 3.23Å; L419-L424 HydrophobicContact CD2-CD1 4.24Å; L419-I427 HydrophobicContact CD2-CB 4.33Å; L419-I427 HydrophobicContact CD2-CD1 3.67Å; L419-I427 HydrophobicContact CD2-CG2 4.1Å; L419-I427 HydrophobicContact CG-CD1 4.06Å; L419-Q443 HydrophobicContact CD1-CB 4.5Å; L419-A444 HydrophobicContact CD2-CB 4.04Å; L419-F447 HydrophobicContact CB-CD2 4.34Å; L419-F447 HydrophobicContact CD1-CB 4.46Å
420	S	93.8	Very high	95.5	Very high	46 Å²	46	36.9 Å²	36.9	32%	0.322	20%	0.202	S	C	.	.			trans	-141.7	175.3	173.6	78.1	0	0	0	0	109.3	S418 D422 S423 L424	S418-S420 PolarHBondContact O-N 3.05Å; S420-D422 PolarHBondContact O-N 3.46Å; S420-D422 PolarHBondContact OG-N 3.13Å; S420-S423 PolarHBondContact N-OG 2.67Å; S420-S423 PolarHBondContact O-N 2.69Å; S420-S423 PolarHBondContact OG-N 2.76Å; S420-S423 PolarHBondContact OG-OG 2.9Å; S420-L424 VanDerWaalsContact O-CB 3.25Å; S420-L424 WeakPolarHBondContact O-CB 3.31Å; S420-L424 PolarHBondContact O-N 3.44Å
421	L	92.4	Very high	95.4	Very high	40 Å²	40	36.2 Å²	36.2	21%	0.209	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-34.1	174.8	-62.8	176.2	0	0	0	112.3	F447 Q454 V455 V460	L421-F447 HydrophobicContact CD2-CE1 4.32Å; L421-Q454 HydrophobicContact CD1-CB 4.02Å; L421-Q454 HydrophobicContact CD2-CB 4.09Å; L421-V455 HydrophobicContact CD2-CG2 3.72Å; L421-V460 WeakPolarHBondContact O-CG2 3.47Å
422	D	90.4	Very high	95.3	Very high	134 Å²	134	39.1 Å²	39.1	72%	0.717	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-37.1	-176	-50.3	-36.8	0	0	0	111.9	S420	S420-D422 PolarHBondContact O-N 3.46Å; S420-D422 PolarHBondContact OG-N 3.13Å
423	S	92.8	Very high	95	Very high	18 Å²	18	41.6 Å²	41.6	13%	0.126	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-17.4	179.2	65.9	0	0	0	0	113.9	S418 S420 V425 P426 I427	S418-S423 PolarHBondContact O-OG 2.78Å; S420-S423 PolarHBondContact N-OG 2.67Å; S420-S423 PolarHBondContact O-N 2.69Å; S420-S423 PolarHBondContact OG-N 2.76Å; S420-S423 PolarHBondContact OG-OG 2.9Å; S423-V425 VanDerWaalsContact C-N 3.34Å; S423-V425 PolarHBondContact O-N 3.38Å; S423-P426 VanDerWaalsContact O-CD 3.3Å; S423-P426 WeakPolarHBondContact O-CD 3.49Å; S423-I427 WeakPolarHBondContact O-CB 3.43Å; S423-I427 VanDerWaalsContact O-CG1 3.24Å; S423-I427 WeakPolarHBondContact O-CG1 3.42Å; S423-I427 PolarHBondContact O-N 2.84Å
424	L	95.1	Very high	94.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-53.3	-45.1	-176.8	177.5	59.9	0	0	0	113.5	L419 S420 I427 L428 A444 F447 L448 V455	L419-L424 HydrophobicContact CD2-CD1 4.24Å; S420-L424 VanDerWaalsContact O-CB 3.25Å; S420-L424 WeakPolarHBondContact O-CB 3.31Å; S420-L424 PolarHBondContact O-N 3.44Å; L424-I427 PolarHBondContact O-N 3.28Å; L424-L428 HydrophobicContact CD1-CD1 3.71Å; L424-L428 HydrophobicContact CD1-CG 3.96Å; L424-L428 HydrophobicContact CG-CD1 3.88Å; L424-L428 HydrophobicContact CG-CG 4.49Å; L424-L428 WeakPolarHBondContact O-CB 3.47Å; L424-L428 VanDerWaalsContact O-CG 3.29Å; L424-L428 WeakPolarHBondContact O-CG 3.42Å; L424-L428 PolarHBondContact O-N 3.24Å; L424-A444 HydrophobicContact CD1-CB 4.25Å; L424-A444 WeakPolarHBondContact CD1-O 3.48Å; L424-F447 HydrophobicContact CD1-CD1 3.87Å; L424-F447 HydrophobicContact CD2-CD1 4Å; L424-F447 HydrophobicContact CD2-CE1 4.14Å; L424-F447 HydrophobicContact CG-CD1 4.39Å; L424-L448 HydrophobicContact CD1-CB 4.46Å; L424-L448 HydrophobicContact CD2-CB 4.29Å; L424-L448 HydrophobicContact CD2-CD1 4.13Å; L424-V455 HydrophobicContact CD2-CG2 4.04Å
425	V	94.8	Very high	94.3	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.03	27%	0.271	C	S	.	.	H	α-helix	trans	-72.2	-46.7	-175.9	169.1	0	0	0	0	112.1	S423 K429 V460 E463 L464	S423-V425 VanDerWaalsContact C-N 3.34Å; S423-V425 PolarHBondContact O-N 3.38Å; V425-K429 HydrophobicContact CG1-CD 3.95Å; V425-K429 WeakPolarHBondContact O-CB 3.41Å; V425-K429 VanDerWaalsContact O-CG 3.26Å; V425-K429 WeakPolarHBondContact O-CG 3.46Å; V425-K429 PolarHBondContact O-N 2.8Å; V425-V460 HydrophobicContact CG2-CG1 3.81Å; V425-E463 HydrophobicContact CG1-CB 4.02Å; V425-E463 HydrophobicContact CG2-CB 4.14Å; V425-L464 HydrophobicContact CG2-CD2 4.08Å
426	P	94.7	Very high	94.1	Very high	66 Å²	66	50.5 Å²	50.5	43%	0.429	27%	0.273	S	S	.	.	H	α-helix	trans	-52.4	-50	166.2	-29.3	35	0	0	0	113.4	S423 L428 K429 W430	S423-P426 VanDerWaalsContact O-CD 3.3Å; S423-P426 WeakPolarHBondContact O-CD 3.49Å; P426-L428 PolarHBondContact O-N 3.2Å; P426-K429 PolarHBondContact O-N 2.62Å; P426-K429 VanDerWaalsContact O-N 3.16Å; P426-W430 PolarHBondContact O-N 2.85Å
427	I	96.5	Very high	94.1	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63	-42.2	-177.7	-66.5	166.3	0	0	0	111.4	T389 M393 V415 L419 S423 L424 W430 S431 V440 A444	T389-I427 HydrophobicContact CG2-CD1 3.97Å; T389-I427 HydrophobicContact CG2-CG1 3.99Å; M393-I427 HydrophobicContact CE-CB 4.16Å; M393-I427 HydrophobicContact CE-CG1 3.56Å; V415-I427 HydrophobicContact CG1-CD1 3.98Å; V415-I427 HydrophobicContact CG1-CG1 3.86Å; V415-I427 HydrophobicContact CG1-CG2 3.92Å; L419-I427 HydrophobicContact CD2-CB 4.33Å; L419-I427 HydrophobicContact CD2-CD1 3.67Å; L419-I427 HydrophobicContact CD2-CG2 4.1Å; L419-I427 HydrophobicContact CG-CD1 4.06Å; S423-I427 WeakPolarHBondContact O-CB 3.43Å; S423-I427 VanDerWaalsContact O-CG1 3.24Å; S423-I427 WeakPolarHBondContact O-CG1 3.42Å; S423-I427 PolarHBondContact O-N 2.84Å; L424-I427 PolarHBondContact O-N 3.28Å; I427-W430 PolarHBondContact O-N 3.33Å; I427-S431 WeakPolarHBondContact O-CB 3.33Å; I427-S431 PolarHBondContact O-N 2.84Å; I427-S431 PolarHBondContact O-OG 2.59Å; I427-V440 HydrophobicContact CG2-CG1 3.54Å; I427-A444 HydrophobicContact CG2-CB 4.01Å
428	L	96.6	Very high	94	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-39	174.6	-76.7	170.6	0	0	0	112.6	L424 P426 S432 A444 L445 L448 L464 H468	L424-L428 HydrophobicContact CD1-CD1 3.71Å; L424-L428 HydrophobicContact CD1-CG 3.96Å; L424-L428 HydrophobicContact CG-CD1 3.88Å; L424-L428 HydrophobicContact CG-CG 4.49Å; L424-L428 WeakPolarHBondContact O-CB 3.47Å; L424-L428 VanDerWaalsContact O-CG 3.29Å; L424-L428 WeakPolarHBondContact O-CG 3.42Å; L424-L428 PolarHBondContact O-N 3.24Å; P426-L428 PolarHBondContact O-N 3.2Å; L428-S432 WeakPolarHBondContact O-CB 3.45Å; L428-S432 PolarHBondContact O-N 2.97Å; L428-S432 PolarHBondContact O-OG 3.25Å; L428-A444 HydrophobicContact CD2-CB 3.65Å; L428-A444 HydrophobicContact CG-CB 4.03Å; L428-L445 HydrophobicContact CD2-CD2 3.86Å; L428-L445 HydrophobicContact CD2-CG 4.04Å; L428-L448 HydrophobicContact CD1-CD2 4.14Å; L428-L464 HydrophobicContact CD1-CD2 3.93Å; L428-H468 HydrophobicContact CD1-CB 4.34Å
429	K	95.4	Very high	94.2	Very high	105 Å²	105	48.1 Å²	48.1	46%	0.457	25%	0.253	S	S	.	.	H	α-helix	trans	-68.4	-36.3	177.9	-75.3	167.6	-179.6	165.8	0	112.7	V425 P426 S432 Q433	V425-K429 HydrophobicContact CG1-CD 3.95Å; V425-K429 WeakPolarHBondContact O-CB 3.41Å; V425-K429 VanDerWaalsContact O-CG 3.26Å; V425-K429 WeakPolarHBondContact O-CG 3.46Å; V425-K429 PolarHBondContact O-N 2.8Å; P426-K429 PolarHBondContact O-N 2.62Å; P426-K429 VanDerWaalsContact O-N 3.16Å; K429-S432 PolarHBondContact O-OG 2.95Å; K429-Q433 WeakPolarHBondContact O-CG 3.49Å; K429-Q433 PolarHBondContact O-NE2 3.3Å
430	W	96	Very high	94.3	Very high	15 Å²	15	46.8 Å²	46.8	6%	0.057	25%	0.246	C	C	.	.	H	α-helix	trans	-74.3	-53.7	175.2	168.9	74.5	0	0	0	111.7	M393 Y396 H397 V415 P426 I427 S432 Q433 V440	M393-W430 HydrophobicContact CB-CD2 4.36Å; M393-W430 HydrophobicContact CB-CZ2 4.34Å; M393-W430 HydrophobicContact CE-CB 3.87Å; M393-W430 HydrophobicContact CE-CD2 3.99Å; M393-W430 HydrophobicContact CE-CE3 3.9Å; M393-W430 HydrophobicContact CE-CG 4.01Å; M393-W430 HydrophobicContact CG-CD2 3.68Å; M393-W430 HydrophobicContact CG-CE3 4.06Å; M393-W430 HydrophobicContact CG-CG 4Å; M393-W430 HydrophobicContact CG-CZ2 4.17Å; M393-W430 HydrophobicContact CG-CZ3 4.46Å; M393-W430 HydrophobicContact SD-CB 3.86Å; M393-W430 HydrophobicContact SD-CD2 3.93Å; M393-W430 HydrophobicContact SD-CE3 4.4Å; M393-W430 HydrophobicContact SD-CG 3.67Å; Y396-W430 HydrophobicContact CD1-CH2 4.04Å; Y396-W430 AromaticContact CD1-CZ2 3.5Å; Y396-W430 HydrophobicContact CD1-CZ2 3.5Å; Y396-W430 VanDerWaalsContact CD1-CZ2 3.5Å; Y396-W430 HydrophobicContact CE1-CH2 4.35Å; Y396-W430 HydrophobicContact CE1-CZ2 4.05Å; Y396-W430 HydrophobicContact CG-CH2 4.14Å; Y396-W430 AromaticContact CG-CZ2 3.86Å; Y396-W430 HydrophobicContact CG-CZ2 3.86Å; H397-W430 AromaticContact CE1-CD1 3.92Å; H397-W430 AromaticContact CE1-NE1 3.24Å; H397-W430 PolarHBondContact CE1-NE1 3.35Å; H397-W430 AromaticContact NE2-CD1 3.83Å; H397-W430 AromaticContact NE2-CE2 3.93Å; H397-W430 AromaticContact NE2-NE1 2.95Å; H397-W430 PolarHBondContact NE2-NE1 3.5Å; V415-W430 HydrophobicContact CG1-CZ3 4.18Å; P426-W430 PolarHBondContact O-N 2.85Å; I427-W430 PolarHBondContact O-N 3.33Å; W430-S432 PolarHBondContact O-N 3.11Å; W430-S432 VanDerWaalsContact O-N 3.11Å; W430-Q433 VanDerWaalsContact O-CB 3.28Å; W430-Q433 WeakPolarHBondContact O-CB 3.47Å; W430-Q433 PolarHBondContact O-N 3.24Å; W430-V440 HydrophobicContact CZ3-CB 4.03Å; W430-V440 HydrophobicContact CZ3-CG1 4.01Å; W430-V440 HydrophobicContact CZ3-CG2 4.1Å
431	S	96.7	Very high	94.5	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-67.1	-14.5	-174.8	61.6	0	0	0	0	115	I427 S437 H441	I427-S431 WeakPolarHBondContact O-CB 3.33Å; I427-S431 PolarHBondContact O-N 2.84Å; I427-S431 PolarHBondContact O-OG 2.59Å; S431-S437 WeakPolarHBondContact CB-O 3.21Å; S431-H441 WeakPolarHBondContact OG-CA 3.43Å; S431-H441 PolarHBondContact OG-ND1 2.88Å
432	S	94.8	Very high	94.7	Very high	60 Å²	60	46.6 Å²	46.6	42%	0.42	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-6.2	172	52.6	0	0	0	0	114.2	L428 K429 W430	L428-S432 WeakPolarHBondContact O-CB 3.45Å; L428-S432 PolarHBondContact O-N 2.97Å; L428-S432 PolarHBondContact O-OG 3.25Å; K429-S432 PolarHBondContact O-OG 2.95Å; W430-S432 PolarHBondContact O-N 3.11Å; W430-S432 VanDerWaalsContact O-N 3.11Å
433	Q	92.8	Very high	95	Very high	68 Å²	68	41.1 Å²	41.1	32%	0.318	21%	0.207	S	C	.	.	S	Bend	trans	-73.2	151.6	174.8	-66	165.1	1.9	0	0	110.2	K429 W430 Y435 G436	K429-Q433 WeakPolarHBondContact O-CG 3.49Å; K429-Q433 PolarHBondContact O-NE2 3.3Å; W430-Q433 VanDerWaalsContact O-CB 3.28Å; W430-Q433 WeakPolarHBondContact O-CB 3.47Å; W430-Q433 PolarHBondContact O-N 3.24Å; Q433-Y435 HydrophobicContact CB-CD2 4.29Å; Q433-Y435 HydrophobicContact CB-CE1 4.17Å; Q433-Y435 HydrophobicContact CB-CE2 3.84Å; Q433-Y435 VanDerWaalsContact CD-OH 3.28Å; Q433-Y435 HydrophobicContact CG-CE2 4.46Å; Q433-Y435 PolarHBondContact O-N 3.09Å; Q433-Y435 VanDerWaalsContact O-N 3.09Å; Q433-Y435 VanDerWaalsContact OE1-CZ 3.23Å; Q433-Y435 PolarHBondContact OE1-OH 3.37Å; Q433-G436 PolarHBondContact O-N 2.59Å
434	P	89.8	Confident	95.2	Very high	120 Å²	120	40.2 Å²	40.2	78%	0.779	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-27.9	-175.9	-26.6	35.7	0	0	0	114.8
435	Y	88.9	Confident	95.3	Very high	130 Å²	130	41.8 Å²	41.8	51%	0.51	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	1.4	177.5	52.3	-100.6	0	0	0	113.5	H397 Q433	H397-Y435 AromaticContact CD2-CD2 3.87Å; H397-Y435 AromaticContact NE2-CD2 3.54Å; H397-Y435 AromaticContact NE2-CE2 3.83Å; Q433-Y435 HydrophobicContact CB-CD2 4.29Å; Q433-Y435 HydrophobicContact CB-CE1 4.17Å; Q433-Y435 HydrophobicContact CB-CE2 3.84Å; Q433-Y435 VanDerWaalsContact CD-OH 3.28Å; Q433-Y435 HydrophobicContact CG-CE2 4.46Å; Q433-Y435 PolarHBondContact O-N 3.09Å; Q433-Y435 VanDerWaalsContact O-N 3.09Å; Q433-Y435 VanDerWaalsContact OE1-CZ 3.23Å; Q433-Y435 PolarHBondContact OE1-OH 3.37Å
436	G	93.4	Very high	95.4	Very high	5 Å²	5	43.9 Å²	43.9	5%	0.052	22%	0.218	C	C	.	.	S	Bend	trans	-85.1	160.3	175	0	0	0	0	0	112.2	Q433 K438	Q433-G436 PolarHBondContact O-N 2.59Å; G436-K438 PolarHBondContact O-N 3.28Å; G436-K438 VanDerWaalsContact O-N 3.11Å
437	S	96	Very high	95.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.207	C	C	.	.			trans	-69.7	112.1	-177.7	176.1	0	0	0	0	113	Y396 E412 S431 W439 V440 H441	Y396-S437 WeakPolarHBondContact OH-CA 3.23Å; Y396-S437 WeakPolarHBondContact OH-CB 3.43Å; E412-S437 VanDerWaalsContact OE1-CB 3.28Å; E412-S437 WeakPolarHBondContact OE1-CB 3.25Å; E412-S437 PolarHBondContact OE1-OG 3.46Å; S431-S437 WeakPolarHBondContact CB-O 3.21Å; S437-W439 PolarHBondContact O-N 2.99Å; S437-W439 PolarHBondContact OG-N 2.98Å; S437-W439 VanDerWaalsContact OG-N 3.15Å; S437-V440 PolarHBondContact O-N 3.37Å; S437-V440 PolarHBondContact OG-N 3.35Å; S437-H441 PolarHBondContact O-N 3.17Å
438	K	94.8	Very high	95.5	Very high	142 Å²	142	42.9 Å²	42.9	62%	0.617	21%	0.207	S	C	*	.	H	α-helix	trans	-62.3	-20.5	169.3	-63.4	175.2	-175.3	170.2	0	113.1	G436 R442	G436-K438 PolarHBondContact O-N 3.28Å; G436-K438 VanDerWaalsContact O-N 3.11Å; K438-R442 WeakPolarHBondContact O-CG 3.28Å; K438-R442 PolarHBondContact O-NH1 2.92Å
439	W	96.9	Very high	95.5	Very high	25 Å²	25	43.4 Å²	43.4	10%	0.095	21%	0.211	C	C	.	.	H	α-helix	trans	-77.9	-53.5	173.8	179.7	92.8	0	0	0	110.1	L120 E412 D413 V416 S437 H441 R442 Q443	L120-W439 PolarHBondContact O-NE1 2.94Å; E412-W439 HydrophobicContact CB-CE3 3.81Å; E412-W439 HydrophobicContact CB-CZ3 3.86Å; E412-W439 HydrophobicContact CG-CE3 4.46Å; D413-W439 VanDerWaalsContact OD1-CH2 3.23Å; D413-W439 WeakPolarHBondContact OD1-CH2 3.17Å; V416-W439 HydrophobicContact CB-CH2 4.34Å; V416-W439 HydrophobicContact CB-CZ3 4.1Å; V416-W439 HydrophobicContact CG1-CH2 4.47Å; V416-W439 HydrophobicContact CG2-CE3 4.18Å; V416-W439 HydrophobicContact CG2-CH2 4.05Å; V416-W439 HydrophobicContact CG2-CZ3 3.46Å; V416-W439 VanDerWaalsContact CG2-CZ3 3.46Å; S437-W439 PolarHBondContact O-N 2.99Å; S437-W439 PolarHBondContact OG-N 2.98Å; S437-W439 VanDerWaalsContact OG-N 3.15Å; W439-H441 PolarHBondContact O-N 3.33Å; W439-R442 WeakPolarHBondContact O-CB 3.29Å; W439-R442 PolarHBondContact O-N 2.9Å; W439-Q443 HydrophobicContact CD2-CG 4.23Å; W439-Q443 HydrophobicContact CE3-CG 4.3Å; W439-Q443 HydrophobicContact CH2-CG 4.34Å; W439-Q443 HydrophobicContact CZ2-CG 4.24Å; W439-Q443 HydrophobicContact CZ3-CG 4.37Å; W439-Q443 PolarHBondContact O-N 2.95Å
440	V	98	Very high	95.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-55.6	-37.1	174.9	179.8	0	0	0	0	111.2	E412 V415 V416 I427 W430 S437 R442 Q443 A444	E412-V440 HydrophobicContact CB-CG2 3.75Å; E412-V440 HydrophobicContact CG-CG2 3.93Å; V415-V440 HydrophobicContact CG1-CG1 3.74Å; V416-V440 HydrophobicContact CG2-CB 4.37Å; V416-V440 HydrophobicContact CG2-CG1 4.06Å; V416-V440 HydrophobicContact CG2-CG2 4.1Å; I427-V440 HydrophobicContact CG2-CG1 3.54Å; W430-V440 HydrophobicContact CZ3-CB 4.03Å; W430-V440 HydrophobicContact CZ3-CG1 4.01Å; W430-V440 HydrophobicContact CZ3-CG2 4.1Å; S437-V440 PolarHBondContact O-N 3.37Å; S437-V440 PolarHBondContact OG-N 3.35Å; V440-R442 VanDerWaalsContact C-N 3.32Å; V440-R442 PolarHBondContact O-N 3.34Å; V440-Q443 PolarHBondContact O-N 2.94Å; V440-Q443 VanDerWaalsContact O-N 3.15Å; V440-A444 WeakPolarHBondContact O-CB 3.47Å; V440-A444 PolarHBondContact O-N 2.96Å
441	H	97.4	Very high	95.4	Very high	39 Å²	39	43.5 Å²	43.5	18%	0.181	21%	0.213	C	C	.	.	H	α-helix	trans	-57.6	-42.2	176.6	-162.8	65.3	0	0	0	113	S431 S437 W439 L445 H468	S431-H441 WeakPolarHBondContact OG-CA 3.43Å; S431-H441 PolarHBondContact OG-ND1 2.88Å; S437-H441 PolarHBondContact O-N 3.17Å; W439-H441 PolarHBondContact O-N 3.33Å; H441-L445 WeakPolarHBondContact O-CB 3.23Å; H441-L445 WeakPolarHBondContact O-CG 3.49Å; H441-L445 PolarHBondContact O-N 2.64Å; H441-H468 AromaticContact CE1-NE2 3.93Å
442	R	96.6	Very high	95.3	Very high	44 Å²	44	43.4 Å²	43.4	17%	0.166	21%	0.213	C	C	.	.	H	α-helix	trans	-66.7	-40.9	176.6	-65.8	-174.8	-57.7	-99.2	17.2	111.3	S119 A121 K438 W439 V440 L445 H446	S119-R442 PolarHBondContact O-NE 3.14Å; S119-R442 PolarHBondContact O-NH2 3.5Å; A121-R442 PolarHBondContact O-NH2 3.05Å; K438-R442 WeakPolarHBondContact O-CG 3.28Å; K438-R442 PolarHBondContact O-NH1 2.92Å; W439-R442 WeakPolarHBondContact O-CB 3.29Å; W439-R442 PolarHBondContact O-N 2.9Å; V440-R442 VanDerWaalsContact C-N 3.32Å; V440-R442 PolarHBondContact O-N 3.34Å; R442-L445 PolarHBondContact O-N 2.9Å; R442-H446 WeakPolarHBondContact O-CB 3.42Å; R442-H446 PolarHBondContact O-N 3.37Å
443	Q	97.4	Very high	95.1	Very high	18 Å²	18	43.3 Å²	43.3	8%	0.084	21%	0.212	C	C	.	.	H	α-helix	trans	-67.5	-39.7	179.2	-55	-50	91.5	0	0	111.8	L120 V416 L419 W439 V440 H446 F447	L120-Q443 VanDerWaalsContact CD2-NE2 3.34Å; V416-Q443 HydrophobicContact CG1-CB 4.32Å; V416-Q443 HydrophobicContact CG2-CB 3.8Å; V416-Q443 HydrophobicContact CG2-CG 4.09Å; L419-Q443 HydrophobicContact CD1-CB 4.5Å; W439-Q443 HydrophobicContact CD2-CG 4.23Å; W439-Q443 HydrophobicContact CE3-CG 4.3Å; W439-Q443 HydrophobicContact CH2-CG 4.34Å; W439-Q443 HydrophobicContact CZ2-CG 4.24Å; W439-Q443 HydrophobicContact CZ3-CG 4.37Å; W439-Q443 PolarHBondContact O-N 2.95Å; V440-Q443 PolarHBondContact O-N 2.94Å; V440-Q443 VanDerWaalsContact O-N 3.15Å; Q443-H446 PolarHBondContact O-N 3.2Å; Q443-F447 WeakPolarHBondContact O-CB 3.25Å; Q443-F447 PolarHBondContact O-N 3.2Å
444	A	97.6	Very high	95.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.8	-38.5	174.3	0	0	0	0	0	112.7	L419 L424 I427 L428 V440 F447 L448	L419-A444 HydrophobicContact CD2-CB 4.04Å; L424-A444 HydrophobicContact CD1-CB 4.25Å; L424-A444 WeakPolarHBondContact CD1-O 3.48Å; I427-A444 HydrophobicContact CG2-CB 4.01Å; L428-A444 HydrophobicContact CD2-CB 3.65Å; L428-A444 HydrophobicContact CG-CB 4.03Å; V440-A444 WeakPolarHBondContact O-CB 3.47Å; V440-A444 PolarHBondContact O-N 2.96Å; A444-F447 PolarHBondContact O-N 3.02Å; A444-L448 WeakPolarHBondContact O-CB 3.35Å; A444-L448 PolarHBondContact O-N 3.14Å
445	L	96.6	Very high	95.3	Very high	32 Å²	32	38.7 Å²	38.7	17%	0.168	18%	0.18	C	C	.	.	H	α-helix	trans	-67.8	-35.2	171.8	-75.5	179.2	0	0	0	112.6	L428 H441 R442 L448 C449	L428-L445 HydrophobicContact CD2-CD2 3.86Å; L428-L445 HydrophobicContact CD2-CG 4.04Å; H441-L445 WeakPolarHBondContact O-CB 3.23Å; H441-L445 WeakPolarHBondContact O-CG 3.49Å; H441-L445 PolarHBondContact O-N 2.64Å; R442-L445 PolarHBondContact O-N 2.9Å; L445-L448 HydrophobicContact CD2-CD2 4.19Å; L445-L448 PolarHBondContact O-N 2.74Å; L445-C449 PolarHBondContact O-N 3.34Å; L445-C449 PolarHBondContact O-SG 3.15Å
446	H	95.9	Very high	95.4	Very high	49 Å²	49	32.9 Å²	32.9	23%	0.227	16%	0.158	C	C	.	.	H	α-helix	trans	-64.6	-47.9	173.2	-175.3	-92.2	0	0	0	110.9	F116 R442 Q443 L448 C449 E450	F116-H446 AromaticContact CD2-CD2 3.78Å; F116-H446 AromaticContact CD2-CE1 3.82Å; F116-H446 AromaticContact CD2-NE2 3.56Å; F116-H446 AromaticContact CE2-CE1 3.75Å; F116-H446 AromaticContact CE2-ND1 3.95Å; F116-H446 AromaticContact CE2-NE2 3.99Å; R442-H446 WeakPolarHBondContact O-CB 3.42Å; R442-H446 PolarHBondContact O-N 3.37Å; Q443-H446 PolarHBondContact O-N 3.2Å; H446-L448 VanDerWaalsContact C-N 3.33Å; H446-L448 PolarHBondContact O-N 2.67Å; H446-C449 WeakPolarHBondContact O-CB 3.34Å; H446-C449 PolarHBondContact O-N 2.85Å; H446-E450 PolarHBondContact O-N 3.38Å
447	F	96.8	Very high	95.2	Very high	46 Å²	46	37.2 Å²	37.2	20%	0.202	18%	0.183	C	C	.	.	H	α-helix	trans	-56.3	-45.2	173.2	-178.1	-86.8	0	0	0	111.9	L419 L421 L424 Q443 A444 C449 E450 E451	L419-F447 HydrophobicContact CB-CD2 4.34Å; L419-F447 HydrophobicContact CD1-CB 4.46Å; L421-F447 HydrophobicContact CD2-CE1 4.32Å; L424-F447 HydrophobicContact CD1-CD1 3.87Å; L424-F447 HydrophobicContact CD2-CD1 4Å; L424-F447 HydrophobicContact CD2-CE1 4.14Å; L424-F447 HydrophobicContact CG-CD1 4.39Å; Q443-F447 WeakPolarHBondContact O-CB 3.25Å; Q443-F447 PolarHBondContact O-N 3.2Å; A444-F447 PolarHBondContact O-N 3.02Å; F447-C449 VanDerWaalsContact C-N 3.26Å; F447-C449 PolarHBondContact O-N 2.84Å; F447-E450 PolarHBondContact O-N 3.29Å; F447-E451 HydrophobicContact CD2-CG 4.38Å; F447-E451 HydrophobicContact CE1-CB 4.29Å; F447-E451 HydrophobicContact CE1-CG 4.48Å; F447-E451 HydrophobicContact CE2-CG 4.04Å; F447-E451 HydrophobicContact CZ-CB 4.35Å; F447-E451 HydrophobicContact CZ-CG 4.1Å; F447-E451 PolarHBondContact O-N 3.25Å
448	L	96.9	Very high	95	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.8	-32.4	174.3	174.5	61.6	0	0	0	112.9	L424 L428 A444 L445 H446 F452 V455 L464 H468 A472	L424-L448 HydrophobicContact CD1-CB 4.46Å; L424-L448 HydrophobicContact CD2-CB 4.29Å; L424-L448 HydrophobicContact CD2-CD1 4.13Å; L428-L448 HydrophobicContact CD1-CD2 4.14Å; A444-L448 WeakPolarHBondContact O-CB 3.35Å; A444-L448 PolarHBondContact O-N 3.14Å; L445-L448 HydrophobicContact CD2-CD2 4.19Å; L445-L448 PolarHBondContact O-N 2.74Å; H446-L448 VanDerWaalsContact C-N 3.33Å; H446-L448 PolarHBondContact O-N 2.67Å; L448-F452 HydrophobicContact CD1-CD2 4.15Å; L448-F452 WeakPolarHBondContact O-CA 3.08Å; L448-F452 VanDerWaalsContact O-CB 3.27Å; L448-F452 WeakPolarHBondContact O-CB 2.97Å; L448-F452 PolarHBondContact O-N 3.08Å; L448-V455 HydrophobicContact CD1-CG1 4.1Å; L448-V455 HydrophobicContact CD1-CG2 4.27Å; L448-L464 HydrophobicContact CD1-CD1 3.81Å; L448-L464 HydrophobicContact CD1-CD2 4.27Å; L448-L464 HydrophobicContact CD2-CD2 4.26Å; L448-H468 HydrophobicContact CD2-CB 4.41Å; L448-A472 HydrophobicContact CD2-CB 4.03Å; L448-A472 HydrophobicContact CG-CB 4.17Å
449	C	96.6	Very high	94.8	Very high	11 Å²	11	37.9 Å²	37.9	7%	0.074	20%	0.197	C	C	.	.	H	α-helix	trans	-76.7	-40.1	178	-69.5	0	0	0	0	113	L445 H446 F447 L478 Q479	L445-C449 PolarHBondContact O-N 3.34Å; L445-C449 PolarHBondContact O-SG 3.15Å; H446-C449 WeakPolarHBondContact O-CB 3.34Å; H446-C449 PolarHBondContact O-N 2.85Å; F447-C449 VanDerWaalsContact C-N 3.26Å; F447-C449 PolarHBondContact O-N 2.84Å; C449-L478 HydrophobicContact CB-CD1 4.39Å; C449-Q479 PolarHBondContact O-N 2.91Å
450	E	94.6	Very high	94.5	Very high	57 Å²	57	37.4 Å²	37.4	27%	0.266	20%	0.196	S	C	.	.	H	α-helix	trans	-75.7	-50.1	-179.7	-62.5	-65.4	85.9	0	0	111.5	K112 H446 F447 F452 Q479	K112-E450 IonicContact NZ-OE1 3.82Å; K112-E450 PolarHBondContact NZ-OE1 3.06Å; K112-E450 IonicContact NZ-OE2 2.83Å; K112-E450 PolarHBondContact NZ-OE2 3.15Å; H446-E450 PolarHBondContact O-N 3.38Å; F447-E450 PolarHBondContact O-N 3.29Å; E450-F452 PolarHBondContact O-N 3.41Å; E450-Q479 WeakPolarHBondContact O-CB 3.38Å
451	E	94.8	Very high	94.3	Very high	65 Å²	65	37.4 Å²	37.4	30%	0.304	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.2	12.7	-177.4	-62.6	-59.1	167.3	0	0	113.5	F447 S453 Q454 V455	F447-E451 HydrophobicContact CD2-CG 4.38Å; F447-E451 HydrophobicContact CE1-CB 4.29Å; F447-E451 HydrophobicContact CE1-CG 4.48Å; F447-E451 HydrophobicContact CE2-CG 4.04Å; F447-E451 HydrophobicContact CZ-CB 4.35Å; F447-E451 HydrophobicContact CZ-CG 4.1Å; F447-E451 PolarHBondContact O-N 3.25Å; E451-S453 PolarHBondContact O-N 3.36Å; E451-Q454 WeakPolarHBondContact O-CB 3.38Å; E451-Q454 PolarHBondContact O-N 3.01Å; E451-Q454 PolarHBondContact OE2-NE2 3.45Å; E451-V455 PolarHBondContact O-N 2.84Å
452	F	95.1	Very high	94.1	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-51.2	-35.9	178.5	-164.6	-108.6	0	0	0	112.5	L448 E450 Q454 V455 V456 L469 L478 A480 I485	L448-F452 HydrophobicContact CD1-CD2 4.15Å; L448-F452 WeakPolarHBondContact O-CA 3.08Å; L448-F452 VanDerWaalsContact O-CB 3.27Å; L448-F452 WeakPolarHBondContact O-CB 2.97Å; L448-F452 PolarHBondContact O-N 3.08Å; E450-F452 PolarHBondContact O-N 3.41Å; F452-Q454 VanDerWaalsContact C-N 3.26Å; F452-Q454 PolarHBondContact O-N 3.39Å; F452-V455 PolarHBondContact O-N 2.93Å; F452-V456 HydrophobicContact CD1-CG1 3.76Å; F452-V456 HydrophobicContact CD2-CG1 4.39Å; F452-V456 HydrophobicContact CE1-CG1 3.4Å; F452-V456 HydrophobicContact CE2-CG1 4.07Å; F452-V456 HydrophobicContact CG-CG1 4.26Å; F452-V456 HydrophobicContact CZ-CG1 3.57Å; F452-V456 WeakPolarHBondContact O-CG1 3.38Å; F452-V456 WeakPolarHBondContact O-CG2 3.43Å; F452-V456 PolarHBondContact O-N 2.83Å; F452-L469 HydrophobicContact CE2-CD1 4.1Å; F452-L469 HydrophobicContact CZ-CD1 4.27Å; F452-L478 HydrophobicContact CB-CD1 3.66Å; F452-L478 HydrophobicContact CD1-CD1 3.88Å; F452-L478 HydrophobicContact CD1-CD2 4.41Å; F452-L478 HydrophobicContact CD1-CG 4.21Å; F452-L478 HydrophobicContact CD2-CD1 3.7Å; F452-L478 HydrophobicContact CE1-CD1 4.42Å; F452-L478 HydrophobicContact CE1-CD2 4.29Å; F452-L478 HydrophobicContact CE2-CD1 4.28Å; F452-L478 HydrophobicContact CG-CD1 3.47Å; F452-L478 VanDerWaalsContact CG-CD1 3.47Å; F452-L478 HydrophobicContact CG-CG 4.29Å; F452-A480 HydrophobicContact CD1-CB 3.76Å; F452-A480 HydrophobicContact CE1-CB 4.15Å; F452-I485 HydrophobicContact CE1-CG1 4.42Å
453	S	91.3	Very high	93.8	Very high	57 Å²	57	42.1 Å²	42.1	40%	0.399	22%	0.218	S	C	.	.	H	α-helix	trans	-63.5	-28	178.7	77.4	0	0	0	0	114.1	E451	E451-S453 PolarHBondContact O-N 3.36Å
454	Q	91.9	Very high	93.6	Very high	91 Å²	91	41.4 Å²	41.4	43%	0.425	22%	0.215	S	C	.	.	H	α-helix	trans	-84.6	-44.6	171.7	-56.1	-160	54.9	0	0	110.9	L421 E451 F452 V456 T457 S458	L421-Q454 HydrophobicContact CD1-CB 4.02Å; L421-Q454 HydrophobicContact CD2-CB 4.09Å; E451-Q454 WeakPolarHBondContact O-CB 3.38Å; E451-Q454 PolarHBondContact O-N 3.01Å; E451-Q454 PolarHBondContact OE2-NE2 3.45Å; F452-Q454 VanDerWaalsContact C-N 3.26Å; F452-Q454 PolarHBondContact O-N 3.39Å; Q454-V456 VanDerWaalsContact C-N 3.31Å; Q454-V456 PolarHBondContact O-N 3.11Å; Q454-T457 CarbonylContact O-C 3.6Å; Q454-T457 WeakPolarHBondContact O-CA 3.43Å; Q454-T457 PolarHBondContact O-N 3.33Å; Q454-T457 PolarHBondContact O-OG1 2.96Å; Q454-S458 PolarHBondContact O-N 3.09Å
455	V	93.5	Very high	93.4	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-53.9	-45.2	178.4	173.4	0	0	0	0	111.6	L421 L424 L448 E451 F452 T457 S458 V460 L464	L421-V455 HydrophobicContact CD2-CG2 3.72Å; L424-V455 HydrophobicContact CD2-CG2 4.04Å; L448-V455 HydrophobicContact CD1-CG1 4.1Å; L448-V455 HydrophobicContact CD1-CG2 4.27Å; E451-V455 PolarHBondContact O-N 2.84Å; F452-V455 PolarHBondContact O-N 2.93Å; V455-T457 PolarHBondContact O-N 3.42Å; V455-S458 PolarHBondContact O-N 2.67Å; V455-S458 VanDerWaalsContact O-N 3.11Å; V455-S458 VanDerWaalsContact O-O 3.1Å; V455-V460 HydrophobicContact CG1-CG1 4.26Å; V455-L464 HydrophobicContact CG1-CD1 3.87Å
456	V	91.4	Very high	93.2	Very high	8 Å²	8	45.1 Å²	45.1	5%	0.048	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-6.7	178	-59.8	0	0	0	0	115	F452 Q454 L461 Y488	F452-V456 HydrophobicContact CD1-CG1 3.76Å; F452-V456 HydrophobicContact CD2-CG1 4.39Å; F452-V456 HydrophobicContact CE1-CG1 3.4Å; F452-V456 HydrophobicContact CE2-CG1 4.07Å; F452-V456 HydrophobicContact CG-CG1 4.26Å; F452-V456 HydrophobicContact CZ-CG1 3.57Å; F452-V456 WeakPolarHBondContact O-CG1 3.38Å; F452-V456 WeakPolarHBondContact O-CG2 3.43Å; F452-V456 PolarHBondContact O-N 2.83Å; Q454-V456 VanDerWaalsContact C-N 3.31Å; Q454-V456 PolarHBondContact O-N 3.11Å; V456-L461 HydrophobicContact CB-CD2 4.45Å; V456-L461 HydrophobicContact CG1-CD1 4.32Å; V456-Y488 HydrophobicContact CB-CD1 3.74Å; V456-Y488 HydrophobicContact CB-CD2 3.67Å; V456-Y488 HydrophobicContact CB-CE1 3.97Å; V456-Y488 HydrophobicContact CB-CE2 3.96Å; V456-Y488 HydrophobicContact CB-CG 3.59Å; V456-Y488 HydrophobicContact CG1-CD1 4.42Å; V456-Y488 HydrophobicContact CG1-CD2 4Å; V456-Y488 HydrophobicContact CG1-CG 3.88Å; V456-Y488 HydrophobicContact CG2-CD1 4.39Å; V456-Y488 HydrophobicContact CG2-CD2 3.69Å; V456-Y488 HydrophobicContact CG2-CE1 4.24Å; V456-Y488 HydrophobicContact CG2-CE2 3.57Å; V456-Y488 HydrophobicContact CG2-CG 4.15Å; V456-Y488 WeakPolarHBondContact O-CD1 3.45Å; V456-Y488 WeakPolarHBondContact O-CE1 3.18Å
457	T	89.4	Confident	93.2	Very high	96 Å²	96	47.5 Å²	47.5	59%	0.589	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-7.1	171.2	55.6	0	0	0	0	113.6	Q454 V455	Q454-T457 CarbonylContact O-C 3.6Å; Q454-T457 WeakPolarHBondContact O-CA 3.43Å; Q454-T457 PolarHBondContact O-N 3.33Å; Q454-T457 PolarHBondContact O-OG1 2.96Å; V455-T457 PolarHBondContact O-N 3.42Å
458	S	91.3	Very high	93.1	Very high	37 Å²	37	46.4 Å²	46.4	26%	0.259	25%	0.246	S	C	.	.	S	Bend	trans	-103.5	160.1	174.9	-175.5	0	0	0	0	111	Q454 V455 V460 L461	Q454-S458 PolarHBondContact O-N 3.09Å; V455-S458 PolarHBondContact O-N 2.67Å; V455-S458 VanDerWaalsContact O-N 3.11Å; V455-S458 VanDerWaalsContact O-O 3.1Å; S458-V460 PolarHBondContact O-N 3.39Å; S458-V460 WeakPolarHBondContact OG-CG2 3.21Å; S458-V460 PolarHBondContact OG-N 3.22Å; S458-L461 PolarHBondContact O-N 2.66Å
459	D	90.1	Very high	93	Very high	119 Å²	119	46.4 Å²	46.4	64%	0.636	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-16.4	173.4	-65.6	-52.4	0	0	0	112.5	L461 Y462	D459-L461 PolarHBondContact O-N 3.25Å; D459-Y462 HydrophobicContact CB-CD2 4.19Å; D459-Y462 WeakPolarHBondContact O-CB 3.35Å; D459-Y462 WeakPolarHBondContact O-CD2 3.46Å; D459-Y462 PolarHBondContact O-N 3.11Å; D459-Y462 WeakPolarHBondContact OD1-CE2 3.2Å
460	V	92.1	Very high	93	Very high	15 Å²	15	46.9 Å²	46.9	9%	0.091	25%	0.248	C	C	.	.	H	α-helix	trans	-47.6	-34	169.7	174.4	0	0	0	0	112.4	L421 V425 V455 S458 Y462 E463 L464	L421-V460 WeakPolarHBondContact O-CG2 3.47Å; V425-V460 HydrophobicContact CG2-CG1 3.81Å; V455-V460 HydrophobicContact CG1-CG1 4.26Å; S458-V460 PolarHBondContact O-N 3.39Å; S458-V460 WeakPolarHBondContact OG-CG2 3.21Å; S458-V460 PolarHBondContact OG-N 3.22Å; V460-Y462 PolarHBondContact O-N 3.15Å; V460-E463 PolarHBondContact O-N 3.37Å; V460-E463 VanDerWaalsContact O-N 3.15Å; V460-L464 PolarHBondContact O-N 3.45Å
461	L	93.6	Very high	93	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-49.9	-45.4	173	173.7	61.2	0	0	0	111.9	V456 S458 D459 E463 L464 Y488	V456-L461 HydrophobicContact CB-CD2 4.45Å; V456-L461 HydrophobicContact CG1-CD1 4.32Å; S458-L461 PolarHBondContact O-N 2.66Å; D459-L461 PolarHBondContact O-N 3.25Å; L461-E463 VanDerWaalsContact C-N 3.31Å; L461-E463 PolarHBondContact O-N 3.3Å; L461-L464 WeakPolarHBondContact O-CB 3.45Å; L461-L464 PolarHBondContact O-N 2.84Å; L461-Y488 HydrophobicContact CD2-CD1 4Å; L461-Y488 HydrophobicContact CD2-CG 4.48Å
462	Y	92	Very high	93	Very high	63 Å²	63	43 Å²	43	25%	0.247	24%	0.235	C	C	.	.	H	α-helix	trans	-77.8	-16.4	-173.6	-48.7	-60.3	0	0	0	113.3	D459 V460 Q495 Q496	D459-Y462 HydrophobicContact CB-CD2 4.19Å; D459-Y462 WeakPolarHBondContact O-CB 3.35Å; D459-Y462 WeakPolarHBondContact O-CD2 3.46Å; D459-Y462 PolarHBondContact O-N 3.11Å; D459-Y462 WeakPolarHBondContact OD1-CE2 3.2Å; V460-Y462 PolarHBondContact O-N 3.15Å; Y462-Q495 HydrophobicContact CD1-CB 3.6Å; Y462-Q495 HydrophobicContact CD1-CG 3.69Å; Y462-Q495 HydrophobicContact CE1-CB 4.09Å; Y462-Q495 HydrophobicContact CE1-CG 4.39Å; Y462-Q495 HydrophobicContact CG-CB 4.22Å; Y462-Q495 HydrophobicContact CG-CG 3.78Å; Y462-Q496 PolarHBondContact O-NE2 2.89Å
463	E	91.9	Very high	93	Very high	118 Å²	118	43 Å²	43	55%	0.551	24%	0.235	S	C	*	.	H	α-helix	trans	-87.2	-15.3	174.1	-60.1	-163.8	-167.4	0	0	113.8	V425 V460 L461 G465	V425-E463 HydrophobicContact CG1-CB 4.02Å; V425-E463 HydrophobicContact CG2-CB 4.14Å; V460-E463 PolarHBondContact O-N 3.37Å; V460-E463 VanDerWaalsContact O-N 3.15Å; L461-E463 VanDerWaalsContact C-N 3.31Å; L461-E463 PolarHBondContact O-N 3.3Å; E463-G465 PolarHBondContact O-N 3.39Å
464	L	93.4	Very high	93.1	Very high	3 Å²	3	43.1 Å²	43.1	2%	0.016	23%	0.229	C	C	.	.	S	Bend	trans	-62.7	125.1	176.4	-73.1	172	0	0	0	111.2	V425 L428 L448 V455 V460 L461 W492	V425-L464 HydrophobicContact CG2-CD2 4.08Å; L428-L464 HydrophobicContact CD1-CD2 3.93Å; L448-L464 HydrophobicContact CD1-CD1 3.81Å; L448-L464 HydrophobicContact CD1-CD2 4.27Å; L448-L464 HydrophobicContact CD2-CD2 4.26Å; V455-L464 HydrophobicContact CG1-CD1 3.87Å; V460-L464 PolarHBondContact O-N 3.45Å; L461-L464 WeakPolarHBondContact O-CB 3.45Å; L461-L464 PolarHBondContact O-N 2.84Å; L464-W492 PolarHBondContact O-NE1 2.83Å
465	G	91.9	Very high	93.2	Very high	34 Å²	34	40 Å²	40	35%	0.351	22%	0.216	S	C	.	.			trans	-64.6	148.2	169.6	0	0	0	0	0	112.3	E463 E467 H468 L469	E463-G465 PolarHBondContact O-N 3.39Å; G465-E467 VanDerWaalsContact C-N 3.27Å; G465-E467 PolarHBondContact O-N 3.45Å; G465-H468 PolarHBondContact O-N 3.02Å; G465-H468 VanDerWaalsContact O-N 3.11Å; G465-L469 PolarHBondContact O-N 2.82Å
466	K	93.8	Very high	93.1	Very high	76 Å²	76	41.3 Å²	41.3	33%	0.33	22%	0.224	S	C	.	.	H	α-helix	trans	-48.8	-45.3	-176.9	-169.5	-159.4	118.2	-142.4	0	113	H468 L469 L470 W492 P537 L538	K466-H468 PolarHBondContact O-N 3.47Å; K466-L469 PolarHBondContact O-N 2.81Å; K466-L470 VanDerWaalsContact O-CB 3.23Å; K466-L470 WeakPolarHBondContact O-CB 3.31Å; K466-L470 PolarHBondContact O-N 3.05Å; K466-W492 HydrophobicContact CB-CH2 3.83Å; K466-W492 HydrophobicContact CB-CZ2 4.2Å; K466-W492 HydrophobicContact CG-CH2 3.91Å; K466-P537 HydrophobicContact CD-CG 3.92Å; K466-L538 HydrophobicContact CG-CD2 4.49Å
467	E	94.3	Very high	93.3	Very high	99 Å²	99	42.4 Å²	42.4	46%	0.463	23%	0.227	S	C	.	.	H	α-helix	trans	-70.8	-31.2	-174.9	-48.2	-44.2	128.3	0	0	113	G465 S471	G465-E467 VanDerWaalsContact C-N 3.27Å; G465-E467 PolarHBondContact O-N 3.45Å; E467-S471 WeakPolarHBondContact O-CB 3.39Å; E467-S471 PolarHBondContact O-N 2.66Å; E467-S471 PolarHBondContact O-OG 3.42Å
468	H	95.1	Very high	93.6	Very high	23 Å²	23	37.8 Å²	37.8	11%	0.106	20%	0.199	C	C	.	.	H	α-helix	trans	-70.7	-44.8	174.6	-53.9	148.4	0	0	0	110.8	L428 H441 L448 G465 K466 S471 A472	L428-H468 HydrophobicContact CD1-CB 4.34Å; H441-H468 AromaticContact CE1-NE2 3.93Å; L448-H468 HydrophobicContact CD2-CB 4.41Å; G465-H468 PolarHBondContact O-N 3.02Å; G465-H468 VanDerWaalsContact O-N 3.11Å; K466-H468 PolarHBondContact O-N 3.47Å; H468-S471 PolarHBondContact O-N 2.94Å; H468-A472 PolarHBondContact O-N 2.73Å
469	L	95.6	Very high	93.8	Very high	1 Å²	1	37 Å²	37	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-63.9	-41.9	175.5	-178	59.2	0	0	0	111.5	F452 G465 K466 A472 I473 W492 L538	F452-L469 HydrophobicContact CE2-CD1 4.1Å; F452-L469 HydrophobicContact CZ-CD1 4.27Å; G465-L469 PolarHBondContact O-N 2.82Å; K466-L469 PolarHBondContact O-N 2.81Å; L469-A472 PolarHBondContact O-N 3.22Å; L469-I473 HydrophobicContact CD1-CD1 3.79Å; L469-I473 HydrophobicContact CD1-CG1 4.3Å; L469-I473 HydrophobicContact CG-CD1 3.73Å; L469-I473 WeakPolarHBondContact O-CD1 3.4Å; L469-I473 VanDerWaalsContact O-CG1 3.22Å; L469-I473 WeakPolarHBondContact O-CG1 3.38Å; L469-I473 PolarHBondContact O-N 2.9Å; L469-W492 HydrophobicContact CD2-CB 4.15Å; L469-W492 HydrophobicContact CD2-CD2 3.44Å; L469-W492 VanDerWaalsContact CD2-CD2 3.44Å; L469-W492 HydrophobicContact CD2-CE3 3.86Å; L469-W492 HydrophobicContact CD2-CG 3.57Å; L469-W492 HydrophobicContact CD2-CZ2 4.38Å; L469-L538 HydrophobicContact CD2-CD1 3.9Å; L469-L538 HydrophobicContact CG-CD1 4.4Å
470	L	95.6	Very high	94	Very high	20 Å²	20	31.7 Å²	31.7	11%	0.105	16%	0.164	C	C	.	.	H	α-helix	trans	-58.7	-46	172.8	176.1	57.6	0	0	0	111.6	K466 A472 I473 Q474 P537 L538 F541	K466-L470 VanDerWaalsContact O-CB 3.23Å; K466-L470 WeakPolarHBondContact O-CB 3.31Å; K466-L470 PolarHBondContact O-N 3.05Å; L470-A472 PolarHBondContact O-N 3.06Å; L470-I473 PolarHBondContact O-N 3.01Å; L470-Q474 HydrophobicContact CD1-CG 4.21Å; L470-Q474 WeakPolarHBondContact O-CB 3.12Å; L470-Q474 WeakPolarHBondContact O-CG 3.32Å; L470-Q474 PolarHBondContact O-N 2.88Å; L470-P537 WeakPolarHBondContact CD1-O 3.48Å; L470-L538 HydrophobicContact CB-CD2 3.72Å; L470-L538 HydrophobicContact CD1-CD2 4.09Å; L470-L538 HydrophobicContact CG-CD2 4.46Å; L470-F541 HydrophobicContact CD1-CD2 3.53Å; L470-F541 HydrophobicContact CD1-CE2 3.55Å; L470-F541 HydrophobicContact CD1-CG 4.37Å; L470-F541 HydrophobicContact CD1-CZ 4.39Å
471	S	94.8	Very high	94.1	Very high	42 Å²	42	31 Å²	31	29%	0.294	16%	0.16	S	C	.	.	H	α-helix	trans	-63.7	-40.2	179	-59.9	0	0	0	0	112	E467 H468 Q474 S475	E467-S471 WeakPolarHBondContact O-CB 3.39Å; E467-S471 PolarHBondContact O-N 2.66Å; E467-S471 PolarHBondContact O-OG 3.42Å; H468-S471 PolarHBondContact O-N 2.94Å; S471-Q474 PolarHBondContact O-N 2.94Å; S471-S475 PolarHBondContact O-N 2.87Å
472	A	95.2	Very high	94	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63	-43.3	173.4	0	0	0	0	0	112.2	L448 H468 L469 L470 Q474 S475 L478	L448-A472 HydrophobicContact CD2-CB 4.03Å; L448-A472 HydrophobicContact CG-CB 4.17Å; H468-A472 PolarHBondContact O-N 2.73Å; L469-A472 PolarHBondContact O-N 3.22Å; L470-A472 PolarHBondContact O-N 3.06Å; A472-Q474 VanDerWaalsContact C-N 3.32Å; A472-Q474 PolarHBondContact O-N 3.24Å; A472-S475 WeakPolarHBondContact O-CB 3.47Å; A472-S475 PolarHBondContact O-N 2.76Å; A472-S475 VanDerWaalsContact O-N 3.12Å; A472-L478 HydrophobicContact CB-CD1 4.19Å
473	I	94.6	Very high	94	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-76.1	-18.8	179.6	-57.4	157.2	0	0	0	112.2	L469 L470 S475 I485 V489 L538 F541 I542 R596	L469-I473 HydrophobicContact CD1-CD1 3.79Å; L469-I473 HydrophobicContact CD1-CG1 4.3Å; L469-I473 HydrophobicContact CG-CD1 3.73Å; L469-I473 WeakPolarHBondContact O-CD1 3.4Å; L469-I473 VanDerWaalsContact O-CG1 3.22Å; L469-I473 WeakPolarHBondContact O-CG1 3.38Å; L469-I473 PolarHBondContact O-N 2.9Å; L470-I473 PolarHBondContact O-N 3.01Å; I473-S475 VanDerWaalsContact C-N 3.3Å; I473-I485 HydrophobicContact CG1-CG2 4.21Å; I473-I485 HydrophobicContact CG2-CG2 4.13Å; I473-V489 HydrophobicContact CD1-CG2 3.36Å; I473-V489 HydrophobicContact CG1-CG2 4.38Å; I473-L538 HydrophobicContact CD1-CD2 4.44Å; I473-F541 HydrophobicContact CG2-CB 3.82Å; I473-I542 HydrophobicContact CG2-CG1 4.23Å; I473-R596 PolarHBondContact O-NH1 3.15Å
474	Q	93.9	Very high	94.1	Very high	59 Å²	59	25.3 Å²	25.3	28%	0.276	14%	0.136	S	C	.	.	H	α-helix	trans	-73	-23.3	167.2	-77.7	176.5	1.2	0	0	112.4	L470 S471 A472 F541	L470-Q474 HydrophobicContact CD1-CG 4.21Å; L470-Q474 WeakPolarHBondContact O-CB 3.12Å; L470-Q474 WeakPolarHBondContact O-CG 3.32Å; L470-Q474 PolarHBondContact O-N 2.88Å; S471-Q474 PolarHBondContact O-N 2.94Å; A472-Q474 VanDerWaalsContact C-N 3.32Å; A472-Q474 PolarHBondContact O-N 3.24Å; Q474-F541 HydrophobicContact CG-CD1 3.62Å; Q474-F541 HydrophobicContact CG-CD2 4.47Å; Q474-F541 HydrophobicContact CG-CE1 3.8Å; Q474-F541 HydrophobicContact CG-CG 3.99Å; Q474-F541 HydrophobicContact CG-CZ 4.31Å; Q474-F541 VanDerWaalsContact NE2-CZ 3.29Å
475	S	93.7	Very high	94.2	Very high	24 Å²	24	25.2 Å²	25.2	17%	0.168	14%	0.135	C	C	.	.			trans	-67.9	137.6	-179.6	-169.9	0	0	0	0	113.1	S471 A472 I473 Y477 R596	S471-S475 PolarHBondContact O-N 2.87Å; A472-S475 WeakPolarHBondContact O-CB 3.47Å; A472-S475 PolarHBondContact O-N 2.76Å; A472-S475 VanDerWaalsContact O-N 3.12Å; I473-S475 VanDerWaalsContact C-N 3.3Å; S475-Y477 PolarHBondContact OG-N 3.41Å; S475-Y477 VanDerWaalsContact OG-N 3.08Å; S475-R596 PolarHBondContact O-NH1 3.27Å
476	D	92.3	Very high	94.3	Very high	29 Å²	29	23.6 Å²	23.6	16%	0.155	12%	0.119	C	C	.	.	S	Bend	trans	-74.8	-15.8	165.8	-82.3	-43.5	0	0	0	112.8	T108 R543 R594 R596 L597	T108-D476 HydrophobicContact CG2-CB 4.49Å; D476-R543 IonicContact OD1-CZ 2.68Å; D476-R543 IonicContact OD1-NH1 3.89Å; D476-R543 PolarHBondContact OD1-NH1 3.2Å; D476-R543 IonicContact OD1-NH2 2.98Å; D476-R543 PolarHBondContact OD1-NH2 2.96Å; D476-R594 IonicContact OD1-NE 2.82Å; D476-R594 IonicContact OD2-CZ 3.69Å; D476-R594 VanDerWaalsContact OD2-CZ 3.3Å; D476-R594 IonicContact OD2-NE 3.34Å; D476-R594 PolarHBondContact OD2-NE 2.88Å; D476-R594 VanDerWaalsContact OD2-NE 3.14Å; D476-R594 IonicContact OD2-NH2 3.69Å; D476-R594 PolarHBondContact OD2-NH2 2.66Å; D476-R596 WeakPolarHBondContact O-CA 3.34Å; D476-L597 PolarHBondContact O-N 3.33Å
477	Y	94.4	Very high	94.3	Very high	30 Å²	30	23.2 Å²	23.2	12%	0.118	12%	0.117	C	C	.	.			trans	-100.5	-0.6	-169.2	-45.5	-46.3	0	0	0	113.7	T108 L111 K112 S115 S475 Q479 L597	T108-Y477 HydrophobicContact CG2-CD1 4.5Å; T108-Y477 HydrophobicContact CG2-CE1 4.15Å; L111-Y477 WeakPolarHBondContact CG-OH 3.48Å; K112-Y477 HydrophobicContact CB-CD1 3.59Å; K112-Y477 HydrophobicContact CB-CE1 3.57Å; K112-Y477 HydrophobicContact CB-CG 4.11Å; K112-Y477 HydrophobicContact CD-CD1 4.14Å; K112-Y477 HydrophobicContact CD-CG 4.11Å; K112-Y477 HydrophobicContact CG-CD1 3.84Å; K112-Y477 HydrophobicContact CG-CD2 4.23Å; K112-Y477 HydrophobicContact CG-CE1 4.23Å; K112-Y477 HydrophobicContact CG-CG 3.84Å; S115-Y477 WeakPolarHBondContact OG-CE2 3.43Å; S475-Y477 PolarHBondContact OG-N 3.41Å; S475-Y477 VanDerWaalsContact OG-N 3.08Å; Y477-Q479 PolarHBondContact O-N 3.38Å; Y477-Q479 PolarHBondContact O-NE2 3.49Å; Y477-L597 HydrophobicContact CD1-CD2 4.43Å
478	L	95.9	Very high	94.3	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.099	C	C	.	.			trans	-58.6	122.5	-179.3	-174.2	64.1	0	0	0	112.1	C449 F452 A472 A480 I485	C449-L478 HydrophobicContact CB-CD1 4.39Å; F452-L478 HydrophobicContact CB-CD1 3.66Å; F452-L478 HydrophobicContact CD1-CD1 3.88Å; F452-L478 HydrophobicContact CD1-CD2 4.41Å; F452-L478 HydrophobicContact CD1-CG 4.21Å; F452-L478 HydrophobicContact CD2-CD1 3.7Å; F452-L478 HydrophobicContact CE1-CD1 4.42Å; F452-L478 HydrophobicContact CE1-CD2 4.29Å; F452-L478 HydrophobicContact CE2-CD1 4.28Å; F452-L478 HydrophobicContact CG-CD1 3.47Å; F452-L478 VanDerWaalsContact CG-CD1 3.47Å; F452-L478 HydrophobicContact CG-CG 4.29Å; A472-L478 HydrophobicContact CB-CD1 4.19Å; L478-A480 PolarHBondContact O-N 2.89Å; L478-I485 HydrophobicContact CD2-CD1 3.67Å; L478-I485 HydrophobicContact CD2-CG1 3.96Å
479	Q	95.4	Very high	94.3	Very high	20 Å²	20	18.4 Å²	18.4	9%	0.093	9%	0.094	C	C	.	.	S	Bend	trans	-81.7	61.1	-177.2	-63.2	-53.5	-57.2	0	0	113.3	C449 E450 Y477 L597 S599	C449-Q479 PolarHBondContact O-N 2.91Å; E450-Q479 WeakPolarHBondContact O-CB 3.38Å; Y477-Q479 PolarHBondContact O-N 3.38Å; Y477-Q479 PolarHBondContact O-NE2 3.49Å; Q479-L597 PolarHBondContact NE2-O 2.88Å; Q479-S599 PolarHBondContact OE1-OG 2.81Å
480	A	94.1	Very high	94.2	Very high	7 Å²	7	18.6 Å²	18.6	6%	0.058	10%	0.095	C	C	.	.	S	Bend	trans	-147.5	157.9	168.8	0	0	0	0	0	113.4	F452 L478 I485	F452-A480 HydrophobicContact CD1-CB 3.76Å; F452-A480 HydrophobicContact CE1-CB 4.15Å; L478-A480 PolarHBondContact O-N 2.89Å; A480-I485 HydrophobicContact CB-CD1 4.28Å; A480-I485 HydrophobicContact CB-CG1 3.82Å
481	S	93.7	Very high	94	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.014	11%	0.108	C	C	.	.			trans	-73.4	149.3	168.1	68.3	0	0	0	0	111.1	Q483 D484 I485	S481-Q483 PolarHBondContact O-N 3.25Å; S481-D484 PolarHBondContact O-N 3.45Å; S481-D484 PolarHBondContact OG-N 2.96Å; S481-D484 PolarHBondContact OG-OD2 2.88Å; S481-I485 WeakPolarHBondContact O-CG1 3.48Å; S481-I485 PolarHBondContact O-N 3.08Å
482	E	93.1	Very high	94.1	Very high	9 Å²	9	20.3 Å²	20.3	4%	0.042	10%	0.096	C	C	.	.	H	α-helix	trans	-57.4	-31.1	174.9	-59.9	-66.1	156.9	0	0	112.5	I485 L486 R543 H546 I547 R596	E482-I485 PolarHBondContact O-N 3.49Å; E482-L486 WeakPolarHBondContact O-CB 3.31Å; E482-L486 PolarHBondContact O-N 2.96Å; E482-R543 HydrophobicContact CG-CB 4.08Å; E482-R543 WeakPolarHBondContact OE1-CD 3.49Å; E482-R543 IonicContact OE1-NE 3.42Å; E482-R543 PolarHBondContact OE2-N 3.08Å; E482-H546 HydrophobicContact CG-CB 3.95Å; E482-I547 HydrophobicContact CB-CB 4.49Å; E482-I547 HydrophobicContact CB-CG1 3.54Å; E482-R596 IonicContact OE1-CZ 2.76Å; E482-R596 VanDerWaalsContact OE1-CZ 3.27Å; E482-R596 IonicContact OE1-NE 3.77Å; E482-R596 PolarHBondContact OE1-NE 3.27Å; E482-R596 IonicContact OE1-NH2 2.65Å; E482-R596 PolarHBondContact OE1-NH2 3.26Å; E482-R596 VanDerWaalsContact OE1-NH2 3.12Å; E482-R596 IonicContact OE2-CZ 3.68Å; E482-R596 IonicContact OE2-NE 2.71Å; E482-R596 IonicContact OE2-NH2 3.41Å; E482-R596 PolarHBondContact OE2-NH2 3.29Å
483	Q	92.3	Very high	94	Very high	39 Å²	39	20.3 Å²	20.3	18%	0.182	10%	0.096	C	C	.	.	H	α-helix	trans	-61.9	-48.3	174	-176.3	-178.1	18.1	0	0	111.4	S481 K487 I547 L548 S552 V554	S481-Q483 PolarHBondContact O-N 3.25Å; Q483-K487 WeakPolarHBondContact O-CB 3.49Å; Q483-K487 PolarHBondContact O-N 2.84Å; Q483-K487 VanDerWaalsContact O-N 3.1Å; Q483-I547 HydrophobicContact CB-CG2 4.26Å; Q483-L548 PolarHBondContact OE1-O 3.49Å; Q483-L548 VanDerWaalsContact OE1-O 3.13Å; Q483-S552 WeakPolarHBondContact CG-OG 3.49Å; Q483-S552 PolarHBondContact NE2-OG 3.47Å; Q483-V554 HydrophobicContact CG-CB 4.3Å; Q483-V554 HydrophobicContact CG-CG2 4.04Å
484	D	93.3	Very high	93.9	Very high	14 Å²	14	21 Å²	21	8%	0.075	10%	0.099	C	C	.	.	H	α-helix	trans	-68.2	-41.6	176.7	-83.7	-46	0	0	0	110.5	R78 H82 S481 L486 K487 Y488	R78-D484 IonicContact NH2-OD1 2.86Å; R78-D484 IonicContact NH2-OD2 2.78Å; R78-D484 PolarHBondContact NH2-OD2 3.32Å; H82-D484 IonicContact CE1-OD2 2.72Å; S481-D484 PolarHBondContact O-N 3.45Å; S481-D484 PolarHBondContact OG-N 2.96Å; S481-D484 PolarHBondContact OG-OD2 2.88Å; D484-L486 PolarHBondContact O-N 3.32Å; D484-K487 WeakPolarHBondContact O-CB 3.42Å; D484-K487 PolarHBondContact O-N 3.42Å; D484-K487 WeakPolarHBondContact OD1-CD 3.31Å; D484-K487 IonicContact OD1-NZ 3.25Å; D484-K487 PolarHBondContact OD1-NZ 3.18Å; D484-Y488 HydrophobicContact CB-CD2 3.97Å; D484-Y488 HydrophobicContact CB-CE2 3.93Å; D484-Y488 WeakPolarHBondContact O-CB 3.27Å; D484-Y488 WeakPolarHBondContact O-CD2 3.35Å; D484-Y488 PolarHBondContact O-N 3.11Å; D484-Y488 WeakPolarHBondContact OD1-CE2 3.4Å
485	I	94.8	Very high	93.8	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-54.8	-52.8	175.8	-65.3	164.7	0	0	0	110.5	F452 I473 L478 A480 S481 E482 K487 Y488 V489 I542	F452-I485 HydrophobicContact CE1-CG1 4.42Å; I473-I485 HydrophobicContact CG1-CG2 4.21Å; I473-I485 HydrophobicContact CG2-CG2 4.13Å; L478-I485 HydrophobicContact CD2-CD1 3.67Å; L478-I485 HydrophobicContact CD2-CG1 3.96Å; A480-I485 HydrophobicContact CB-CD1 4.28Å; A480-I485 HydrophobicContact CB-CG1 3.82Å; S481-I485 WeakPolarHBondContact O-CG1 3.48Å; S481-I485 PolarHBondContact O-N 3.08Å; E482-I485 PolarHBondContact O-N 3.49Å; I485-K487 PolarHBondContact O-N 3.06Å; I485-Y488 PolarHBondContact O-N 3.43Å; I485-V489 HydrophobicContact CG2-CG2 4.19Å; I485-V489 VanDerWaalsContact O-CB 3.25Å; I485-V489 WeakPolarHBondContact O-CB 3.32Å; I485-V489 WeakPolarHBondContact O-CG2 3.11Å; I485-V489 PolarHBondContact O-N 3.01Å; I485-I542 HydrophobicContact CG2-CD1 4.22Å; I485-I542 HydrophobicContact CG2-CG1 4.13Å
486	L	93.9	Very high	93.6	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-58.6	-47.2	177.9	-179.7	58.2	0	0	0	112.5	E482 D484 Y488 V490 L539 I542 I547 V554 L555 A558 I564	E482-L486 WeakPolarHBondContact O-CB 3.31Å; E482-L486 PolarHBondContact O-N 2.96Å; D484-L486 PolarHBondContact O-N 3.32Å; L486-Y488 PolarHBondContact O-N 3.48Å; L486-V490 HydrophobicContact CD1-CG2 4.16Å; L486-V490 WeakPolarHBondContact O-CB 3.45Å; L486-V490 VanDerWaalsContact O-CG2 3.29Å; L486-V490 WeakPolarHBondContact O-CG2 3.36Å; L486-V490 PolarHBondContact O-N 3.29Å; L486-L539 HydrophobicContact CD1-CD2 3.93Å; L486-I542 HydrophobicContact CB-CD1 4.34Å; L486-I542 HydrophobicContact CB-CG2 4.21Å; L486-I542 HydrophobicContact CD1-CD1 3.92Å; L486-I547 HydrophobicContact CD2-CD1 3.95Å; L486-V554 HydrophobicContact CB-CG1 4.24Å; L486-V554 HydrophobicContact CD2-CG1 4.03Å; L486-V554 HydrophobicContact CG-CG1 3.94Å; L486-L555 HydrophobicContact CD2-CB 4.38Å; L486-L555 HydrophobicContact CD2-CD1 4.12Å; L486-A558 HydrophobicContact CD1-CB 4.4Å; L486-A558 HydrophobicContact CD2-CB 4.19Å; L486-I564 HydrophobicContact CD1-CD1 3.96Å; L486-I564 HydrophobicContact CD2-CD1 4.04Å
487	K	93.8	Very high	93.6	Very high	68 Å²	68	21.3 Å²	21.3	30%	0.296	10%	0.097	S	C	.	.	H	α-helix	trans	-58.9	-44.4	178.7	170.7	-163.3	178.2	-156.4	0	112.5	Q483 D484 I485 K491 V554	Q483-K487 WeakPolarHBondContact O-CB 3.49Å; Q483-K487 PolarHBondContact O-N 2.84Å; Q483-K487 VanDerWaalsContact O-N 3.1Å; D484-K487 WeakPolarHBondContact O-CB 3.42Å; D484-K487 PolarHBondContact O-N 3.42Å; D484-K487 WeakPolarHBondContact OD1-CD 3.31Å; D484-K487 IonicContact OD1-NZ 3.25Å; D484-K487 PolarHBondContact OD1-NZ 3.18Å; I485-K487 PolarHBondContact O-N 3.06Å; K487-K491 WeakPolarHBondContact O-CG 3.47Å; K487-K491 PolarHBondContact O-N 2.94Å; K487-K491 VanDerWaalsContact O-N 3.16Å; K487-V554 HydrophobicContact CB-CG1 3.79Å; K487-V554 HydrophobicContact CB-CG2 4.29Å
488	Y	94.7	Very high	93.3	Very high	20 Å²	20	21.5 Å²	21.5	8%	0.078	10%	0.1	C	C	.	.	H	α-helix	trans	-82.9	-30.6	-177.2	-69.5	-68.4	0	0	0	112.9	V456 L461 D484 I485 L486 K491 W492	V456-Y488 HydrophobicContact CB-CD1 3.74Å; V456-Y488 HydrophobicContact CB-CD2 3.67Å; V456-Y488 HydrophobicContact CB-CE1 3.97Å; V456-Y488 HydrophobicContact CB-CE2 3.96Å; V456-Y488 HydrophobicContact CB-CG 3.59Å; V456-Y488 HydrophobicContact CG1-CD1 4.42Å; V456-Y488 HydrophobicContact CG1-CD2 4Å; V456-Y488 HydrophobicContact CG1-CG 3.88Å; V456-Y488 HydrophobicContact CG2-CD1 4.39Å; V456-Y488 HydrophobicContact CG2-CD2 3.69Å; V456-Y488 HydrophobicContact CG2-CE1 4.24Å; V456-Y488 HydrophobicContact CG2-CE2 3.57Å; V456-Y488 HydrophobicContact CG2-CG 4.15Å; V456-Y488 WeakPolarHBondContact O-CD1 3.45Å; V456-Y488 WeakPolarHBondContact O-CE1 3.18Å; L461-Y488 HydrophobicContact CD2-CD1 4Å; L461-Y488 HydrophobicContact CD2-CG 4.48Å; D484-Y488 HydrophobicContact CB-CD2 3.97Å; D484-Y488 HydrophobicContact CB-CE2 3.93Å; D484-Y488 WeakPolarHBondContact O-CB 3.27Å; D484-Y488 WeakPolarHBondContact O-CD2 3.35Å; D484-Y488 PolarHBondContact O-N 3.11Å; D484-Y488 WeakPolarHBondContact OD1-CE2 3.4Å; I485-Y488 PolarHBondContact O-N 3.43Å; L486-Y488 PolarHBondContact O-N 3.48Å; Y488-K491 HydrophobicContact CD1-CD 3.89Å; Y488-K491 HydrophobicContact CE1-CD 4.22Å; Y488-K491 PolarHBondContact O-N 3.26Å; Y488-W492 WeakPolarHBondContact O-CB 3.35Å; Y488-W492 PolarHBondContact O-N 3.48Å
489	V	94.9	Very high	92.8	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.006	13%	0.125	C	C	.	.	H	α-helix	trans	-62.3	-46.7	168.6	165.7	0	0	0	0	111.1	I473 I485 K491 W492 G493 L535 L538 I542	I473-V489 HydrophobicContact CD1-CG2 3.36Å; I473-V489 HydrophobicContact CG1-CG2 4.38Å; I485-V489 HydrophobicContact CG2-CG2 4.19Å; I485-V489 VanDerWaalsContact O-CB 3.25Å; I485-V489 WeakPolarHBondContact O-CB 3.32Å; I485-V489 WeakPolarHBondContact O-CG2 3.11Å; I485-V489 PolarHBondContact O-N 3.01Å; V489-K491 PolarHBondContact O-N 3.23Å; V489-W492 PolarHBondContact O-N 3.08Å; V489-G493 PolarHBondContact O-N 3.16Å; V489-L535 HydrophobicContact CG1-CD2 3.77Å; V489-L535 WeakPolarHBondContact O-CD2 3.35Å; V489-L538 HydrophobicContact CG1-CB 4.04Å; V489-L538 HydrophobicContact CG1-CD1 3.99Å; V489-I542 HydrophobicContact CB-CD1 4.28Å; V489-I542 HydrophobicContact CG1-CD1 4.23Å; V489-I542 HydrophobicContact CG2-CD1 4.32Å
490	V	93.1	Very high	92.4	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.03	14%	0.138	C	C	.	.	H	α-helix	trans	-61.7	-43.8	175.9	169.5	0	0	0	0	111.1	L486 W492 G493 E494 L535 L563	L486-V490 HydrophobicContact CD1-CG2 4.16Å; L486-V490 WeakPolarHBondContact O-CB 3.45Å; L486-V490 VanDerWaalsContact O-CG2 3.29Å; L486-V490 WeakPolarHBondContact O-CG2 3.36Å; L486-V490 PolarHBondContact O-N 3.29Å; V490-W492 PolarHBondContact O-N 2.85Å; V490-G493 PolarHBondContact O-N 2.73Å; V490-E494 HydrophobicContact CG1-CG 4.42Å; V490-E494 VanDerWaalsContact CG1-OE1 3.29Å; V490-E494 WeakPolarHBondContact CG1-OE1 3.45Å; V490-E494 WeakPolarHBondContact O-CB 3.48Å; V490-E494 VanDerWaalsContact O-CG 3.26Å; V490-E494 WeakPolarHBondContact O-CG 3.25Å; V490-E494 PolarHBondContact O-N 3.34Å; V490-L535 HydrophobicContact CG2-CD1 4.09Å; V490-L563 HydrophobicContact CG1-CD1 4.4Å; V490-L563 HydrophobicContact CG2-CD1 4.16Å
491	K	93	Very high	91.9	Very high	87 Å²	87	32.5 Å²	32.5	38%	0.378	15%	0.145	S	C	.	.	H	α-helix	trans	-59.4	-43.1	173.5	-82	-179.7	156.3	-143.6	0	113.2	K487 Y488 V489 E494 Q495	K487-K491 WeakPolarHBondContact O-CG 3.47Å; K487-K491 PolarHBondContact O-N 2.94Å; K487-K491 VanDerWaalsContact O-N 3.16Å; Y488-K491 HydrophobicContact CD1-CD 3.89Å; Y488-K491 HydrophobicContact CE1-CD 4.22Å; Y488-K491 PolarHBondContact O-N 3.26Å; V489-K491 PolarHBondContact O-N 3.23Å; K491-E494 PolarHBondContact O-N 2.68Å; K491-Q495 PolarHBondContact O-N 3.02Å
492	W	95.4	Very high	91.3	Very high	10 Å²	10	33.7 Å²	33.7	4%	0.038	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-48.8	177.1	175.7	89.8	0	0	0	110.6	L464 K466 L469 Y488 V489 V490 E494 Q495 Q496 I534 L538	L464-W492 PolarHBondContact O-NE1 2.83Å; K466-W492 HydrophobicContact CB-CH2 3.83Å; K466-W492 HydrophobicContact CB-CZ2 4.2Å; K466-W492 HydrophobicContact CG-CH2 3.91Å; L469-W492 HydrophobicContact CD2-CB 4.15Å; L469-W492 HydrophobicContact CD2-CD2 3.44Å; L469-W492 VanDerWaalsContact CD2-CD2 3.44Å; L469-W492 HydrophobicContact CD2-CE3 3.86Å; L469-W492 HydrophobicContact CD2-CG 3.57Å; L469-W492 HydrophobicContact CD2-CZ2 4.38Å; Y488-W492 WeakPolarHBondContact O-CB 3.35Å; Y488-W492 PolarHBondContact O-N 3.48Å; V489-W492 PolarHBondContact O-N 3.08Å; V490-W492 PolarHBondContact O-N 2.85Å; W492-E494 VanDerWaalsContact C-N 3.34Å; W492-E494 PolarHBondContact O-N 3.48Å; W492-Q495 PolarHBondContact O-N 3.16Å; W492-Q495 VanDerWaalsContact O-N 3.15Å; W492-Q496 HydrophobicContact CD2-CG 3.84Å; W492-Q496 HydrophobicContact CE3-CG 4.1Å; W492-Q496 HydrophobicContact CG-CG 4.47Å; W492-Q496 HydrophobicContact CH2-CG 3.88Å; W492-Q496 HydrophobicContact CZ2-CG 3.62Å; W492-Q496 HydrophobicContact CZ3-CG 4.11Å; W492-Q496 WeakPolarHBondContact O-CG 3.48Å; W492-Q496 PolarHBondContact O-N 3.07Å; W492-I534 HydrophobicContact CE3-CG2 4.49Å; W492-I534 HydrophobicContact CZ3-CG2 3.85Å; W492-L538 HydrophobicContact CE3-CD1 3.76Å; W492-L538 HydrophobicContact CH2-CD1 4.41Å; W492-L538 HydrophobicContact CZ3-CD1 3.6Å
493	G	93.6	Very high	90.7	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-39.8	177.3	0	0	0	0	0	113.2	V489 V490 Q495 Q496 L497	V489-G493 PolarHBondContact O-N 3.16Å; V490-G493 PolarHBondContact O-N 2.73Å; G493-Q495 VanDerWaalsContact C-N 3.33Å; G493-Q495 PolarHBondContact O-N 3.5Å; G493-Q496 PolarHBondContact O-N 3.11Å; G493-L497 WeakPolarHBondContact O-CB 3.33Å; G493-L497 PolarHBondContact O-N 3.18Å
494	E	92.3	Very high	90.2	Very high	15 Å²	15	43.8 Å²	43.8	7%	0.07	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-42.6	173.8	-74.2	169.6	-179.6	0	0	111.3	V490 K491 W492 L497 I498 R523 L526 L531 R561	V490-E494 HydrophobicContact CG1-CG 4.42Å; V490-E494 VanDerWaalsContact CG1-OE1 3.29Å; V490-E494 WeakPolarHBondContact CG1-OE1 3.45Å; V490-E494 WeakPolarHBondContact O-CB 3.48Å; V490-E494 VanDerWaalsContact O-CG 3.26Å; V490-E494 WeakPolarHBondContact O-CG 3.25Å; V490-E494 PolarHBondContact O-N 3.34Å; K491-E494 PolarHBondContact O-N 2.68Å; W492-E494 VanDerWaalsContact C-N 3.34Å; W492-E494 PolarHBondContact O-N 3.48Å; E494-L497 PolarHBondContact O-N 3.12Å; E494-I498 VanDerWaalsContact O-CG1 3.3Å; E494-I498 WeakPolarHBondContact O-CG1 3.25Å; E494-I498 PolarHBondContact O-N 2.92Å; E494-R523 VanDerWaalsContact CD-NE 3.29Å; E494-R523 IonicContact OE1-CZ 2.8Å; E494-R523 IonicContact OE1-NE 3.61Å; E494-R523 PolarHBondContact OE1-NE 3.31Å; E494-R523 IonicContact OE1-NH2 3.53Å; E494-R523 PolarHBondContact OE1-NH2 3.44Å; E494-R523 IonicContact OE2-CZ 3.26Å; E494-R523 IonicContact OE2-NE 2.67Å; E494-R523 PolarHBondContact OE2-NE 3.01Å; E494-R523 IonicContact OE2-NH2 2.93Å; E494-L526 HydrophobicContact CB-CD1 3.89Å; E494-L526 HydrophobicContact CG-CD1 3.85Å; E494-L531 HydrophobicContact CG-CD1 4.09Å; E494-L531 HydrophobicContact CG-CD2 3.82Å; E494-R561 IonicContact OE1-CZ 2.8Å; E494-R561 VanDerWaalsContact OE1-CZ 3.22Å; E494-R561 IonicContact OE1-NH1 3.8Å; E494-R561 PolarHBondContact OE1-NH1 2.86Å; E494-R561 IonicContact OE1-NH2 3.43Å; E494-R561 PolarHBondContact OE1-NH2 2.88Å
495	Q	91	Very high	89.2	Confident	81 Å²	81	48.5 Å²	48.5	38%	0.379	22%	0.221	S	C	.	.	H	α-helix	trans	-72.9	-37	177.5	-170.7	63.4	11.7	0	0	113.2	Y462 K491 W492 G493 L497 I498 K499	Y462-Q495 HydrophobicContact CD1-CB 3.6Å; Y462-Q495 HydrophobicContact CD1-CG 3.69Å; Y462-Q495 HydrophobicContact CE1-CB 4.09Å; Y462-Q495 HydrophobicContact CE1-CG 4.39Å; Y462-Q495 HydrophobicContact CG-CB 4.22Å; Y462-Q495 HydrophobicContact CG-CG 3.78Å; K491-Q495 PolarHBondContact O-N 3.02Å; W492-Q495 PolarHBondContact O-N 3.16Å; W492-Q495 VanDerWaalsContact O-N 3.15Å; G493-Q495 VanDerWaalsContact C-N 3.33Å; G493-Q495 PolarHBondContact O-N 3.5Å; Q495-L497 VanDerWaalsContact C-N 3.3Å; Q495-L497 PolarHBondContact O-N 3.12Å; Q495-I498 PolarHBondContact O-N 3.45Å; Q495-K499 PolarHBondContact O-N 2.66Å
496	Q	91.6	Very high	87.6	Confident	36 Å²	36	52.1 Å²	52.1	17%	0.168	24%	0.244	C	C	.	.	H	α-helix	trans	-64.7	-35.3	172.6	-63.2	-48.8	-34.9	0	0	111.6	Y462 W492 G493 K499 R500 I534	Y462-Q496 PolarHBondContact O-NE2 2.89Å; W492-Q496 HydrophobicContact CD2-CG 3.84Å; W492-Q496 HydrophobicContact CE3-CG 4.1Å; W492-Q496 HydrophobicContact CG-CG 4.47Å; W492-Q496 HydrophobicContact CH2-CG 3.88Å; W492-Q496 HydrophobicContact CZ2-CG 3.62Å; W492-Q496 HydrophobicContact CZ3-CG 4.11Å; W492-Q496 WeakPolarHBondContact O-CG 3.48Å; W492-Q496 PolarHBondContact O-N 3.07Å; G493-Q496 PolarHBondContact O-N 3.11Å; Q496-K499 PolarHBondContact O-N 2.81Å; Q496-R500 WeakPolarHBondContact O-CG 3.37Å; Q496-R500 PolarHBondContact O-N 2.99Å; Q496-I534 HydrophobicContact CB-CG2 4.36Å
497	L	90.9	Very high	85.9	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-67.3	-45.2	173.9	-176.1	54.4	0	0	0	111.4	G493 E494 Q495 K499 R500 M501 L526 D527 E530 L531 I534	G493-L497 WeakPolarHBondContact O-CB 3.33Å; G493-L497 PolarHBondContact O-N 3.18Å; E494-L497 PolarHBondContact O-N 3.12Å; Q495-L497 VanDerWaalsContact C-N 3.3Å; Q495-L497 PolarHBondContact O-N 3.12Å; L497-K499 VanDerWaalsContact C-N 3.25Å; L497-K499 PolarHBondContact O-N 3.31Å; L497-R500 PolarHBondContact O-N 3.36Å; L497-M501 HydrophobicContact CD1-CG 4.37Å; L497-M501 HydrophobicContact CG-SD 4.18Å; L497-M501 VanDerWaalsContact O-CG 3.29Å; L497-M501 WeakPolarHBondContact O-CG 3.47Å; L497-M501 PolarHBondContact O-N 2.98Å; L497-L526 HydrophobicContact CD2-CB 4.06Å; L497-L526 HydrophobicContact CD2-CD2 4.25Å; L497-L526 HydrophobicContact CG-CD2 4.26Å; L497-D527 WeakPolarHBondContact CD2-O 3.27Å; L497-E530 HydrophobicContact CD1-CB 3.85Å; L497-E530 HydrophobicContact CD2-CB 4.4Å; L497-L531 HydrophobicContact CD2-CB 3.94Å; L497-I534 HydrophobicContact CB-CD1 3.77Å; L497-I534 HydrophobicContact CD1-CD1 4.05Å; L497-I534 HydrophobicContact CG-CD1 4.41Å
498	I	88.6	Confident	84.1	Confident	34 Å²	34	58 Å²	58	17%	0.174	28%	0.279	C	S	.	.	H	α-helix	trans	-56	-42.1	173.5	-69.7	165.1	0	0	0	110.9	E494 Q495 M501 A502 L509 V521 L526	E494-I498 VanDerWaalsContact O-CG1 3.3Å; E494-I498 WeakPolarHBondContact O-CG1 3.25Å; E494-I498 PolarHBondContact O-N 2.92Å; Q495-I498 PolarHBondContact O-N 3.45Å; I498-M501 PolarHBondContact O-N 3.43Å; I498-A502 PolarHBondContact O-N 2.88Å; I498-L509 HydrophobicContact CG2-CD1 4.37Å; I498-V521 HydrophobicContact CG1-CG1 4.34Å; I498-L526 HydrophobicContact CD1-CD2 4.5Å; I498-L526 HydrophobicContact CG1-CD2 3.72Å
499	K	86.3	Confident	82.1	Confident	121 Å²	121	60.2 Å²	60.2	53%	0.526	29%	0.292	S	S	.	.	H	α-helix	trans	-63.5	-49.6	175.6	-171.8	176.3	178.5	178.1	0	112.1	Q495 Q496 L497 M501 A502 D503	Q495-K499 PolarHBondContact O-N 2.66Å; Q496-K499 PolarHBondContact O-N 2.81Å; L497-K499 VanDerWaalsContact C-N 3.25Å; L497-K499 PolarHBondContact O-N 3.31Å; K499-M501 VanDerWaalsContact C-N 3.25Å; K499-M501 PolarHBondContact O-N 3.47Å; K499-A502 WeakPolarHBondContact O-CA 3.45Å; K499-A502 VanDerWaalsContact O-CB 3.29Å; K499-A502 WeakPolarHBondContact O-CB 3.49Å; K499-A502 PolarHBondContact O-N 3.37Å; K499-D503 VanDerWaalsContact O-CG 3.26Å; K499-D503 PolarHBondContact O-N 2.7Å
500	R	87	Confident	79.9	Confident	95 Å²	95	63 Å²	63	36%	0.358	31%	0.311	S	S	.	.	H	α-helix	trans	-57.1	-37	175	-73.1	174.5	178.5	-158.4	-1	112.7	Q496 L497 R504	Q496-R500 WeakPolarHBondContact O-CG 3.37Å; Q496-R500 PolarHBondContact O-N 2.99Å; L497-R500 PolarHBondContact O-N 3.36Å; R500-R504 VanDerWaalsContact O-CG 3.25Å; R500-R504 WeakPolarHBondContact O-CG 3.48Å; R500-R504 PolarHBondContact O-N 3.48Å; R500-R504 VanDerWaalsContact O-N 3.11Å
501	M	83.3	Confident	77.9	Confident	42 Å²	42	66.7 Å²	66.7	21%	0.207	35%	0.35	C	S	.	.	H	α-helix	trans	-67.3	-38.6	174.6	-68.4	171.9	76	0	0	111.6	L497 I498 K499 R504 E505 V521 L526	L497-M501 HydrophobicContact CD1-CG 4.37Å; L497-M501 HydrophobicContact CG-SD 4.18Å; L497-M501 VanDerWaalsContact O-CG 3.29Å; L497-M501 WeakPolarHBondContact O-CG 3.47Å; L497-M501 PolarHBondContact O-N 2.98Å; I498-M501 PolarHBondContact O-N 3.43Å; K499-M501 VanDerWaalsContact C-N 3.25Å; K499-M501 PolarHBondContact O-N 3.47Å; M501-R504 PolarHBondContact O-N 2.93Å; M501-E505 PolarHBondContact O-N 3.36Å; M501-V521 HydrophobicContact CE-CG1 4.1Å; M501-V521 HydrophobicContact CE-CG2 4.31Å; M501-V521 HydrophobicContact SD-CG1 4.27Å; M501-L526 HydrophobicContact SD-CD2 3.75Å
502	A	81.1	Confident	75.8	Confident	27 Å²	27	66.5 Å²	66.5	22%	0.223	36%	0.356	C	S	.	.	H	α-helix	trans	-64.3	-43	174.2	0	0	0	0	0	112.6	I498 K499 R504 E505 P506 L509	I498-A502 PolarHBondContact O-N 2.88Å; K499-A502 WeakPolarHBondContact O-CA 3.45Å; K499-A502 VanDerWaalsContact O-CB 3.29Å; K499-A502 WeakPolarHBondContact O-CB 3.49Å; K499-A502 PolarHBondContact O-N 3.37Å; A502-R504 VanDerWaalsContact C-N 3.31Å; A502-R504 PolarHBondContact O-N 2.89Å; A502-E505 CarbonylContact O-C 3.44Å; A502-P506 VanDerWaalsContact O-CA 3.32Å; A502-P506 WeakPolarHBondContact O-CA 3.45Å; A502-P506 WeakPolarHBondContact O-CD 3.34Å; A502-P506 VanDerWaalsContact O-N 3.13Å; A502-L509 HydrophobicContact CB-CD1 3.45Å; A502-L509 VanDerWaalsContact CB-CD1 3.45Å
503	D	79.8	Confident	73.4	Confident	117 Å²	117	70.2 Å²	70.2	63%	0.626	39%	0.389	S	S	*	.	H	α-helix	trans	-68.5	-30.5	-179.4	-60.8	-29	0	0	0	111.8	K499	K499-D503 VanDerWaalsContact O-CG 3.26Å; K499-D503 PolarHBondContact O-N 2.7Å
504	R	81.5	Confident	71.1	Confident	143 Å²	143	79 Å²	79	54%	0.54	43%	0.43	S	S	.	.	H	α-helix	trans	-79.5	-44.6	173.9	-70.3	171.3	-172.7	164.8	4	113.1	R500 M501 A502 E530	R500-R504 VanDerWaalsContact O-CG 3.25Å; R500-R504 WeakPolarHBondContact O-CG 3.48Å; R500-R504 PolarHBondContact O-N 3.48Å; R500-R504 VanDerWaalsContact O-N 3.11Å; M501-R504 PolarHBondContact O-N 2.93Å; A502-R504 VanDerWaalsContact C-N 3.31Å; A502-R504 PolarHBondContact O-N 2.89Å; R504-E530 IonicContact CZ-OE1 3.55Å; R504-E530 IonicContact CZ-OE2 3.68Å; R504-E530 VanDerWaalsContact CZ-OE2 3.29Å; R504-E530 VanDerWaalsContact NH1-CD 3.27Å; R504-E530 IonicContact NH1-OE1 2.84Å; R504-E530 PolarHBondContact NH1-OE1 3.24Å; R504-E530 IonicContact NH1-OE2 2.83Å; R504-E530 PolarHBondContact NH1-OE2 3.15Å; R504-E530 IonicContact NH2-OE1 3.31Å; R504-E530 IonicContact NH2-OE2 3.22Å; R504-E530 PolarHBondContact NH2-OE2 3.19Å
505	E	73.6	Confident	68.7	Low	114 Å²	114	81.5 Å²	81.5	53%	0.533	45%	0.449	S	S	.	.			trans	-135	78.5	-174.9	-71.3	-169.3	-138.6	0	0	111.6	M501 A502 N507 L508	M501-E505 PolarHBondContact O-N 3.36Å; A502-E505 CarbonylContact O-C 3.44Å; E505-N507 PolarHBondContact O-N 3.12Å; E505-L508 HydrophobicContact CB-CD1 3.78Å; E505-L508 HydrophobicContact CB-CG 3.87Å; E505-L508 HydrophobicContact CG-CD1 4.44Å; E505-L508 PolarHBondContact O-N 3.45Å; E505-L508 WeakPolarHBondContact OE2-CD1 3.46Å
506	P	61.2	Low	66.4	Low	75 Å²	75	84.2 Å²	84.2	49%	0.487	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-61.3	-21.9	-176.6	22.5	-33.9	0	0	0	113.4	A502 L508 L509 S510	A502-P506 VanDerWaalsContact O-CA 3.32Å; A502-P506 WeakPolarHBondContact O-CA 3.45Å; A502-P506 WeakPolarHBondContact O-CD 3.34Å; A502-P506 VanDerWaalsContact O-N 3.13Å; P506-L508 VanDerWaalsContact C-N 3.29Å; P506-L508 PolarHBondContact O-N 3.23Å; P506-L509 PolarHBondContact O-N 2.95Å; P506-S510 WeakPolarHBondContact O-CB 3.23Å; P506-S510 PolarHBondContact O-N 2.98Å; P506-S510 PolarHBondContact O-OG 3.02Å
507	N	57.7	Low	64.2	Low	106 Å²	106	88.3 Å²	88.3	57%	0.567	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-75.8	-8.6	178.3	-63	-28.9	0	0	0	114.3	E505	E505-N507 PolarHBondContact O-N 3.12Å
508	L	56.1	Low	62.1	Low	86 Å²	86	98.5 Å²	98.5	45%	0.45	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-81.6	-19.9	172.2	-68.9	-179.3	0	0	0	113.1	E505 P506	E505-L508 HydrophobicContact CB-CD1 3.78Å; E505-L508 HydrophobicContact CB-CG 3.87Å; E505-L508 HydrophobicContact CG-CD1 4.44Å; E505-L508 PolarHBondContact O-N 3.45Å; E505-L508 WeakPolarHBondContact OE2-CD1 3.46Å; P506-L508 VanDerWaalsContact C-N 3.29Å; P506-L508 PolarHBondContact O-N 3.23Å
509	L	52.2	Low	60.4	Low	68 Å²	68	105.4 Å²	105.4	36%	0.356	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-122.7	-30.1	-173.7	-74.7	164.3	0	0	0	113.3	I498 A502 P506 V521	I498-L509 HydrophobicContact CG2-CD1 4.37Å; A502-L509 HydrophobicContact CB-CD1 3.45Å; A502-L509 VanDerWaalsContact CB-CD1 3.45Å; P506-L509 PolarHBondContact O-N 2.95Å; L509-V521 HydrophobicContact CD2-CG2 4.02Å; L509-V521 HydrophobicContact CG-CG2 4.38Å
510	S	49.4	Very low	59.2	Low	60 Å²	60	101.9 Å²	101.9	42%	0.42	56%	0.56	S	S	.	*	S	Bend	trans	-75.2	126.6	168.9	63.3	0	0	0	0	110.6	P506 T512	P506-S510 WeakPolarHBondContact O-CB 3.23Å; P506-S510 PolarHBondContact O-N 2.98Å; P506-S510 PolarHBondContact O-OG 3.02Å; S510-T512 PolarHBondContact O-N 3.02Å; S510-T512 PolarHBondContact O-OG1 2.84Å
511	G	50.9	Low	58.2	Low	82 Å²	82	99 Å²	99	85%	0.845	55%	0.553	S	S	*	*			trans	-76.4	54.6	-170.6	0	0	0	0	0	115.4	A513	G511-A513 PolarHBondContact O-N 3.16Å
512	T	47.5	Very low	57.5	Low	82 Å²	82	101.3 Å²	101.3	50%	0.503	56%	0.562	S	S	.	*			trans	-58.3	123.7	174	12.8	0	0	0	0	110.1	S510 H514 S515	S510-T512 PolarHBondContact O-N 3.02Å; S510-T512 PolarHBondContact O-OG1 2.84Å; T512-H514 PolarHBondContact O-N 3.46Å; T512-S515 PolarHBondContact O-N 2.68Å
513	A	46.9	Very low	57	Low	88 Å²	88	105.8 Å²	105.8	73%	0.727	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-2.7	-158.2	0	0	0	0	0	117.1	G511	G511-A513 PolarHBondContact O-N 3.16Å
514	H	44.9	Very low	56.6	Low	186 Å²	186	109.8 Å²	109.8	86%	0.861	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.2	1.8	178.8	-56.9	-51.1	0	0	0	113.9	T512	T512-H514 PolarHBondContact O-N 3.46Å
515	S	41.9	Very low	56.4	Low	67 Å²	67	106.5 Å²	106.5	47%	0.469	57%	0.572	S	S	.	*	S	Bend	trans	-81.5	130.8	172.4	-172.7	0	0	0	0	111.1	T512 N517	T512-S515 PolarHBondContact O-N 2.68Å; S515-N517 VanDerWaalsContact C-N 3.31Å; S515-N517 PolarHBondContact O-N 2.96Å
516	V	42.6	Very low	56.9	Low	138 Å²	138	101.7 Å²	101.7	84%	0.836	55%	0.55	S	S	*	*	S	Bend	trans	-85.3	68.9	-174	-170.8	0	0	0	0	111.2
517	N	43.8	Very low	58.1	Low	121 Å²	121	101.7 Å²	101.7	65%	0.647	55%	0.546	S	S	*	.			trans	-166.7	92	153.2	-100.4	-30.2	0	0	0	112.5	S515 R519	S515-N517 VanDerWaalsContact C-N 3.31Å; S515-N517 PolarHBondContact O-N 2.96Å; N517-R519 PolarHBondContact O-N 2.67Å
518	K	46.9	Very low	59.6	Low	217 Å²	217	99.2 Å²	99.2	94%	0.943	54%	0.535	S	S	*	.	S	Bend	trans	-73	37	164.7	-72.9	-170.8	173.9	-176.6	0	112.8
519	R	54.2	Low	61.1	Low	178 Å²	178	102.3 Å²	102.3	67%	0.672	55%	0.547	S	S	*	.	S	Bend	trans	-142.1	103	-177.5	-71.5	176.1	173.5	175.4	-0	106.7	N517	N517-R519 PolarHBondContact O-N 2.67Å
520	G	60	Low	62.9	Low	48 Å²	48	101.6 Å²	101.6	50%	0.495	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-57.9	156.7	174.3	0	0	0	0	0	111.9	K522	G520-K522 PolarHBondContact O-N 3.19Å
521	V	66.4	Low	64.9	Low	33 Å²	33	98.7 Å²	98.7	20%	0.2	52%	0.522	C	S	.	.	P	Polyproline II helix	trans	-47.1	121.5	-176.2	179.3	0	0	0	0	110.9	I498 M501 L509 D525 L526	I498-V521 HydrophobicContact CG1-CG1 4.34Å; M501-V521 HydrophobicContact CE-CG1 4.1Å; M501-V521 HydrophobicContact CE-CG2 4.31Å; M501-V521 HydrophobicContact SD-CG1 4.27Å; L509-V521 HydrophobicContact CD2-CG2 4.02Å; L509-V521 HydrophobicContact CG-CG2 4.38Å; V521-D525 HydrophobicContact CG1-CB 4.48Å; V521-L526 HydrophobicContact CG1-CD2 3.51Å; V521-L526 HydrophobicContact CG1-CG 4.34Å
522	K	69.7	Low	66.7	Low	92 Å²	92	98.8 Å²	98.8	40%	0.4	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-95.1	158.2	178.5	-50.5	-174.6	174.7	-163.3	0	110.5	G520 R524 D525	G520-K522 PolarHBondContact O-N 3.19Å; K522-R524 HydrophobicContact CB-CG 4.42Å; K522-R524 PolarHBondContact O-N 3.41Å; K522-D525 WeakPolarHBondContact CA-OD2 3.47Å; K522-D525 WeakPolarHBondContact CB-OD2 3.34Å; K522-D525 WeakPolarHBondContact CG-OD2 3.42Å; K522-D525 PolarHBondContact N-OD2 3.03Å; K522-D525 WeakPolarHBondContact O-CA 3.19Å; K522-D525 WeakPolarHBondContact O-CB 3.29Å; K522-D525 PolarHBondContact O-N 2.92Å
523	R	69.6	Low	68.8	Low	121 Å²	121	100.6 Å²	100.6	46%	0.457	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.1	-25.4	176.8	-166.2	-179.7	-168.2	-119.2	2.7	115.7	E494 D557 R561	E494-R523 VanDerWaalsContact CD-NE 3.29Å; E494-R523 IonicContact OE1-CZ 2.8Å; E494-R523 IonicContact OE1-NE 3.61Å; E494-R523 PolarHBondContact OE1-NE 3.31Å; E494-R523 IonicContact OE1-NH2 3.53Å; E494-R523 PolarHBondContact OE1-NH2 3.44Å; E494-R523 IonicContact OE2-CZ 3.26Å; E494-R523 IonicContact OE2-NE 2.67Å; E494-R523 PolarHBondContact OE2-NE 3.01Å; E494-R523 IonicContact OE2-NH2 2.93Å; R523-D557 IonicContact CZ-OD2 3.89Å; R523-D557 VanDerWaalsContact CZ-OD2 3.31Å; R523-D557 IonicContact NH1-OD1 2.93Å; R523-D557 IonicContact NH1-OD2 2.87Å; R523-D557 PolarHBondContact NH1-OD2 3.23Å; R523-D557 IonicContact NH2-OD2 3.19Å; R523-D557 PolarHBondContact NH2-OD2 3.41Å; R523-R561 VanDerWaalsContact CZ-NH1 3.33Å
524	R	72.4	Confident	70.9	Confident	200 Å²	200	96.8 Å²	96.8	76%	0.755	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-17.5	179	79.9	-169.9	-176.8	148.5	17	113.9	K522 L526	K522-R524 HydrophobicContact CB-CG 4.42Å; K522-R524 PolarHBondContact O-N 3.41Å; R524-L526 VanDerWaalsContact C-N 3.3Å
525	D	76.3	Confident	73.2	Confident	74 Å²	74	88 Å²	88	40%	0.396	43%	0.426	S	S	.	.	S	Bend	trans	-94.7	4.7	-178.2	-40.5	-45.1	0	0	0	110.1	V521 K522	V521-D525 HydrophobicContact CG1-CB 4.48Å; K522-D525 WeakPolarHBondContact CA-OD2 3.47Å; K522-D525 WeakPolarHBondContact CB-OD2 3.34Å; K522-D525 WeakPolarHBondContact CG-OD2 3.42Å; K522-D525 PolarHBondContact N-OD2 3.03Å; K522-D525 WeakPolarHBondContact O-CA 3.19Å; K522-D525 WeakPolarHBondContact O-CB 3.29Å; K522-D525 PolarHBondContact O-N 2.92Å
526	L	84.3	Confident	75.6	Confident	13 Å²	13	87.8 Å²	87.8	7%	0.068	42%	0.424	C	S	.	.	S	Bend	trans	-88.3	137.5	174.9	-61.8	178.3	0	0	0	110.5	E494 L497 I498 M501 V521 R524	E494-L526 HydrophobicContact CB-CD1 3.89Å; E494-L526 HydrophobicContact CG-CD1 3.85Å; L497-L526 HydrophobicContact CD2-CB 4.06Å; L497-L526 HydrophobicContact CD2-CD2 4.25Å; L497-L526 HydrophobicContact CG-CD2 4.26Å; I498-L526 HydrophobicContact CD1-CD2 4.5Å; I498-L526 HydrophobicContact CG1-CD2 3.72Å; M501-L526 HydrophobicContact SD-CD2 3.75Å; V521-L526 HydrophobicContact CG1-CD2 3.51Å; V521-L526 HydrophobicContact CG1-CG 4.34Å; R524-L526 VanDerWaalsContact C-N 3.3Å
527	D	86.9	Confident	78	Confident	76 Å²	76	83 Å²	83	41%	0.406	40%	0.396	S	S	.	.			trans	-68.2	144.4	170.5	178.9	48.7	0	0	0	112.1	L497 E529 E530 L531	L497-D527 WeakPolarHBondContact CD2-O 3.27Å; D527-E529 PolarHBondContact OD1-N 3.5Å; D527-E529 WeakPolarHBondContact OD2-CA 3.47Å; D527-E529 WeakPolarHBondContact OD2-CB 3.3Å; D527-E529 PolarHBondContact OD2-N 3.21Å; D527-E530 PolarHBondContact OD2-N 2.82Å; D527-L531 VanDerWaalsContact O-CB 3.26Å; D527-L531 WeakPolarHBondContact O-CB 3.37Å; D527-L531 PolarHBondContact O-N 3.03Å
528	V	88.1	Confident	80.3	Confident	53 Å²	53	77.2 Å²	77.2	32%	0.321	37%	0.365	S	S	.	.	H	α-helix	trans	-90.8	-24.9	-176.4	-177.3	0	0	0	0	111.5	R532 R561 L563	V528-R532 VanDerWaalsContact O-CB 3.26Å; V528-R532 WeakPolarHBondContact O-CB 3.37Å; V528-R532 PolarHBondContact O-N 2.68Å; V528-R561 VanDerWaalsContact CG1-O 3.24Å; V528-R561 WeakPolarHBondContact CG1-O 3.37Å; V528-L563 HydrophobicContact CG1-CD2 4.19Å
529	E	87.8	Confident	82.4	Confident	151 Å²	151	67.9 Å²	67.9	71%	0.706	33%	0.325	S	S	*	.	H	α-helix	trans	-79.1	-45.4	178.2	-57.1	-162	154.9	0	0	111.5	D527 L531 R532 E533	D527-E529 PolarHBondContact OD1-N 3.5Å; D527-E529 WeakPolarHBondContact OD2-CA 3.47Å; D527-E529 WeakPolarHBondContact OD2-CB 3.3Å; D527-E529 PolarHBondContact OD2-N 3.21Å; E529-L531 VanDerWaalsContact C-N 3.34Å; E529-L531 PolarHBondContact O-N 3.05Å; E529-R532 WeakPolarHBondContact O-CB 3.46Å; E529-R532 PolarHBondContact O-N 2.97Å; E529-E533 PolarHBondContact O-N 2.88Å
530	E	89.5	Confident	84.1	Confident	53 Å²	53	64 Å²	64	25%	0.248	32%	0.324	C	S	.	.	H	α-helix	trans	-62.2	-39	170.4	-74.5	-154.3	-128.7	0	0	112.2	L497 R504 D527 E533 I534	L497-E530 HydrophobicContact CD1-CB 3.85Å; L497-E530 HydrophobicContact CD2-CB 4.4Å; R504-E530 IonicContact CZ-OE1 3.55Å; R504-E530 IonicContact CZ-OE2 3.68Å; R504-E530 VanDerWaalsContact CZ-OE2 3.29Å; R504-E530 VanDerWaalsContact NH1-CD 3.27Å; R504-E530 IonicContact NH1-OE1 2.84Å; R504-E530 PolarHBondContact NH1-OE1 3.24Å; R504-E530 IonicContact NH1-OE2 2.83Å; R504-E530 PolarHBondContact NH1-OE2 3.15Å; R504-E530 IonicContact NH2-OE1 3.31Å; R504-E530 IonicContact NH2-OE2 3.22Å; R504-E530 PolarHBondContact NH2-OE2 3.19Å; D527-E530 PolarHBondContact OD2-N 2.82Å; E530-E533 WeakPolarHBondContact O-CB 3.49Å; E530-E533 PolarHBondContact O-N 3.34Å; E530-I534 WeakPolarHBondContact O-CG1 3.29Å; E530-I534 PolarHBondContact O-N 2.91Å
531	L	91.4	Very high	85.6	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.1	-40.1	174.3	-178.5	60.4	0	0	0	111.6	E494 L497 D527 E529 E533 I534 L535 L563	E494-L531 HydrophobicContact CG-CD1 4.09Å; E494-L531 HydrophobicContact CG-CD2 3.82Å; L497-L531 HydrophobicContact CD2-CB 3.94Å; D527-L531 VanDerWaalsContact O-CB 3.26Å; D527-L531 WeakPolarHBondContact O-CB 3.37Å; D527-L531 PolarHBondContact O-N 3.03Å; E529-L531 VanDerWaalsContact C-N 3.34Å; E529-L531 PolarHBondContact O-N 3.05Å; L531-E533 VanDerWaalsContact C-N 3.34Å; L531-I534 PolarHBondContact O-N 2.85Å; L531-L535 HydrophobicContact CD1-CD1 3.85Å; L531-L535 HydrophobicContact CD1-CG 4.07Å; L531-L535 HydrophobicContact CG-CD1 3.93Å; L531-L535 HydrophobicContact CG-CG 4.45Å; L531-L535 WeakPolarHBondContact O-CB 3.42Å; L531-L535 VanDerWaalsContact O-CG 3.27Å; L531-L535 WeakPolarHBondContact O-CG 3.44Å; L531-L535 PolarHBondContact O-N 3.37Å; L531-L563 HydrophobicContact CD2-CD1 4.45Å; L531-L563 HydrophobicContact CD2-CD2 4.27Å; L531-L563 HydrophobicContact CG-CD2 4.25Å
532	R	90.2	Very high	86.8	Confident	84 Å²	84	64.6 Å²	64.6	32%	0.317	31%	0.311	S	S	.	.	H	α-helix	trans	-60.4	-43.6	172.2	176.5	-163	-60.9	-72.9	-2.3	110.8	V528 E529 L535 S536 G562 L563	V528-R532 VanDerWaalsContact O-CB 3.26Å; V528-R532 WeakPolarHBondContact O-CB 3.37Å; V528-R532 PolarHBondContact O-N 2.68Å; E529-R532 WeakPolarHBondContact O-CB 3.46Å; E529-R532 PolarHBondContact O-N 2.97Å; R532-L535 PolarHBondContact O-N 2.78Å; R532-S536 WeakPolarHBondContact O-CA 3.39Å; R532-S536 VanDerWaalsContact O-CB 3.26Å; R532-S536 WeakPolarHBondContact O-CB 3.42Å; R532-S536 PolarHBondContact O-N 2.81Å; R532-G562 PolarHBondContact NH1-O 2.89Å; R532-G562 PolarHBondContact NH2-O 3.38Å; R532-L563 HydrophobicContact CB-CD2 4.45Å; R532-L563 PolarHBondContact NH1-O 3.46Å
533	E	91.1	Very high	87.7	Confident	119 Å²	119	61.7 Å²	61.7	56%	0.556	30%	0.297	S	S	*	.	H	α-helix	trans	-57.5	-51.7	178.3	-165.7	-155.2	123.7	0	0	110.8	E529 E530 L531 L535 S536 P537	E529-E533 PolarHBondContact O-N 2.88Å; E530-E533 WeakPolarHBondContact O-CB 3.49Å; E530-E533 PolarHBondContact O-N 3.34Å; L531-E533 VanDerWaalsContact C-N 3.34Å; E533-L535 VanDerWaalsContact C-N 3.29Å; E533-L535 PolarHBondContact O-N 2.83Å; E533-S536 PolarHBondContact O-N 2.86Å; E533-S536 PolarHBondContact O-OG 2.91Å; E533-P537 WeakPolarHBondContact O-CD 3.24Å
534	I	91.6	Very high	88.5	Confident	9 Å²	9	58.2 Å²	58.2	5%	0.046	29%	0.289	C	S	.	.	H	α-helix	trans	-57.3	-40.2	178.2	-68.3	164.2	0	0	0	112.1	W492 Q496 L497 E530 L531 P537	W492-I534 HydrophobicContact CE3-CG2 4.49Å; W492-I534 HydrophobicContact CZ3-CG2 3.85Å; Q496-I534 HydrophobicContact CB-CG2 4.36Å; L497-I534 HydrophobicContact CB-CD1 3.77Å; L497-I534 HydrophobicContact CD1-CD1 4.05Å; L497-I534 HydrophobicContact CG-CD1 4.41Å; E530-I534 WeakPolarHBondContact O-CG1 3.29Å; E530-I534 PolarHBondContact O-N 2.91Å; L531-I534 PolarHBondContact O-N 2.85Å; I534-P537 WeakPolarHBondContact O-CD 3.46Å
535	L	93.1	Very high	89.1	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-87.5	-20.2	-176.4	-65.7	-178.4	0	0	0	114.1	V489 V490 L531 R532 E533 P537 L538 L539 L563	V489-L535 HydrophobicContact CG1-CD2 3.77Å; V489-L535 WeakPolarHBondContact O-CD2 3.35Å; V490-L535 HydrophobicContact CG2-CD1 4.09Å; L531-L535 HydrophobicContact CD1-CD1 3.85Å; L531-L535 HydrophobicContact CD1-CG 4.07Å; L531-L535 HydrophobicContact CG-CD1 3.93Å; L531-L535 HydrophobicContact CG-CG 4.45Å; L531-L535 WeakPolarHBondContact O-CB 3.42Å; L531-L535 VanDerWaalsContact O-CG 3.27Å; L531-L535 WeakPolarHBondContact O-CG 3.44Å; L531-L535 PolarHBondContact O-N 3.37Å; R532-L535 PolarHBondContact O-N 2.78Å; E533-L535 VanDerWaalsContact C-N 3.29Å; E533-L535 PolarHBondContact O-N 2.83Å; L535-P537 VanDerWaalsContact C-CD 3.41Å; L535-L538 PolarHBondContact O-N 3.34Å; L535-L539 HydrophobicContact CB-CD1 3.86Å; L535-L539 HydrophobicContact CB-CG 3.99Å; L535-L539 WeakPolarHBondContact O-CG 3.49Å; L535-L539 PolarHBondContact O-N 2.68Å; L535-L563 HydrophobicContact CD1-CD1 4.26Å
536	S	91.3	Very high	89.7	Confident	63 Å²	63	51.8 Å²	51.8	44%	0.441	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-35	-177.2	67.8	0	0	0	0	116	R532 E533 L538 P540	R532-S536 WeakPolarHBondContact O-CA 3.39Å; R532-S536 VanDerWaalsContact O-CB 3.26Å; R532-S536 WeakPolarHBondContact O-CB 3.42Å; R532-S536 PolarHBondContact O-N 2.81Å; E533-S536 PolarHBondContact O-N 2.86Å; E533-S536 PolarHBondContact O-OG 2.91Å; S536-L538 VanDerWaalsContact C-N 3.35Å; S536-P540 WeakPolarHBondContact O-CD 3.46Å; S536-P540 WeakPolarHBondContact O-CG 3.28Å
537	P	92.6	Very high	89.9	Confident	38 Å²	38	51.5 Å²	51.5	25%	0.247	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-15.3	173.5	30.5	-36.8	0	0	0	114.4	K466 L470 E533 I534 L535 F541	K466-P537 HydrophobicContact CD-CG 3.92Å; L470-P537 WeakPolarHBondContact CD1-O 3.48Å; E533-P537 WeakPolarHBondContact O-CD 3.24Å; I534-P537 WeakPolarHBondContact O-CD 3.46Å; L535-P537 VanDerWaalsContact C-CD 3.41Å; P537-F541 WeakPolarHBondContact O-CD2 3.41Å; P537-F541 WeakPolarHBondContact O-CE2 3.47Å
538	L	93.3	Very high	89.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-43.2	-176.3	-58.5	-178.9	0	0	0	112.5	K466 L469 L470 I473 V489 W492 L535 S536 P540 F541	K466-L538 HydrophobicContact CG-CD2 4.49Å; L469-L538 HydrophobicContact CD2-CD1 3.9Å; L469-L538 HydrophobicContact CG-CD1 4.4Å; L470-L538 HydrophobicContact CB-CD2 3.72Å; L470-L538 HydrophobicContact CD1-CD2 4.09Å; L470-L538 HydrophobicContact CG-CD2 4.46Å; I473-L538 HydrophobicContact CD1-CD2 4.44Å; V489-L538 HydrophobicContact CG1-CB 4.04Å; V489-L538 HydrophobicContact CG1-CD1 3.99Å; W492-L538 HydrophobicContact CE3-CD1 3.76Å; W492-L538 HydrophobicContact CH2-CD1 4.41Å; W492-L538 HydrophobicContact CZ3-CD1 3.6Å; L535-L538 PolarHBondContact O-N 3.34Å; S536-L538 VanDerWaalsContact C-N 3.35Å; L538-P540 VanDerWaalsContact C-CD 3.4Å; L538-F541 PolarHBondContact O-N 2.89Å; L538-F541 VanDerWaalsContact O-N 3.16Å
539	L	90.8	Very high	89.8	Confident	20 Å²	20	47.1 Å²	47.1	11%	0.105	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-55.9	-36.7	-174.4	-66.3	173.5	0	0	0	115.2	L486 L535 F541 I542 L563 I564	L486-L539 HydrophobicContact CD1-CD2 3.93Å; L535-L539 HydrophobicContact CB-CD1 3.86Å; L535-L539 HydrophobicContact CB-CG 3.99Å; L535-L539 WeakPolarHBondContact O-CG 3.49Å; L535-L539 PolarHBondContact O-N 2.68Å; L539-F541 PolarHBondContact O-N 3.23Å; L539-F541 VanDerWaalsContact O-N 3.08Å; L539-I542 HydrophobicContact CD2-CD1 3.97Å; L539-I542 PolarHBondContact O-N 3.01Å; L539-I542 VanDerWaalsContact O-N 3.13Å; L539-L563 HydrophobicContact CD1-CB 4.34Å; L539-L563 VanDerWaalsContact CD1-O 3.32Å; L539-L563 WeakPolarHBondContact CD1-O 3.43Å; L539-I564 HydrophobicContact CD1-CG1 4.48Å; L539-I564 HydrophobicContact CD2-CG1 4.34Å
540	P	90.2	Very high	89.2	Confident	98 Å²	98	44.5 Å²	44.5	64%	0.636	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-62.6	-14	178.8	-25.3	36	0	0	0	115.4	S536 L538	S536-P540 WeakPolarHBondContact O-CD 3.46Å; S536-P540 WeakPolarHBondContact O-CG 3.28Å; L538-P540 VanDerWaalsContact C-CD 3.4Å
541	F	90.6	Very high	88.8	Confident	80 Å²	80	47.9 Å²	47.9	35%	0.351	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-98.7	2.5	180	-59	-78.4	0	0	0	113.2	L470 I473 Q474 P537 L538 L539 R596	L470-F541 HydrophobicContact CD1-CD2 3.53Å; L470-F541 HydrophobicContact CD1-CE2 3.55Å; L470-F541 HydrophobicContact CD1-CG 4.37Å; L470-F541 HydrophobicContact CD1-CZ 4.39Å; I473-F541 HydrophobicContact CG2-CB 3.82Å; Q474-F541 HydrophobicContact CG-CD1 3.62Å; Q474-F541 HydrophobicContact CG-CD2 4.47Å; Q474-F541 HydrophobicContact CG-CE1 3.8Å; Q474-F541 HydrophobicContact CG-CG 3.99Å; Q474-F541 HydrophobicContact CG-CZ 4.31Å; Q474-F541 VanDerWaalsContact NE2-CZ 3.29Å; P537-F541 WeakPolarHBondContact O-CD2 3.41Å; P537-F541 WeakPolarHBondContact O-CE2 3.47Å; L538-F541 PolarHBondContact O-N 2.89Å; L538-F541 VanDerWaalsContact O-N 3.16Å; L539-F541 PolarHBondContact O-N 3.23Å; L539-F541 VanDerWaalsContact O-N 3.08Å; F541-R596 PolarHBondContact O-NH2 3.3Å
542	I	91.1	Very high	88.5	Confident	13 Å²	13	48 Å²	48	7%	0.067	26%	0.257	C	S	.	.	S	Bend	trans	-94.3	129.8	175.9	-53.5	-175.7	0	0	0	109.1	I473 I485 L486 V489 L539 T544	I473-I542 HydrophobicContact CG2-CG1 4.23Å; I485-I542 HydrophobicContact CG2-CD1 4.22Å; I485-I542 HydrophobicContact CG2-CG1 4.13Å; L486-I542 HydrophobicContact CB-CD1 4.34Å; L486-I542 HydrophobicContact CB-CG2 4.21Å; L486-I542 HydrophobicContact CD1-CD1 3.92Å; V489-I542 HydrophobicContact CB-CD1 4.28Å; V489-I542 HydrophobicContact CG1-CD1 4.23Å; V489-I542 HydrophobicContact CG2-CD1 4.32Å; L539-I542 HydrophobicContact CD2-CD1 3.97Å; L539-I542 PolarHBondContact O-N 3.01Å; L539-I542 VanDerWaalsContact O-N 3.13Å; I542-T544 PolarHBondContact O-N 3.02Å
543	R	89.8	Confident	88.4	Confident	31 Å²	31	50.5 Å²	50.5	12%	0.117	28%	0.277	C	S	.	.			trans	-94.3	86	-167.9	-52.6	173.3	-167.7	-176.5	3.5	109.1	D476 E482 E545 H546 I547 V593 R594	D476-R543 IonicContact OD1-CZ 2.68Å; D476-R543 IonicContact OD1-NH1 3.89Å; D476-R543 PolarHBondContact OD1-NH1 3.2Å; D476-R543 IonicContact OD1-NH2 2.98Å; D476-R543 PolarHBondContact OD1-NH2 2.96Å; E482-R543 HydrophobicContact CG-CB 4.08Å; E482-R543 WeakPolarHBondContact OE1-CD 3.49Å; E482-R543 IonicContact OE1-NE 3.42Å; E482-R543 PolarHBondContact OE2-N 3.08Å; R543-E545 PolarHBondContact O-N 2.76Å; R543-H546 HydrophobicContact CB-CB 4.09Å; R543-H546 PolarHBondContact O-N 3.22Å; R543-I547 PolarHBondContact O-N 2.81Å; R543-V593 HydrophobicContact CG-CG1 4.1Å; R543-R594 PolarHBondContact NH1-O 3.35Å
544	T	86.6	Confident	88.3	Confident	47 Å²	47	46.4 Å²	46.4	29%	0.288	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-53	-40.7	-174.3	50.4	0	0	0	0	113.1	I542 H546 I547 L555 I564	I542-T544 PolarHBondContact O-N 3.02Å; T544-H546 PolarHBondContact O-N 3.13Å; T544-I547 WeakPolarHBondContact O-CB 3.48Å; T544-I547 PolarHBondContact O-N 3.24Å; T544-I547 VanDerWaalsContact O-N 3.16Å; T544-L555 HydrophobicContact CG2-CD1 4.44Å; T544-I564 HydrophobicContact CG2-CD1 4.4Å
545	E	83.9	Confident	88.1	Confident	132 Å²	132	47.4 Å²	47.4	62%	0.617	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-70.6	-12.1	-179.8	-46.7	-47.3	109.4	0	0	113.9	R543 A582 W583	R543-E545 PolarHBondContact O-N 2.76Å; E545-A582 HydrophobicContact CB-CB 3.82Å; E545-W583 PolarHBondContact O-NE1 3.23Å
546	H	89	Confident	87.8	Confident	7 Å²	7	48.9 Å²	48.9	3%	0.032	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-104.5	5.8	176.4	-55.3	157	0	0	0	112.8	E482 R543 T544 L548 A582 W583 V593 R594	E482-H546 HydrophobicContact CG-CB 3.95Å; R543-H546 HydrophobicContact CB-CB 4.09Å; R543-H546 PolarHBondContact O-N 3.22Å; T544-H546 PolarHBondContact O-N 3.13Å; H546-L548 PolarHBondContact O-N 3.45Å; H546-A582 PolarHBondContact NE2-O 2.77Å; H546-W583 VanDerWaalsContact CA-CZ2 3.47Å; H546-W583 HydrophobicContact CB-CH2 4.02Å; H546-W583 HydrophobicContact CB-CZ2 3.8Å; H546-W583 AromaticContact CD2-CD2 3.82Å; H546-W583 AromaticContact CD2-CE2 3.67Å; H546-W583 AromaticContact CD2-NE1 3.75Å; H546-V593 PolarHBondContact CE1-O 2.99Å; H546-V593 VanDerWaalsContact CE1-O 3.25Å; H546-R594 PolarHBondContact CE1-O 3.18Å
547	I	89.3	Confident	87.7	Confident	7 Å²	7	48.2 Å²	48.2	4%	0.036	27%	0.268	C	S	.	.			trans	-71.9	116.8	174.3	-67.5	173.6	0	0	0	109.9	E482 Q483 L486 R543 T544 L555	E482-I547 HydrophobicContact CB-CB 4.49Å; E482-I547 HydrophobicContact CB-CG1 3.54Å; Q483-I547 HydrophobicContact CB-CG2 4.26Å; L486-I547 HydrophobicContact CD2-CD1 3.95Å; R543-I547 PolarHBondContact O-N 2.81Å; T544-I547 WeakPolarHBondContact O-CB 3.48Å; T544-I547 PolarHBondContact O-N 3.24Å; T544-I547 VanDerWaalsContact O-N 3.16Å; I547-L555 HydrophobicContact CD1-CB 4.33Å; I547-L555 HydrophobicContact CD1-CD1 3.98Å; I547-L555 HydrophobicContact CD1-CD2 4.12Å; I547-L555 HydrophobicContact CD1-CG 4.37Å
548	L	87.3	Confident	87.5	Confident	9 Å²	9	46.5 Å²	46.5	5%	0.047	26%	0.257	C	S	.	.	S	Bend	trans	-110.4	139.6	170.2	-56.7	179.2	0	0	0	110.4	Q85 M86 L89 Q483 H546 W583 Y601	Q85-L548 HydrophobicContact CB-CB 4.02Å; Q85-L548 HydrophobicContact CB-CD1 4.32Å; Q85-L548 HydrophobicContact CG-CB 4.42Å; M86-L548 HydrophobicContact SD-CD1 4.1Å; L89-L548 HydrophobicContact CB-CD1 4.18Å; L89-L548 HydrophobicContact CB-CD2 4.15Å; L89-L548 HydrophobicContact CD1-CD2 4.25Å; L89-L548 HydrophobicContact CD2-CD1 4.04Å; L89-L548 HydrophobicContact CD2-CD2 4.23Å; L89-L548 HydrophobicContact CG-CD2 4.43Å; Q483-L548 PolarHBondContact OE1-O 3.49Å; Q483-L548 VanDerWaalsContact OE1-O 3.13Å; H546-L548 PolarHBondContact O-N 3.45Å; L548-W583 HydrophobicContact CD1-CH2 4.07Å; L548-W583 HydrophobicContact CD1-CZ2 4.2Å; L548-W583 HydrophobicContact CD2-CZ2 4.08Å; L548-W583 HydrophobicContact CG-CH2 4.28Å; L548-W583 HydrophobicContact CG-CZ2 4.05Å; L548-Y601 HydrophobicContact CD1-CE1 4.37Å; L548-Y601 HydrophobicContact CD1-CE2 4.2Å
549	P	85.5	Confident	87.2	Confident	29 Å²	29	49.4 Å²	49.4	19%	0.188	27%	0.273	C	S	.	.	S	Bend	cis	-74.6	158.6	-5.3	36.4	-36.9	0	0	0	111.2	N551 S552	P549-N551 WeakPolarHBondContact CB-OD1 3.25Å; P549-N551 PolarHBondContact O-N 3Å; P549-N551 VanDerWaalsContact O-N 3.13Å; P549-S552 VanDerWaalsContact O-CB 3.32Å; P549-S552 WeakPolarHBondContact O-CB 3.46Å; P549-S552 PolarHBondContact O-N 3.31Å
550	P	75.9	Confident	87	Confident	96 Å²	96	56.8 Å²	56.8	62%	0.623	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.9	-175.3	26	-35.7	0	0	0	114	S552	P550-S552 VanDerWaalsContact C-N 3.34Å
551	N	80	Confident	86.8	Confident	123 Å²	123	54.2 Å²	54.2	66%	0.658	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	31.1	172.8	65.7	-33.3	0	0	0	112.8	P549 D553	P549-N551 WeakPolarHBondContact CB-OD1 3.25Å; P549-N551 PolarHBondContact O-N 3Å; P549-N551 VanDerWaalsContact O-N 3.13Å; N551-D553 PolarHBondContact O-N 2.94Å
552	S	86.3	Confident	86.5	Confident	4 Å²	4	51.6 Å²	51.6	3%	0.028	28%	0.277	C	S	.	.			trans	-59.8	121.2	-175.5	-172.5	0	0	0	0	113.3	Q483 P549 P550 V554 L555 A556	Q483-S552 WeakPolarHBondContact CG-OG 3.49Å; Q483-S552 PolarHBondContact NE2-OG 3.47Å; P549-S552 VanDerWaalsContact O-CB 3.32Å; P549-S552 WeakPolarHBondContact O-CB 3.46Å; P549-S552 PolarHBondContact O-N 3.31Å; P550-S552 VanDerWaalsContact C-N 3.34Å; S552-V554 PolarHBondContact O-N 2.83Å; S552-V554 VanDerWaalsContact O-N 3.13Å; S552-V554 PolarHBondContact OG-N 3.37Å; S552-L555 PolarHBondContact O-N 2.98Å; S552-L555 VanDerWaalsContact O-N 3.12Å; S552-A556 PolarHBondContact O-N 3.38Å
553	D	88	Confident	86.1	Confident	136 Å²	136	51.2 Å²	51.2	73%	0.727	28%	0.275	S	S	*	.	H	α-helix	trans	-56.1	-28.1	172.9	-66.3	-61.3	0	0	0	113.1	N551 A556 D557	N551-D553 PolarHBondContact O-N 2.94Å; D553-A556 PolarHBondContact O-N 3.12Å; D553-D557 WeakPolarHBondContact O-CB 3.44Å; D553-D557 PolarHBondContact O-N 2.92Å
554	V	88.5	Confident	85.7	Confident	33 Å²	33	51 Å²	51	20%	0.2	28%	0.276	C	S	.	.	H	α-helix	trans	-68.5	-45.8	178.3	-179.6	0	0	0	0	110.7	Q483 L486 K487 S552 A556 D557 A558	Q483-V554 HydrophobicContact CG-CB 4.3Å; Q483-V554 HydrophobicContact CG-CG2 4.04Å; L486-V554 HydrophobicContact CB-CG1 4.24Å; L486-V554 HydrophobicContact CD2-CG1 4.03Å; L486-V554 HydrophobicContact CG-CG1 3.94Å; K487-V554 HydrophobicContact CB-CG1 3.79Å; K487-V554 HydrophobicContact CB-CG2 4.29Å; S552-V554 PolarHBondContact O-N 2.83Å; S552-V554 VanDerWaalsContact O-N 3.13Å; S552-V554 PolarHBondContact OG-N 3.37Å; V554-A556 VanDerWaalsContact C-N 3.33Å; V554-D557 PolarHBondContact O-N 3.2Å; V554-A558 WeakPolarHBondContact O-CB 3.32Å; V554-A558 PolarHBondContact O-N 3Å
555	L	87.2	Confident	84.9	Confident	30 Å²	30	53.5 Å²	53.5	16%	0.157	30%	0.296	C	S	.	.	H	α-helix	trans	-66.6	-39.8	175.4	-178.8	58.7	0	0	0	110.2	L486 T544 I547 S552 A558 L559 I564	L486-L555 HydrophobicContact CD2-CB 4.38Å; L486-L555 HydrophobicContact CD2-CD1 4.12Å; T544-L555 HydrophobicContact CG2-CD1 4.44Å; I547-L555 HydrophobicContact CD1-CB 4.33Å; I547-L555 HydrophobicContact CD1-CD1 3.98Å; I547-L555 HydrophobicContact CD1-CD2 4.12Å; I547-L555 HydrophobicContact CD1-CG 4.37Å; S552-L555 PolarHBondContact O-N 2.98Å; S552-L555 VanDerWaalsContact O-N 3.12Å; L555-A558 PolarHBondContact O-N 3.42Å; L555-L559 HydrophobicContact CD1-CD1 4.08Å; L555-L559 HydrophobicContact CD1-CG 4.19Å; L555-L559 HydrophobicContact CG-CD1 3.95Å; L555-L559 HydrophobicContact CG-CG 4.48Å; L555-L559 WeakPolarHBondContact O-CB 3.49Å; L555-L559 VanDerWaalsContact O-CG 3.26Å; L555-L559 WeakPolarHBondContact O-CG 3.25Å; L555-L559 PolarHBondContact O-N 3.43Å; L555-I564 HydrophobicContact CD1-CD1 3.84Å
556	A	87.3	Confident	83.7	Confident	30 Å²	30	51.7 Å²	51.7	25%	0.248	29%	0.293	C	S	.	.	H	α-helix	trans	-64.8	-38.1	175.4	0	0	0	0	0	113.3	S552 D553 V554 K560	S552-A556 PolarHBondContact O-N 3.38Å; D553-A556 PolarHBondContact O-N 3.12Å; V554-A556 VanDerWaalsContact C-N 3.33Å; A556-K560 VanDerWaalsContact O-CB 3.28Å; A556-K560 WeakPolarHBondContact O-CB 3.34Å; A556-K560 VanDerWaalsContact O-CD 3.3Å; A556-K560 WeakPolarHBondContact O-CD 3.5Å; A556-K560 WeakPolarHBondContact O-CG 3.26Å; A556-K560 PolarHBondContact O-N 3.03Å
557	D	88.6	Confident	81.9	Confident	49 Å²	49	54.6 Å²	54.6	26%	0.262	31%	0.313	S	S	.	.	H	α-helix	trans	-63.7	-47.9	172.5	-174.7	51	0	0	0	110.7	R523 D553 V554 L559 K560 R561	R523-D557 IonicContact CZ-OD2 3.89Å; R523-D557 VanDerWaalsContact CZ-OD2 3.31Å; R523-D557 IonicContact NH1-OD1 2.93Å; R523-D557 IonicContact NH1-OD2 2.87Å; R523-D557 PolarHBondContact NH1-OD2 3.23Å; R523-D557 IonicContact NH2-OD2 3.19Å; R523-D557 PolarHBondContact NH2-OD2 3.41Å; D553-D557 WeakPolarHBondContact O-CB 3.44Å; D553-D557 PolarHBondContact O-N 2.92Å; V554-D557 PolarHBondContact O-N 3.2Å; D557-L559 PolarHBondContact O-N 2.95Å; D557-K560 PolarHBondContact O-N 3.39Å; D557-R561 WeakPolarHBondContact O-CB 3.14Å; D557-R561 VanDerWaalsContact O-CG 3.29Å; D557-R561 WeakPolarHBondContact O-CG 3.49Å; D557-R561 PolarHBondContact O-N 2.96Å; D557-R561 WeakPolarHBondContact OD1-CD 3.43Å; D557-R561 IonicContact OD2-NH1 3.34Å
558	A	87.9	Confident	79.9	Confident	2 Å²	2	58 Å²	58	2%	0.017	34%	0.336	C	S	.	.	H	α-helix	trans	-60.7	-41.4	178.8	0	0	0	0	0	112.6	L486 V554 L555 G562 L563 I564	L486-A558 HydrophobicContact CD1-CB 4.4Å; L486-A558 HydrophobicContact CD2-CB 4.19Å; V554-A558 WeakPolarHBondContact O-CB 3.32Å; V554-A558 PolarHBondContact O-N 3Å; L555-A558 PolarHBondContact O-N 3.42Å; A558-G562 PolarHBondContact O-N 3.3Å; A558-L563 PolarHBondContact O-N 3.06Å; A558-I564 HydrophobicContact CB-CD1 3.99Å; A558-I564 HydrophobicContact CB-CG1 4.38Å
559	L	86.7	Confident	77.9	Confident	61 Å²	61	62.2 Å²	62.2	32%	0.319	37%	0.366	S	S	.	.	H	α-helix	trans	-72.7	-39.8	177	-69	171.8	0	0	0	112.9	L555 D557 R561 G562 I564 T566	L555-L559 HydrophobicContact CD1-CD1 4.08Å; L555-L559 HydrophobicContact CD1-CG 4.19Å; L555-L559 HydrophobicContact CG-CD1 3.95Å; L555-L559 HydrophobicContact CG-CG 4.48Å; L555-L559 WeakPolarHBondContact O-CB 3.49Å; L555-L559 VanDerWaalsContact O-CG 3.26Å; L555-L559 WeakPolarHBondContact O-CG 3.25Å; L555-L559 PolarHBondContact O-N 3.43Å; D557-L559 PolarHBondContact O-N 2.95Å; L559-R561 VanDerWaalsContact C-N 3.31Å; L559-R561 PolarHBondContact O-N 3.46Å; L559-G562 VanDerWaalsContact O-CA 3.31Å; L559-G562 WeakPolarHBondContact O-CA 3.26Å; L559-G562 PolarHBondContact O-N 2.74Å; L559-I564 HydrophobicContact CD2-CB 3.98Å; L559-I564 HydrophobicContact CD2-CG2 4.13Å; L559-T566 HydrophobicContact CD2-CG2 3.49Å; L559-T566 VanDerWaalsContact CD2-CG2 3.49Å
560	K	86.7	Confident	75.7	Confident	175 Å²	175	68.5 Å²	68.5	76%	0.761	40%	0.398	S	S	*	.	H	α-helix	trans	-65.8	-33.5	175.7	-74.4	165.6	-171.2	169.3	0	112.6	A556 D557 G562	A556-K560 VanDerWaalsContact O-CB 3.28Å; A556-K560 WeakPolarHBondContact O-CB 3.34Å; A556-K560 VanDerWaalsContact O-CD 3.3Å; A556-K560 WeakPolarHBondContact O-CD 3.5Å; A556-K560 WeakPolarHBondContact O-CG 3.26Å; A556-K560 PolarHBondContact O-N 3.03Å; D557-K560 PolarHBondContact O-N 3.39Å; K560-G562 PolarHBondContact O-N 3.25Å
561	R	86.5	Confident	74.3	Confident	44 Å²	44	71.1 Å²	71.1	17%	0.166	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	1.3	170.1	-63.9	169.7	71.3	-167	8.4	112.4	E494 R523 V528 D557 L559 L563	E494-R561 IonicContact OE1-CZ 2.8Å; E494-R561 VanDerWaalsContact OE1-CZ 3.22Å; E494-R561 IonicContact OE1-NH1 3.8Å; E494-R561 PolarHBondContact OE1-NH1 2.86Å; E494-R561 IonicContact OE1-NH2 3.43Å; E494-R561 PolarHBondContact OE1-NH2 2.88Å; R523-R561 VanDerWaalsContact CZ-NH1 3.33Å; V528-R561 VanDerWaalsContact CG1-O 3.24Å; V528-R561 WeakPolarHBondContact CG1-O 3.37Å; D557-R561 WeakPolarHBondContact O-CB 3.14Å; D557-R561 VanDerWaalsContact O-CG 3.29Å; D557-R561 WeakPolarHBondContact O-CG 3.49Å; D557-R561 PolarHBondContact O-N 2.96Å; D557-R561 WeakPolarHBondContact OD1-CD 3.43Å; D557-R561 IonicContact OD2-NH1 3.34Å; L559-R561 VanDerWaalsContact C-N 3.31Å; L559-R561 PolarHBondContact O-N 3.46Å; R561-L563 HydrophobicContact CB-CD1 4.31Å; R561-L563 HydrophobicContact CB-CG 3.98Å; R561-L563 PolarHBondContact O-N 2.88Å; R561-L563 VanDerWaalsContact O-N 3.07Å
562	G	83.9	Confident	73	Confident	25 Å²	25	69.7 Å²	69.7	26%	0.258	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	8.5	179.3	0	0	0	0	0	115.3	R532 A558 L559 K560 I564	R532-G562 PolarHBondContact NH1-O 2.89Å; R532-G562 PolarHBondContact NH2-O 3.38Å; A558-G562 PolarHBondContact O-N 3.3Å; L559-G562 VanDerWaalsContact O-CA 3.31Å; L559-G562 WeakPolarHBondContact O-CA 3.26Å; L559-G562 PolarHBondContact O-N 2.74Å; K560-G562 PolarHBondContact O-N 3.25Å; G562-I564 VanDerWaalsContact C-N 3.28Å; G562-I564 PolarHBondContact O-N 2.88Å
563	L	84.3	Confident	71.1	Confident	5 Å²	5	75.2 Å²	75.2	3%	0.026	43%	0.431	C	S	.	.			trans	-58.9	-41.5	-172	-64.4	175.7	0	0	0	111.3	V490 V528 L531 R532 L535 L539 A558 R561	V490-L563 HydrophobicContact CG1-CD1 4.4Å; V490-L563 HydrophobicContact CG2-CD1 4.16Å; V528-L563 HydrophobicContact CG1-CD2 4.19Å; L531-L563 HydrophobicContact CD2-CD1 4.45Å; L531-L563 HydrophobicContact CD2-CD2 4.27Å; L531-L563 HydrophobicContact CG-CD2 4.25Å; R532-L563 HydrophobicContact CB-CD2 4.45Å; R532-L563 PolarHBondContact NH1-O 3.46Å; L535-L563 HydrophobicContact CD1-CD1 4.26Å; L539-L563 HydrophobicContact CD1-CB 4.34Å; L539-L563 VanDerWaalsContact CD1-O 3.32Å; L539-L563 WeakPolarHBondContact CD1-O 3.43Å; A558-L563 PolarHBondContact O-N 3.06Å; R561-L563 HydrophobicContact CB-CD1 4.31Å; R561-L563 HydrophobicContact CB-CG 3.98Å; R561-L563 PolarHBondContact O-N 2.88Å; R561-L563 VanDerWaalsContact O-N 3.07Å
564	I	81.4	Confident	68.8	Low	28 Å²	28	74.6 Å²	74.6	14%	0.144	43%	0.432	C	S	.	.	S	Bend	trans	-92	122.4	171.2	-61.5	169.8	0	0	0	108.5	L486 L539 T544 L555 A558 L559 G562 T566	L486-I564 HydrophobicContact CD1-CD1 3.96Å; L486-I564 HydrophobicContact CD2-CD1 4.04Å; L539-I564 HydrophobicContact CD1-CG1 4.48Å; L539-I564 HydrophobicContact CD2-CG1 4.34Å; T544-I564 HydrophobicContact CG2-CD1 4.4Å; L555-I564 HydrophobicContact CD1-CD1 3.84Å; A558-I564 HydrophobicContact CB-CD1 3.99Å; A558-I564 HydrophobicContact CB-CG1 4.38Å; L559-I564 HydrophobicContact CD2-CB 3.98Å; L559-I564 HydrophobicContact CD2-CG2 4.13Å; G562-I564 VanDerWaalsContact C-N 3.28Å; G562-I564 PolarHBondContact O-N 2.88Å; I564-T566 PolarHBondContact O-N 3Å
565	S	68.4	Low	66.7	Low	99 Å²	99	77.9 Å²	77.9	69%	0.692	46%	0.463	S	S	*	.			trans	-80.7	89.2	175.1	-57.8	0	0	0	0	111
566	T	58.2	Low	64.5	Low	93 Å²	93	85.4 Å²	85.4	57%	0.571	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-64.1	133.1	166.9	36.7	0	0	0	0	110.6	L559 I564	L559-T566 HydrophobicContact CD2-CG2 3.49Å; L559-T566 VanDerWaalsContact CD2-CG2 3.49Å; I564-T566 PolarHBondContact O-N 3Å
567	P	52.8	Low	62.7	Low	68 Å²	68	86.1 Å²	86.1	44%	0.442	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-63.1	157.2	166.3	30.3	-35.1	0	0	0	110	L572	P567-L572 HydrophobicContact CG-CD2 3.85Å; P567-L572 HydrophobicContact CG-CG 4.5Å
568	P	46.3	Very low	61.1	Low	79 Å²	79	86 Å²	86	51%	0.513	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-56	144	177.1	-24.3	34.5	0	0	0	111.9	D570 M571	P568-D570 PolarHBondContact O-N 2.86Å; P568-M571 WeakPolarHBondContact O-CB 3.5Å; P568-M571 PolarHBondContact O-N 3.41Å
569	S	44.8	Very low	59.7	Low	97 Å²	97	92.8 Å²	92.8	68%	0.678	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-54.9	-30.3	-178	-51.6	0	0	0	0	113.4	M571 L572	S569-M571 PolarHBondContact O-N 3.15Å; S569-L572 PolarHBondContact O-N 2.7Å; S569-L572 VanDerWaalsContact O-N 3.15Å
570	D	41.1	Very low	58.4	Low	161 Å²	161	90.4 Å²	90.4	86%	0.861	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-70.6	-10	178.2	-48.8	-40.9	0	0	0	113.7	P568	P568-D570 PolarHBondContact O-N 2.86Å
571	M	44.6	Very low	57.6	Low	151 Å²	151	84.3 Å²	84.3	74%	0.744	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-103.9	-6	173.3	-64	-169.4	69.9	0	0	113.3	P568 S569	P568-M571 WeakPolarHBondContact O-CB 3.5Å; P568-M571 PolarHBondContact O-N 3.41Å; S569-M571 PolarHBondContact O-N 3.15Å
572	L	52.9	Low	57.1	Low	93 Å²	93	83.9 Å²	83.9	49%	0.487	52%	0.518	S	S	.	.	S	Bend	trans	-82.1	139.3	171.7	-64.3	175.9	0	0	0	109.2	P567 S569 T574	P567-L572 HydrophobicContact CG-CD2 3.85Å; P567-L572 HydrophobicContact CG-CG 4.5Å; S569-L572 PolarHBondContact O-N 2.7Å; S569-L572 VanDerWaalsContact O-N 3.15Å; L572-T574 PolarHBondContact O-N 3.13Å
573	P	47	Very low	57.1	Low	120 Å²	120	83.1 Å²	83.1	78%	0.779	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-61.9	134.9	176.5	26.3	-33.6	0	0	0	110.2	A575	P573-A575 PolarHBondContact O-N 3.19Å
574	T	40.5	Very low	57.1	Low	123 Å²	123	83.4 Å²	83.4	76%	0.755	51%	0.508	S	S	*	.	P	Polyproline II helix	trans	-54.4	137.2	177.4	38	0	0	0	0	111.3	L572 E576	L572-T574 PolarHBondContact O-N 3.13Å; T574-E576 PolarHBondContact O-N 3.42Å
575	A	44.8	Very low	56.8	Low	103 Å²	103	87.4 Å²	87.4	85%	0.851	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	35.7	-165.4	0	0	0	0	0	116	P573	P573-A575 PolarHBondContact O-N 3.19Å
576	E	40.7	Very low	56.8	Low	188 Å²	188	86 Å²	86	88%	0.879	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-12.6	169.3	-58	-164.4	158.3	0	0	112.2	T574	T574-E576 PolarHBondContact O-N 3.42Å
577	G	48.4	Very low	56.7	Low	45 Å²	45	91 Å²	91	46%	0.464	52%	0.518	S	S	.	.	S	Bend	trans	-76.3	117.7	164.4	0	0	0	0	0	111.1	N581	G577-N581 WeakPolarHBondContact CA-ND2 3.42Å
578	G	56.3	Low	56.6	Low	45 Å²	45	95.5 Å²	95.5	46%	0.464	54%	0.538	S	S	.	.			trans	-65.5	161.7	-177.1	0	0	0	0	0	114.4	A580 N581	G578-A580 PolarHBondContact O-N 3.32Å; G578-N581 VanDerWaalsContact O-CB 3.3Å; G578-N581 WeakPolarHBondContact O-CB 3.32Å; G578-N581 VanDerWaalsContact O-CG 3.23Å; G578-N581 PolarHBondContact O-N 3.38Å; G578-N581 PolarHBondContact O-OD1 3.18Å
579	K	57.5	Low	56.9	Low	146 Å²	146	93 Å²	93	64%	0.635	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-51.8	-28.3	-176.1	-64.5	-179.3	-179.3	176.8	0	114.8	N581	K579-N581 VanDerWaalsContact C-N 3.25Å; K579-N581 PolarHBondContact O-N 3.41Å
580	A	59.9	Low	57.6	Low	10 Å²	10	92.1 Å²	92.1	8%	0.083	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	-66.6	-23.7	178.6	0	0	0	0	0	113.6	W93 G578 A582 W583 L584	W93-A580 HydrophobicContact CD2-CB 4.19Å; W93-A580 HydrophobicContact CE3-CB 4.21Å; W93-A580 HydrophobicContact CH2-CB 3.82Å; W93-A580 HydrophobicContact CZ2-CB 3.79Å; W93-A580 HydrophobicContact CZ3-CB 4.02Å; G578-A580 PolarHBondContact O-N 3.32Å; A580-A582 PolarHBondContact O-N 3.46Å; A580-A582 VanDerWaalsContact O-N 3.16Å; A580-W583 PolarHBondContact O-N 3.2Å; A580-L584 HydrophobicContact CB-CD1 4.03Å; A580-L584 HydrophobicContact CB-CG 4.46Å; A580-L584 PolarHBondContact O-N 3.23Å
581	N	68.4	Low	58.7	Low	48 Å²	48	91.4 Å²	91.4	26%	0.257	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-64.1	-24.1	-171.6	-66.2	18	0	0	0	114.1	G577 G578 K579 Q586 A589	G577-N581 WeakPolarHBondContact CA-ND2 3.42Å; G578-N581 VanDerWaalsContact O-CB 3.3Å; G578-N581 WeakPolarHBondContact O-CB 3.32Å; G578-N581 VanDerWaalsContact O-CG 3.23Å; G578-N581 PolarHBondContact O-N 3.38Å; G578-N581 PolarHBondContact O-OD1 3.18Å; K579-N581 VanDerWaalsContact C-N 3.25Å; K579-N581 PolarHBondContact O-N 3.41Å; N581-Q586 PolarHBondContact ND2-OE1 2.63Å; N581-Q586 PolarHBondContact OD1-NE2 3.27Å; N581-Q586 PolarHBondContact OD1-OE1 2.82Å; N581-A589 HydrophobicContact CB-CB 4.21Å
582	A	77.1	Confident	60.4	Low	35 Å²	35	86.6 Å²	86.6	29%	0.289	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-86.8	-16.7	176.4	0	0	0	0	0	113.7	E545 H546 A580	E545-A582 HydrophobicContact CB-CB 3.82Å; H546-A582 PolarHBondContact NE2-O 2.77Å; A580-A582 PolarHBondContact O-N 3.46Å; A580-A582 VanDerWaalsContact O-N 3.16Å
583	W	84.4	Confident	61.7	Low	9 Å²	9	85.3 Å²	85.3	3%	0.034	50%	0.495	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-27.8	-176.2	-70.1	74	0	0	0	112.2	M86 L89 W93 L101 E545 H546 L548 A580 Y592 P595	M86-W583 HydrophobicContact CE-CZ3 4.37Å; L89-W583 HydrophobicContact CD2-CD2 3.84Å; L89-W583 HydrophobicContact CD2-CE3 4.11Å; L89-W583 HydrophobicContact CD2-CG 4.47Å; L89-W583 HydrophobicContact CD2-CH2 3.91Å; L89-W583 HydrophobicContact CD2-CZ2 3.61Å; L89-W583 HydrophobicContact CD2-CZ3 4.15Å; W93-W583 HydrophobicContact CH2-CB 3.99Å; W93-W583 HydrophobicContact CH2-CG 4.49Å; L101-W583 HydrophobicContact CD1-CB 4.44Å; L101-W583 HydrophobicContact CD1-CE3 4.23Å; E545-W583 PolarHBondContact O-NE1 3.23Å; H546-W583 VanDerWaalsContact CA-CZ2 3.47Å; H546-W583 HydrophobicContact CB-CH2 4.02Å; H546-W583 HydrophobicContact CB-CZ2 3.8Å; H546-W583 AromaticContact CD2-CD2 3.82Å; H546-W583 AromaticContact CD2-CE2 3.67Å; H546-W583 AromaticContact CD2-NE1 3.75Å; L548-W583 HydrophobicContact CD1-CH2 4.07Å; L548-W583 HydrophobicContact CD1-CZ2 4.2Å; L548-W583 HydrophobicContact CD2-CZ2 4.08Å; L548-W583 HydrophobicContact CG-CH2 4.28Å; L548-W583 HydrophobicContact CG-CZ2 4.05Å; A580-W583 PolarHBondContact O-N 3.2Å; W583-Y592 PolarHBondContact O-OH 3.16Å; W583-P595 HydrophobicContact CE3-CB 3.97Å; W583-P595 HydrophobicContact CE3-CG 3.83Å; W583-P595 HydrophobicContact CZ3-CB 4.12Å; W583-P595 HydrophobicContact CZ3-CG 4.48Å
584	L	83.9	Confident	63.5	Low	11 Å²	11	81.3 Å²	81.3	6%	0.058	47%	0.465	C	S	.	.	S	Bend	trans	-104.5	144.8	-178.8	-61.5	-176.9	0	0	0	113.1	W93 D97 A100 L101 A580 Q586 Y592	W93-L584 HydrophobicContact CH2-CG 4.44Å; W93-L584 HydrophobicContact CZ3-CD1 4.04Å; W93-L584 HydrophobicContact CZ3-CD2 4.32Å; W93-L584 HydrophobicContact CZ3-CG 4.12Å; D97-L584 HydrophobicContact CB-CD1 3.74Å; A100-L584 HydrophobicContact CB-CD1 4.46Å; A100-L584 HydrophobicContact CB-CD2 3.89Å; L101-L584 HydrophobicContact CB-CD2 3.88Å; A580-L584 HydrophobicContact CB-CD1 4.03Å; A580-L584 HydrophobicContact CB-CG 4.46Å; A580-L584 PolarHBondContact O-N 3.23Å; L584-Q586 VanDerWaalsContact C-N 3.28Å; L584-Q586 HydrophobicContact CB-CG 4.5Å; L584-Q586 PolarHBondContact O-N 2.9Å; L584-Y592 WeakPolarHBondContact O-CD2 3.22Å
585	R	75.4	Confident	65.9	Low	111 Å²	111	75.6 Å²	75.6	42%	0.419	43%	0.43	S	S	.	.			trans	-74.3	69.2	-177.2	-168.8	-176.9	-68	-96.9	0.9	112.9	E104 Y592	E104-R585 VanDerWaalsContact CD-NH2 3.33Å; E104-R585 IonicContact OE1-CZ 2.85Å; E104-R585 IonicContact OE1-NE 3.9Å; E104-R585 IonicContact OE1-NH2 2.69Å; E104-R585 PolarHBondContact OE1-NH2 3.49Å; E104-R585 IonicContact OE2-CZ 3.8Å; E104-R585 IonicContact OE2-NE 2.75Å; E104-R585 PolarHBondContact OE2-NE 3.23Å; E104-R585 IonicContact OE2-NH2 3.74Å; E104-R585 PolarHBondContact OE2-NH2 2.93Å; E104-R585 VanDerWaalsContact OE2-NH2 3.13Å; R585-Y592 HydrophobicContact CB-CD1 4.4Å; R585-Y592 HydrophobicContact CB-CD2 4.46Å; R585-Y592 HydrophobicContact CB-CE1 4.14Å; R585-Y592 HydrophobicContact CB-CE2 4.21Å; R585-Y592 HydrophobicContact CG-CD1 4.16Å; R585-Y592 HydrophobicContact CG-CE1 4.2Å; R585-Y592 HydrophobicContact CG-CG 4.5Å
586	Q	68.4	Low	68.2	Low	70 Å²	70	71.1 Å²	71.1	33%	0.327	39%	0.391	S	S	.	.			trans	-86.2	136.6	-179.3	-65.7	-177.2	7.1	0	0	113	N581 L584 N588 A589	N581-Q586 PolarHBondContact ND2-OE1 2.63Å; N581-Q586 PolarHBondContact OD1-NE2 3.27Å; N581-Q586 PolarHBondContact OD1-OE1 2.82Å; L584-Q586 VanDerWaalsContact C-N 3.28Å; L584-Q586 HydrophobicContact CB-CG 4.5Å; L584-Q586 PolarHBondContact O-N 2.9Å; Q586-N588 PolarHBondContact O-N 3.26Å; Q586-N588 VanDerWaalsContact O-N 3.07Å; Q586-A589 HydrophobicContact CB-CB 3.79Å; Q586-A589 PolarHBondContact O-N 3.31Å
587	K	55.2	Low	70.7	Confident	199 Å²	199	62.7 Å²	62.7	87%	0.865	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-11.3	-174.8	-70.7	169	-179	160.6	0	115.6
588	N	51.8	Low	72.9	Confident	161 Å²	161	61.3 Å²	61.3	86%	0.861	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.3	3.3	-175.6	-62.6	7.7	0	0	0	113.1	Q586	Q586-N588 PolarHBondContact O-N 3.26Å; Q586-N588 VanDerWaalsContact O-N 3.07Å
589	A	52.2	Low	74.8	Confident	26 Å²	26	61.8 Å²	61.8	22%	0.215	33%	0.329	C	S	.	.	S	Bend	trans	-104.1	82.6	-169.8	0	0	0	0	0	112.8	N581 Q586	N581-A589 HydrophobicContact CB-CB 4.21Å; Q586-A589 HydrophobicContact CB-CB 3.79Å; Q586-A589 PolarHBondContact O-N 3.31Å
590	G	58.8	Low	76.5	Confident	80 Å²	80	56.1 Å²	56.1	83%	0.825	31%	0.307	S	S	*	.	S	Bend	trans	56.1	-141.1	167	0	0	0	0	0	115.2
591	I	65.5	Low	78.2	Confident	145 Å²	145	56 Å²	56	74%	0.744	31%	0.305	S	S	*	.	S	Bend	trans	-98.1	104.5	170.1	-59.3	174.7	0	0	0	106.9	V593	I591-V593 PolarHBondContact O-N 3.31Å
592	Y	78.4	Confident	79.4	Confident	50 Å²	50	54.8 Å²	54.8	20%	0.196	30%	0.299	C	S	.	.			trans	-66.6	130.3	176.2	176.2	-104.1	0	0	0	111	E104 W583 L584 R585 R594 P595	E104-Y592 WeakPolarHBondContact CG-OH 3.49Å; W583-Y592 PolarHBondContact O-OH 3.16Å; L584-Y592 WeakPolarHBondContact O-CD2 3.22Å; R585-Y592 HydrophobicContact CB-CD1 4.4Å; R585-Y592 HydrophobicContact CB-CD2 4.46Å; R585-Y592 HydrophobicContact CB-CE1 4.14Å; R585-Y592 HydrophobicContact CB-CE2 4.21Å; R585-Y592 HydrophobicContact CG-CD1 4.16Å; R585-Y592 HydrophobicContact CG-CE1 4.2Å; R585-Y592 HydrophobicContact CG-CG 4.5Å; Y592-R594 HydrophobicContact CE1-CB 4.39Å; Y592-P595 WeakPolarHBondContact OH-CD 3.26Å
593	V	80.8	Confident	80.3	Confident	67 Å²	67	58.6 Å²	58.6	41%	0.406	31%	0.311	S	S	.	.			trans	-118.9	133.4	170	-175.1	0	0	0	0	107.8	R543 H546 I591	R543-V593 HydrophobicContact CG-CG1 4.1Å; H546-V593 PolarHBondContact CE1-O 2.99Å; H546-V593 VanDerWaalsContact CE1-O 3.25Å; I591-V593 PolarHBondContact O-N 3.31Å
594	R	85.5	Confident	80.8	Confident	35 Å²	35	58.5 Å²	58.5	13%	0.132	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-64.7	140.7	178	-174.2	157.4	69.2	169.7	-6.8	110.9	E104 T108 D476 R543 H546 Y592	E104-R594 HydrophobicContact CG-CG 4.46Å; E104-R594 VanDerWaalsContact OE1-CD 3.31Å; E104-R594 WeakPolarHBondContact OE1-CD 3.3Å; T108-R594 WeakPolarHBondContact OG1-CD 3.29Å; D476-R594 IonicContact OD1-NE 2.82Å; D476-R594 IonicContact OD2-CZ 3.69Å; D476-R594 VanDerWaalsContact OD2-CZ 3.3Å; D476-R594 IonicContact OD2-NE 3.34Å; D476-R594 PolarHBondContact OD2-NE 2.88Å; D476-R594 VanDerWaalsContact OD2-NE 3.14Å; D476-R594 IonicContact OD2-NH2 3.69Å; D476-R594 PolarHBondContact OD2-NH2 2.66Å; R543-R594 PolarHBondContact NH1-O 3.35Å; H546-R594 PolarHBondContact CE1-O 3.18Å; Y592-R594 HydrophobicContact CE1-CB 4.39Å
595	P	90.3	Very high	81.3	Confident	3 Å²	3	58 Å²	58	2%	0.019	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-66.1	146.1	167.7	-22.7	34.6	0	0	0	111.8	L101 Y105 W583 Y592	L101-P595 HydrophobicContact CD1-CG 4.12Å; Y105-P595 HydrophobicContact CE1-CB 3.89Å; W583-P595 HydrophobicContact CE3-CB 3.97Å; W583-P595 HydrophobicContact CE3-CG 3.83Å; W583-P595 HydrophobicContact CZ3-CB 4.12Å; W583-P595 HydrophobicContact CZ3-CG 4.48Å; Y592-P595 WeakPolarHBondContact OH-CD 3.26Å
596	R	92.8	Very high	82.3	Confident	9 Å²	9	55.9 Å²	55.9	3%	0.034	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-69.8	148.6	172	-71.5	-167.7	-137.4	-91.1	-6.3	111.9	Y105 I473 S475 D476 E482 F541 F598	Y105-R596 WeakPolarHBondContact CE1-O 3.47Å; I473-R596 PolarHBondContact O-NH1 3.15Å; S475-R596 PolarHBondContact O-NH1 3.27Å; D476-R596 WeakPolarHBondContact O-CA 3.34Å; E482-R596 IonicContact OE1-CZ 2.76Å; E482-R596 VanDerWaalsContact OE1-CZ 3.27Å; E482-R596 IonicContact OE1-NE 3.77Å; E482-R596 PolarHBondContact OE1-NE 3.27Å; E482-R596 IonicContact OE1-NH2 2.65Å; E482-R596 PolarHBondContact OE1-NH2 3.26Å; E482-R596 VanDerWaalsContact OE1-NH2 3.12Å; E482-R596 IonicContact OE2-CZ 3.68Å; E482-R596 IonicContact OE2-NE 2.71Å; E482-R596 IonicContact OE2-NH2 3.41Å; E482-R596 PolarHBondContact OE2-NH2 3.29Å; F541-R596 PolarHBondContact O-NH2 3.3Å; R596-F598 PolarHBondContact O-N 3.44Å
597	L	93.7	Very high	83.5	Confident	12 Å²	12	54.7 Å²	54.7	6%	0.063	30%	0.301	C	S	.	.			trans	-77.5	56.3	176.6	-164.9	73.9	0	0	0	112	Y105 T108 A109 K112 D476 Y477 Q479 S599 V602	Y105-L597 HydrophobicContact CD1-CD1 4.31Å; T108-L597 HydrophobicContact CG2-CB 4Å; T108-L597 HydrophobicContact CG2-CD1 4.25Å; A109-L597 HydrophobicContact CB-CD1 4.08Å; A109-L597 HydrophobicContact CB-CD2 4.1Å; K112-L597 HydrophobicContact CB-CD2 4.1Å; K112-L597 HydrophobicContact CD-CD2 3.79Å; D476-L597 PolarHBondContact O-N 3.33Å; Y477-L597 HydrophobicContact CD1-CD2 4.43Å; Q479-L597 PolarHBondContact NE2-O 2.88Å; L597-S599 PolarHBondContact O-N 3.05Å; L597-V602 HydrophobicContact CD1-CG2 3.85Å; L597-V602 HydrophobicContact CG-CG2 4.41Å
598	F	95.6	Very high	85.4	Confident	16 Å²	16	46 Å²	46	7%	0.07	27%	0.265	C	S	.	.			trans	-79.4	107.8	176.1	179.7	-129.1	0	0	0	110.2	H82 R596 P600 Y601 V602	H82-F598 HydrophobicContact CB-CE1 4.38Å; H82-F598 AromaticContact CD2-CZ 3.93Å; H82-F598 AromaticContact CG-CE1 3.97Å; R596-F598 PolarHBondContact O-N 3.44Å; F598-P600 VanDerWaalsContact C-CD 3.47Å; F598-P600 HydrophobicContact CD1-CB 4.49Å; F598-P600 HydrophobicContact CD1-CG 4.48Å; F598-P600 HydrophobicContact CD2-CG 4.43Å; F598-P600 HydrophobicContact CE1-CB 4.02Å; F598-P600 HydrophobicContact CE1-CG 3.97Å; F598-P600 HydrophobicContact CE2-CG 3.91Å; F598-P600 HydrophobicContact CZ-CB 4.21Å; F598-P600 HydrophobicContact CZ-CG 3.66Å; F598-P600 VanDerWaalsContact O-N 3.13Å; F598-Y601 HydrophobicContact CB-CD2 4.46Å; F598-Y601 HydrophobicContact CD1-CD1 4.13Å; F598-Y601 AromaticContact CD1-CD2 3.69Å; F598-Y601 HydrophobicContact CD1-CD2 3.69Å; F598-Y601 HydrophobicContact CD1-CE1 4.32Å; F598-Y601 AromaticContact CD1-CE2 3.87Å; F598-Y601 HydrophobicContact CD1-CE2 3.87Å; F598-Y601 AromaticContact CD1-CG 3.81Å; F598-Y601 HydrophobicContact CD1-CG 3.81Å; F598-Y601 HydrophobicContact CE1-CD1 4.37Å; F598-Y601 HydrophobicContact CE1-CE1 4.29Å; F598-Y601 HydrophobicContact CE1-CE2 4.42Å; F598-Y601 HydrophobicContact CE1-CG 4.49Å; F598-Y601 PolarHBondContact O-N 3.08Å; F598-V602 PolarHBondContact O-N 3.34Å
599	S	94.5	Very high	87.4	Confident	54 Å²	54	39 Å²	39	38%	0.378	23%	0.228	S	C	.	.	H	α-helix	trans	-50.4	-41.5	-167.7	-55.5	0	0	0	0	115.3	Q479 L597 Y601 V602 E603	Q479-S599 PolarHBondContact OE1-OG 2.81Å; L597-S599 PolarHBondContact O-N 3.05Å; S599-Y601 VanDerWaalsContact C-N 3.28Å; S599-Y601 PolarHBondContact O-N 3.33Å; S599-V602 PolarHBondContact O-N 3.43Å; S599-V602 VanDerWaalsContact O-N 3.13Å; S599-E603 PolarHBondContact O-N 3.31Å
600	P	94.4	Very high	89.3	Confident	28 Å²	28	42.8 Å²	42.8	18%	0.182	24%	0.244	C	C	.	.	H	α-helix	trans	-64.4	-22.7	177.2	-24.7	36.9	0	0	0	115.7	H82 F598 E604	H82-P600 HydrophobicContact CB-CB 4.22Å; F598-P600 VanDerWaalsContact C-CD 3.47Å; F598-P600 HydrophobicContact CD1-CB 4.49Å; F598-P600 HydrophobicContact CD1-CG 4.48Å; F598-P600 HydrophobicContact CD2-CG 4.43Å; F598-P600 HydrophobicContact CE1-CB 4.02Å; F598-P600 HydrophobicContact CE1-CG 3.97Å; F598-P600 HydrophobicContact CE2-CG 3.91Å; F598-P600 HydrophobicContact CZ-CB 4.21Å; F598-P600 HydrophobicContact CZ-CG 3.66Å; F598-P600 VanDerWaalsContact O-N 3.13Å; P600-E604 WeakPolarHBondContact O-CB 3.35Å
601	Y	94.8	Very high	91	Very high	8 Å²	8	44 Å²	44	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-85	-34.9	171	-68	-17	0	0	0	111.4	H82 Q85 M86 L548 F598 S599 E604 A605	H82-Y601 HydrophobicContact CB-CD1 4.26Å; H82-Y601 HydrophobicContact CB-CE1 3.77Å; Q85-Y601 HydrophobicContact CB-CE1 4.43Å; Q85-Y601 PolarHBondContact OE1-OH 3.03Å; M86-Y601 HydrophobicContact CB-CD1 4.03Å; M86-Y601 HydrophobicContact CG-CD1 4.38Å; M86-Y601 HydrophobicContact SD-CD1 4.17Å; M86-Y601 HydrophobicContact SD-CD2 4.46Å; M86-Y601 HydrophobicContact SD-CG 3.94Å; L548-Y601 HydrophobicContact CD1-CE1 4.37Å; L548-Y601 HydrophobicContact CD1-CE2 4.2Å; F598-Y601 HydrophobicContact CB-CD2 4.46Å; F598-Y601 HydrophobicContact CD1-CD1 4.13Å; F598-Y601 AromaticContact CD1-CD2 3.69Å; F598-Y601 HydrophobicContact CD1-CD2 3.69Å; F598-Y601 HydrophobicContact CD1-CE1 4.32Å; F598-Y601 AromaticContact CD1-CE2 3.87Å; F598-Y601 HydrophobicContact CD1-CE2 3.87Å; F598-Y601 AromaticContact CD1-CG 3.81Å; F598-Y601 HydrophobicContact CD1-CG 3.81Å; F598-Y601 HydrophobicContact CE1-CD1 4.37Å; F598-Y601 HydrophobicContact CE1-CE1 4.29Å; F598-Y601 HydrophobicContact CE1-CE2 4.42Å; F598-Y601 HydrophobicContact CE1-CG 4.49Å; F598-Y601 PolarHBondContact O-N 3.08Å; S599-Y601 VanDerWaalsContact C-N 3.28Å; S599-Y601 PolarHBondContact O-N 3.33Å; Y601-E604 PolarHBondContact O-N 3.31Å; Y601-A605 WeakPolarHBondContact O-CB 3.27Å; Y601-A605 PolarHBondContact O-N 3.12Å
602	V	94.5	Very high	92.2	Very high	22 Å²	22	39 Å²	39	13%	0.133	20%	0.202	C	C	.	.	H	α-helix	trans	-64.9	-49.3	176.6	-178.3	0	0	0	0	111.7	Y105 L597 F598 S599 E604 K606	Y105-V602 HydrophobicContact CD1-CG2 3.74Å; Y105-V602 HydrophobicContact CD2-CG2 4.26Å; Y105-V602 HydrophobicContact CE1-CG2 4.01Å; Y105-V602 HydrophobicContact CE2-CG2 4.5Å; Y105-V602 HydrophobicContact CG-CG1 4.4Å; Y105-V602 HydrophobicContact CG-CG2 3.87Å; L597-V602 HydrophobicContact CD1-CG2 3.85Å; L597-V602 HydrophobicContact CG-CG2 4.41Å; F598-V602 PolarHBondContact O-N 3.34Å; S599-V602 PolarHBondContact O-N 3.43Å; S599-V602 VanDerWaalsContact O-N 3.13Å; V602-E604 PolarHBondContact O-N 3.38Å; V602-K606 WeakPolarHBondContact O-CG 3.48Å; V602-K606 PolarHBondContact O-N 2.9Å
603	E	94.9	Very high	92.6	Very high	115 Å²	115	40.7 Å²	40.7	54%	0.537	21%	0.213	S	C	.	.	H	α-helix	trans	-53.4	-44.2	174.5	-76.9	-173.6	-177.4	0	0	111.4	K75 S599 S607	K75-E603 IonicContact NZ-OE2 3.64Å; K75-E603 PolarHBondContact NZ-OE2 3.27Å; S599-E603 PolarHBondContact O-N 3.31Å; E603-S607 WeakPolarHBondContact O-CB 3.42Å; E603-S607 PolarHBondContact O-N 2.91Å
604	E	95.8	Very high	92.9	Very high	6 Å²	6	41.2 Å²	41.2	3%	0.028	22%	0.216	C	C	.	.	H	α-helix	trans	-79.2	-36.5	-171.2	-161.3	60.8	-116.4	0	0	112.4	K75 A83 M86 R87 P600 Y601 V602 K606 S607 V608	K75-E604 IonicContact NZ-OE2 3.54Å; A83-E604 HydrophobicContact CB-CG 4.26Å; A83-E604 WeakPolarHBondContact CB-OE2 3.25Å; M86-E604 HydrophobicContact CB-CB 4.12Å; M86-E604 HydrophobicContact CB-CG 4.1Å; M86-E604 HydrophobicContact CG-CB 4.25Å; R87-E604 IonicContact CZ-OE1 2.98Å; R87-E604 IonicContact CZ-OE2 3.59Å; R87-E604 IonicContact NE-OE1 2.71Å; R87-E604 IonicContact NH1-OE1 3.63Å; R87-E604 PolarHBondContact NH1-OE1 2.7Å; R87-E604 IonicContact NH1-OE2 2.74Å; R87-E604 IonicContact NH2-OE1 3.29Å; R87-E604 PolarHBondContact NH2-OE1 3.15Å; R87-E604 IonicContact NH2-OE2 3.64Å; R87-E604 PolarHBondContact NH2-OE2 3.42Å; P600-E604 WeakPolarHBondContact O-CB 3.35Å; Y601-E604 PolarHBondContact O-N 3.31Å; V602-E604 PolarHBondContact O-N 3.38Å; E604-K606 VanDerWaalsContact C-N 3.3Å; E604-K606 PolarHBondContact O-N 3.29Å; E604-S607 PolarHBondContact O-N 2.93Å; E604-V608 WeakPolarHBondContact O-CG2 3.49Å; E604-V608 PolarHBondContact O-N 2.91Å
605	A	94.6	Very high	92.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.9	-41.8	171.1	0	0	0	0	0	111.5	M86 L90 Y105 Y601 V608 L609	M86-A605 HydrophobicContact CE-CB 3.98Å; L90-A605 HydrophobicContact CD1-CB 4.27Å; Y105-A605 HydrophobicContact CD2-CB 4.24Å; Y105-A605 HydrophobicContact CE2-CB 4.05Å; Y601-A605 WeakPolarHBondContact O-CB 3.27Å; Y601-A605 PolarHBondContact O-N 3.12Å; A605-V608 PolarHBondContact O-N 2.98Å; A605-L609 WeakPolarHBondContact O-CB 3.47Å; A605-L609 PolarHBondContact O-N 2.66Å
606	K	95.1	Very high	91.9	Very high	68 Å²	68	51.2 Å²	51.2	30%	0.296	26%	0.264	S	S	.	.	H	α-helix	trans	-67	-42.5	174.8	-67.8	-169.3	175.4	-157.6	0	111.9	A102 E106 V602 E604 V608 L609 D610	A102-K606 HydrophobicContact CB-CG 4.33Å; E106-K606 IonicContact OE2-NZ 2.97Å; E106-K606 PolarHBondContact OE2-NZ 2.91Å; V602-K606 WeakPolarHBondContact O-CG 3.48Å; V602-K606 PolarHBondContact O-N 2.9Å; E604-K606 VanDerWaalsContact C-N 3.3Å; E604-K606 PolarHBondContact O-N 3.29Å; K606-V608 VanDerWaalsContact C-N 3.34Å; K606-V608 PolarHBondContact O-N 3.21Å; K606-L609 WeakPolarHBondContact O-CB 3.38Å; K606-L609 PolarHBondContact O-N 3.46Å; K606-D610 PolarHBondContact O-N 2.72Å
607	S	95.1	Very high	91	Very high	45 Å²	45	54.4 Å²	54.4	32%	0.315	29%	0.285	S	S	.	.	H	α-helix	trans	-61.4	-38.8	175.4	-166.7	0	0	0	0	113.2	E603 E604 E611	E603-S607 WeakPolarHBondContact O-CB 3.42Å; E603-S607 PolarHBondContact O-N 2.91Å; E604-S607 PolarHBondContact O-N 2.93Å; S607-E611 WeakPolarHBondContact O-CG 3.37Å; S607-E611 PolarHBondContact O-N 3.06Å; S607-E611 VanDerWaalsContact O-N 3.12Å
608	V	94.3	Very high	90	Very high	15 Å²	15	58 Å²	58	9%	0.091	30%	0.304	C	S	.	.	H	α-helix	trans	-69.6	-40.2	175.9	171.2	0	0	0	0	111	R87 L90 T98 E604 A605 K606 E611 M612	R87-V608 HydrophobicContact CG-CG2 3.49Å; R87-V608 VanDerWaalsContact CG-CG2 3.49Å; L90-V608 HydrophobicContact CB-CG1 4.28Å; L90-V608 HydrophobicContact CD1-CB 4.02Å; L90-V608 HydrophobicContact CD1-CG1 4.01Å; L90-V608 HydrophobicContact CD1-CG2 4.26Å; T98-V608 HydrophobicContact CG2-CG1 4.35Å; E604-V608 WeakPolarHBondContact O-CG2 3.49Å; E604-V608 PolarHBondContact O-N 2.91Å; A605-V608 PolarHBondContact O-N 2.98Å; K606-V608 VanDerWaalsContact C-N 3.34Å; K606-V608 PolarHBondContact O-N 3.21Å; V608-E611 PolarHBondContact O-N 3.46Å; V608-M612 HydrophobicContact CG1-CG 4.44Å; V608-M612 HydrophobicContact CG1-SD 3.94Å; V608-M612 VanDerWaalsContact O-CG 3.25Å; V608-M612 WeakPolarHBondContact O-CG 3.34Å; V608-M612 PolarHBondContact O-N 3.31Å
609	L	93.9	Very high	88.8	Confident	16 Å²	16	61.4 Å²	61.4	8%	0.084	32%	0.322	C	S	.	.	H	α-helix	trans	-60.1	-48.2	174.3	-178.1	60.5	0	0	0	111.6	V95 T98 N99 A102 A605 K606 E611 M612 M613	V95-L609 HydrophobicContact CG1-CD1 4.03Å; T98-L609 HydrophobicContact CG2-CB 4.03Å; T98-L609 HydrophobicContact CG2-CD1 4.31Å; N99-L609 HydrophobicContact CB-CD1 3.92Å; N99-L609 HydrophobicContact CB-CD2 4.28Å; A102-L609 HydrophobicContact CB-CD2 3.75Å; A605-L609 WeakPolarHBondContact O-CB 3.47Å; A605-L609 PolarHBondContact O-N 2.66Å; K606-L609 WeakPolarHBondContact O-CB 3.38Å; K606-L609 PolarHBondContact O-N 3.46Å; L609-E611 VanDerWaalsContact C-N 3.34Å; L609-E611 PolarHBondContact O-N 3.31Å; L609-M612 PolarHBondContact O-N 3.25Å; L609-M613 HydrophobicContact CD1-CG 4.04Å; L609-M613 HydrophobicContact CG-CG 4.25Å; L609-M613 WeakPolarHBondContact O-CB 3.44Å; L609-M613 VanDerWaalsContact O-CG 3.25Å; L609-M613 WeakPolarHBondContact O-CG 3.26Å; L609-M613 PolarHBondContact O-N 2.88Å
610	D	93	Very high	87.5	Confident	105 Å²	105	62.4 Å²	62.4	56%	0.561	33%	0.326	S	S	*	.	H	α-helix	trans	-58.5	-43.9	177.5	-76.5	-23.7	0	0	0	111.7	K606 M613 V614	K606-D610 PolarHBondContact O-N 2.72Å; D610-M613 PolarHBondContact O-N 3.29Å; D610-V614 WeakPolarHBondContact O-CB 3.49Å; D610-V614 VanDerWaalsContact O-CG2 3.32Å; D610-V614 WeakPolarHBondContact O-CG2 3.46Å; D610-V614 PolarHBondContact O-N 3.18Å
611	E	92.7	Very high	86.2	Confident	106 Å²	106	69.1 Å²	69.1	50%	0.495	35%	0.348	S	S	.	.	H	α-helix	trans	-59.5	-48.1	174.8	-75.4	176.6	179.9	0	0	111.3	S607 V608 L609 M613 V614 E615	S607-E611 WeakPolarHBondContact O-CG 3.37Å; S607-E611 PolarHBondContact O-N 3.06Å; S607-E611 VanDerWaalsContact O-N 3.12Å; V608-E611 PolarHBondContact O-N 3.46Å; L609-E611 VanDerWaalsContact C-N 3.34Å; L609-E611 PolarHBondContact O-N 3.31Å; E611-M613 PolarHBondContact O-N 2.77Å; E611-V614 PolarHBondContact O-N 3.33Å; E611-E615 PolarHBondContact O-N 3.05Å
612	M	90.8	Very high	84.5	Confident	38 Å²	38	74 Å²	74	19%	0.187	37%	0.374	C	S	.	.	H	α-helix	trans	-63.9	-37.9	177.2	-66.9	170.3	100.9	0	0	113.2	W93 V95 T98 V608 L609 E615 Q616	W93-M612 VanDerWaalsContact O-CE 3.28Å; W93-M612 WeakPolarHBondContact O-CE 3.37Å; V95-M612 HydrophobicContact CG2-CB 4.01Å; V95-M612 HydrophobicContact CG2-CE 4.03Å; T98-M612 HydrophobicContact CG2-SD 4.09Å; V608-M612 HydrophobicContact CG1-CG 4.44Å; V608-M612 HydrophobicContact CG1-SD 3.94Å; V608-M612 VanDerWaalsContact O-CG 3.25Å; V608-M612 WeakPolarHBondContact O-CG 3.34Å; V608-M612 PolarHBondContact O-N 3.31Å; L609-M612 PolarHBondContact O-N 3.25Å; M612-E615 PolarHBondContact O-N 3.09Å; M612-Q616 PolarHBondContact O-N 3.07Å
613	M	87.9	Confident	82.8	Confident	87 Å²	87	80.6 Å²	80.6	43%	0.429	40%	0.396	S	S	.	.	H	α-helix	trans	-71	-36.1	178.5	-69	-136.9	75.8	0	0	112.1	V95 L609 D610 E611 T617	V95-M613 HydrophobicContact CG1-CG 4.31Å; L609-M613 HydrophobicContact CD1-CG 4.04Å; L609-M613 HydrophobicContact CG-CG 4.25Å; L609-M613 WeakPolarHBondContact O-CB 3.44Å; L609-M613 VanDerWaalsContact O-CG 3.25Å; L609-M613 WeakPolarHBondContact O-CG 3.26Å; L609-M613 PolarHBondContact O-N 2.88Å; D610-M613 PolarHBondContact O-N 3.29Å; E611-M613 PolarHBondContact O-N 2.77Å; M613-T617 WeakPolarHBondContact O-CB 3.39Å; M613-T617 PolarHBondContact O-N 3.48Å; M613-T617 PolarHBondContact O-OG1 2.96Å
614	V	86.8	Confident	81	Confident	78 Å²	78	81 Å²	81	47%	0.473	40%	0.401	S	S	.	.	H	α-helix	trans	-64.6	-45.8	171.6	169.1	0	0	0	0	110.5	D610 E611 Q616 T617 D618	D610-V614 WeakPolarHBondContact O-CB 3.49Å; D610-V614 VanDerWaalsContact O-CG2 3.32Å; D610-V614 WeakPolarHBondContact O-CG2 3.46Å; D610-V614 PolarHBondContact O-N 3.18Å; E611-V614 PolarHBondContact O-N 3.33Å; V614-Q616 PolarHBondContact O-N 2.98Å; V614-T617 PolarHBondContact O-N 2.88Å; V614-T617 VanDerWaalsContact O-N 3.15Å; V614-D618 PolarHBondContact O-N 3.34Å
615	E	80.3	Confident	79.1	Confident	143 Å²	143	86 Å²	86	67%	0.668	43%	0.432	S	S	*	.	H	α-helix	trans	-60.2	-42.8	176.7	-74.1	-168.5	167.2	0	0	112.5	E611 M612 L619	E611-E615 PolarHBondContact O-N 3.05Å; M612-E615 PolarHBondContact O-N 3.09Å; E615-L619 WeakPolarHBondContact O-CB 3.39Å; E615-L619 PolarHBondContact O-N 3.32Å
616	Q	74.9	Confident	77.3	Confident	104 Å²	104	96.3 Å²	96.3	49%	0.486	47%	0.471	S	S	.	.	H	α-helix	trans	-63.9	-41.2	173.3	-74.6	-154.9	-0.6	0	0	112.6	V95 M612 V614 L619 V620	V95-Q616 HydrophobicContact CG2-CG 4.33Å; V95-Q616 VanDerWaalsContact CG2-NE2 3.26Å; M612-Q616 PolarHBondContact O-N 3.07Å; V614-Q616 PolarHBondContact O-N 2.98Å; Q616-L619 WeakPolarHBondContact O-CB 3.48Å; Q616-L619 PolarHBondContact O-N 2.95Å; Q616-V620 WeakPolarHBondContact O-CG2 3.35Å; Q616-V620 PolarHBondContact O-N 3.24Å
617	T	74.1	Confident	74.9	Confident	77 Å²	77	99.8 Å²	99.8	47%	0.472	49%	0.49	S	S	.	.	H	α-helix	trans	-63.5	-44.2	179.4	-60.1	0	0	0	0	111.2	M613 V614 V620 R621	M613-T617 WeakPolarHBondContact O-CB 3.39Å; M613-T617 PolarHBondContact O-N 3.48Å; M613-T617 PolarHBondContact O-OG1 2.96Å; V614-T617 PolarHBondContact O-N 2.88Å; V614-T617 VanDerWaalsContact O-N 3.15Å; T617-V620 PolarHBondContact O-N 3.45Å; T617-R621 WeakPolarHBondContact O-CG 3.32Å; T617-R621 PolarHBondContact O-N 2.86Å
618	D	72.3	Confident	72.8	Confident	87 Å²	87	102.1 Å²	102.1	47%	0.465	51%	0.506	S	S	.	.	H	α-helix	trans	-67	-35.5	174.9	-82.5	-20.2	0	0	0	111.9	V614 V620 R621 L622	V614-D618 PolarHBondContact O-N 3.34Å; D618-V620 PolarHBondContact O-N 2.84Å; D618-R621 PolarHBondContact O-N 3.47Å; D618-L622 WeakPolarHBondContact O-CB 3.27Å; D618-L622 VanDerWaalsContact O-CG 3.25Å; D618-L622 WeakPolarHBondContact O-CG 3.39Å; D618-L622 PolarHBondContact O-N 3.39Å
619	L	70.4	Confident	70.7	Confident	88 Å²	88	109.2 Å²	109.2	46%	0.461	54%	0.544	S	S	.	.	H	α-helix	trans	-62.2	-40.9	171	-123.9	76.8	0	0	0	112.5	E615 Q616 L622 R623	E615-L619 WeakPolarHBondContact O-CB 3.39Å; E615-L619 PolarHBondContact O-N 3.32Å; Q616-L619 WeakPolarHBondContact O-CB 3.48Å; Q616-L619 PolarHBondContact O-N 2.95Å; L619-L622 PolarHBondContact O-N 3.15Å; L619-R623 WeakPolarHBondContact O-CB 3.25Å; L619-R623 VanDerWaalsContact O-CG 3.25Å; L619-R623 WeakPolarHBondContact O-CG 3.39Å; L619-R623 PolarHBondContact O-N 3.42Å
620	V	66.8	Low	68.4	Low	75 Å²	75	114.5 Å²	114.5	46%	0.455	58%	0.576	S	S	.	*	H	α-helix	trans	-67.7	-42.2	176.6	169.3	0	0	0	0	110.6	Q616 T617 D618 L622 R623 L624	Q616-V620 WeakPolarHBondContact O-CG2 3.35Å; Q616-V620 PolarHBondContact O-N 3.24Å; T617-V620 PolarHBondContact O-N 3.45Å; D618-V620 PolarHBondContact O-N 2.84Å; V620-L622 PolarHBondContact O-N 3.46Å; V620-R623 PolarHBondContact O-N 2.91Å; V620-L624 HydrophobicContact CG1-CD1 4.2Å; V620-L624 PolarHBondContact O-N 2.68Å
621	R	66.6	Low	66	Low	169 Å²	169	115 Å²	115	64%	0.638	59%	0.585	S	S	*	*	H	α-helix	trans	-60.5	-44.4	173	-69.4	176.1	75.2	94.6	4.6	111.6	T617 D618 R623 L624 V625	T617-R621 WeakPolarHBondContact O-CG 3.32Å; T617-R621 PolarHBondContact O-N 2.86Å; D618-R621 PolarHBondContact O-N 3.47Å; R621-R623 VanDerWaalsContact C-N 3.29Å; R621-R623 PolarHBondContact O-N 3.35Å; R621-L624 PolarHBondContact O-N 2.87Å; R621-V625 WeakPolarHBondContact O-CB 3.49Å; R621-V625 VanDerWaalsContact O-CG2 3.27Å; R621-V625 WeakPolarHBondContact O-CG2 3.34Å; R621-V625 PolarHBondContact O-N 3.24Å
622	L	59.8	Low	63.9	Low	109 Å²	109	118 Å²	118	57%	0.571	60%	0.604	S	S	*	*	H	α-helix	trans	-65	-29.8	176.1	-74.7	167.4	0	0	0	113.2	D618 L619 V620	D618-L622 WeakPolarHBondContact O-CB 3.27Å; D618-L622 VanDerWaalsContact O-CG 3.25Å; D618-L622 WeakPolarHBondContact O-CG 3.39Å; D618-L622 PolarHBondContact O-N 3.39Å; L619-L622 PolarHBondContact O-N 3.15Å; V620-L622 PolarHBondContact O-N 3.46Å
623	R	58.6	Low	61.7	Low	161 Å²	161	122.1 Å²	122.1	61%	0.608	63%	0.632	S	S	*	*	H	α-helix	trans	-73.6	-45.4	172.1	-74	167.7	179.8	177.6	0.7	111.7	L619 V620 R621 V625 R626 M627	L619-R623 WeakPolarHBondContact O-CB 3.25Å; L619-R623 VanDerWaalsContact O-CG 3.25Å; L619-R623 WeakPolarHBondContact O-CG 3.39Å; L619-R623 PolarHBondContact O-N 3.42Å; V620-R623 PolarHBondContact O-N 2.91Å; R621-R623 VanDerWaalsContact C-N 3.29Å; R621-R623 PolarHBondContact O-N 3.35Å; R623-V625 VanDerWaalsContact C-N 3.34Å; R623-V625 PolarHBondContact O-N 3.43Å; R623-R626 PolarHBondContact O-N 3.37Å; R623-M627 VanDerWaalsContact O-CG 3.29Å; R623-M627 WeakPolarHBondContact O-CG 3.32Å; R623-M627 PolarHBondContact O-N 2.83Å
624	L	56.4	Low	59.4	Low	123 Å²	123	126.3 Å²	126.3	64%	0.644	66%	0.656	S	S	*	*	H	α-helix	trans	-57.3	-45.6	174.4	-106.7	72.2	0	0	0	111.9	V620 R621 R626 M627	V620-L624 HydrophobicContact CG1-CD1 4.2Å; V620-L624 PolarHBondContact O-N 2.68Å; R621-L624 PolarHBondContact O-N 2.87Å; L624-R626 PolarHBondContact O-N 3.07Å; L624-R626 VanDerWaalsContact O-N 3.08Å; L624-M627 PolarHBondContact O-N 3.18Å
625	V	57.5	Low	57	Low	111 Å²	111	132.8 Å²	132.8	67%	0.673	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-14.8	177.9	168.9	0	0	0	0	113.1	R621 R623	R621-V625 WeakPolarHBondContact O-CB 3.49Å; R621-V625 VanDerWaalsContact O-CG2 3.27Å; R621-V625 WeakPolarHBondContact O-CG2 3.34Å; R621-V625 PolarHBondContact O-N 3.24Å; R623-V625 VanDerWaalsContact C-N 3.34Å; R623-V625 PolarHBondContact O-N 3.43Å
626	R	55.3	Low	54.8	Low	218 Å²	218	133.7 Å²	133.7	82%	0.823	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-1.1	173.5	-71.3	-177.8	175.1	-174.5	-0.2	114.4	R623 L624	R623-R626 PolarHBondContact O-N 3.37Å; L624-R626 PolarHBondContact O-N 3.07Å; L624-R626 VanDerWaalsContact O-N 3.08Å
627	M	46.3	Very low	53.1	Low	141 Å²	141	134.9 Å²	134.9	70%	0.695	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	6.3	-173.3	-67	-93.2	58.7	0	0	114.1	R623 L624 N629	R623-M627 VanDerWaalsContact O-CG 3.29Å; R623-M627 WeakPolarHBondContact O-CG 3.32Å; R623-M627 PolarHBondContact O-N 2.83Å; L624-M627 PolarHBondContact O-N 3.18Å; M627-N629 VanDerWaalsContact C-N 3.32Å; M627-N629 PolarHBondContact O-N 3.44Å
628	S	49.7	Very low	51	Low	93 Å²	93	138.6 Å²	138.6	65%	0.65	71%	0.71	S	S	*	*			trans	-72.5	79.8	172.6	59.4	0	0	0	0	111.9
629	N	51.1	Low	49.5	Very low	165 Å²	165	142.5 Å²	142.5	88%	0.882	73%	0.731	S	S	*	*			trans	-173.5	48.6	157.3	-97	-15.5	0	0	0	113.2	M627	M627-N629 VanDerWaalsContact C-N 3.32Å; M627-N629 PolarHBondContact O-N 3.44Å
630	V	44.8	Very low	47.6	Very low	127 Å²	127	142.4 Å²	142.4	77%	0.77	74%	0.743	S	S	*	*	S	Bend	trans	-134.6	129.9	160.9	-175.9	0	0	0	0	107.7
631	P	43.1	Very low	46	Very low	115 Å²	115	145 Å²	145	75%	0.747	76%	0.758	S	S	*	*			trans	-75.3	143.4	179.5	-15.5	30.7	0	0	0	112.9	T633	P631-T633 PolarHBondContact O-N 2.88Å
632	D	47.7	Very low	44.2	Very low	168 Å²	168	142.8 Å²	142.8	90%	0.898	77%	0.766	S	S	*	*			trans	-69.9	112.6	167.9	-90.7	-46.4	0	0	0	111.3
633	T	44.7	Very low	43.3	Very low	125 Å²	125	145.8 Å²	145.8	77%	0.767	78%	0.777	S	S	*	*			trans	-144.7	91.9	157.7	52.2	0	0	0	0	110.9	P631	P631-T633 PolarHBondContact O-N 2.88Å
634	L	39.5	Very low	41.7	Very low	176 Å²	176	143.5 Å²	143.5	92%	0.921	78%	0.784	S	S	*	*			trans	-167	162	139.3	-104.6	167.6	0	0	0	110.1
635	Y	36.7	Very low	40.2	Very low	214 Å²	214	140.8 Å²	140.8	84%	0.839	78%	0.775	S	S	*	*			trans	-110.1	164	-155.3	-101.4	-102.2	0	0	0	115.2
636	M	35.3	Very low	38.8	Very low	162 Å²	162	144.4 Å²	144.4	80%	0.798	78%	0.784	S	S	*	*			trans	76	103.3	153.1	-73.9	162.5	63.7	0	0	120.4
637	V	39.3	Very low	37.6	Very low	129 Å²	129	142.5 Å²	142.5	78%	0.782	79%	0.787	S	S	*	*				39.7	120.5	119	-177.2	0	0	0	0	118.4
638	N	28.8	Very low	36.5	Very low	155 Å²	155	144.2 Å²	144.2	83%	0.829	80%	0.797	S	S	*	*				-154.9	118.8	129.2	-117.1	-15.8	0	0	0	112.3
639	N	41.4	Very low	35.5	Very low	168 Å²	168	145.8 Å²	145.8	90%	0.898	80%	0.798	S	S	*	*			trans	-89.6	113.7	163.9	-86.2	-6.6	0	0	0	107.8
640	A	30	Very low	34.4	Very low	86 Å²	86	144.9 Å²	144.9	71%	0.711	79%	0.788	S	S	*	*			trans	-133.5	116	175.9	0	0	0	0	0	110.4
641	V	32.6	Very low	33.5	Very low	129 Å²	129	147 Å²	147	78%	0.782	79%	0.79	S	S	*	*			trans	-76.5	136.3	169.7	179.8	0	0	0	0	108.5	Q643	V641-Q643 PolarHBondContact O-N 3.04Å
642	P	29.2	Very low	33	Very low	123 Å²	123	150.4 Å²	150.4	80%	0.799	80%	0.796	S	S	*	*			trans	-74.6	82.4	-178.2	-14.2	29.9	0	0	0	113.2
643	Q	40.3	Very low	32	Very low	173 Å²	173	151.1 Å²	151.1	81%	0.808	80%	0.796	S	S	*	*			trans	-83.9	126.4	157.5	-71.1	176.2	-44.3	0	0	108.8	V641	V641-Q643 PolarHBondContact O-N 3.04Å
644	C	25.4	Very low	31.6	Very low	112 Å²	112	150.4 Å²	150.4	76%	0.757	80%	0.803	S	S	*	*			trans	-146.4	81.6	-177.7	-92.3	0	0	0	0	111.8
645	C	25.7	Very low	31.1	Very low	66 Å²	66	145.9 Å²	145.9	45%	0.446	80%	0.798	S	S	.	*			trans	-131.3	75.3	-168.3	-43.7	0	0	0	0	111.3	Q751	C645-Q751 PolarHBondContact SG-OE1 3.2Å
646	H	28.4	Very low	31.1	Very low	188 Å²	188	141.6 Å²	141.6	87%	0.87	80%	0.8	S	S	*	*			trans	-132.5	156.1	178.9	-87.7	0.1	0	0	0	114.3
647	M	28.8	Very low	31.3	Very low	177 Å²	177	139.1 Å²	139.1	87%	0.872	80%	0.799	S	S	*	*			trans	-106.3	153.2	-150.1	-60	146.5	57.9	0	0	114.6
648	I	24.1	Very low	31.8	Very low	177 Å²	177	138.8 Å²	138.8	91%	0.908	80%	0.802	S	S	*	*			trans	-134.7	147.7	151.9	-62.2	-175	0	0	0	108.4
649	N	28	Very low	32.8	Very low	126 Å²	126	137.2 Å²	137.2	67%	0.674	80%	0.798	S	S	*	*			trans	-92.2	-179.2	-163	-162.9	8.7	0	0	0	114.6
650	H	28.8	Very low	33	Very low	146 Å²	146	131.8 Å²	131.8	68%	0.676	78%	0.776	S	S	*	*			trans	83.3	141.8	166.3	-60	-60.6	0	0	0	116.9
651	Q	26.8	Very low	34.6	Very low	172 Å²	172	130 Å²	130	80%	0.804	76%	0.757	S	S	*	*			cis	-150.1	151.8	-10.2	-172	165.2	3.2	0	0	109
652	Q	30.6	Very low	35.9	Very low	186 Å²	186	128.4 Å²	128.4	87%	0.869	75%	0.752	S	S	*	*			trans	-72	148.7	174.9	-70.7	174	-17.6	0	0	112
653	M	26.7	Very low	37.5	Very low	183 Å²	183	125.4 Å²	125.4	90%	0.901	73%	0.732	S	S	*	*			trans	-129	136.2	160.7	-79.9	-67.6	178.3	0	0	108.4
654	A	36.4	Very low	38.9	Very low	110 Å²	110	117.2 Å²	117.2	91%	0.909	69%	0.694	S	S	*	*			trans	-95.1	147	178.9	0	0	0	0	0	111.1
655	G	29.3	Very low	40.4	Very low	81 Å²	81	114.1 Å²	114.1	84%	0.835	68%	0.676	S	S	*	*			trans	-161.1	111.8	174.5	0	0	0	0	0	109.9
656	S	38.3	Very low	41.7	Very low	124 Å²	124	118.6 Å²	118.6	87%	0.867	70%	0.695	S	S	*	*			trans	-109.6	127.7	-166.7	54.9	0	0	0	0	113.3
657	S	39.5	Very low	43.3	Very low	111 Å²	111	118.1 Å²	118.1	78%	0.776	69%	0.693	S	S	*	*			trans	-157.7	107.4	159.2	55.7	0	0	0	0	110.2	T659	S657-T659 PolarHBondContact O-N 2.94Å
658	S	49.7	Very low	45.4	Very low	121 Å²	121	111.2 Å²	111.2	85%	0.846	66%	0.66	S	S	*	*			trans	-93.9	72.4	-172	58.2	0	0	0	0	112.9
659	T	48	Very low	47.9	Very low	122 Å²	122	107.7 Å²	107.7	75%	0.748	65%	0.648	S	S	*	*			trans	-144	116.9	166.6	49	0	0	0	0	109	S657	S657-T659 PolarHBondContact O-N 2.94Å
660	A	46.8	Very low	50.4	Low	54 Å²	54	103.4 Å²	103.4	45%	0.446	63%	0.627	S	S	.	*			trans	-66.3	135.3	173.5	0	0	0	0	0	110.5	F734 P736	A660-F734 WeakPolarHBondContact CB-O 3.38Å; A660-P736 HydrophobicContact CB-CG 4.34Å
661	P	62.7	Low	53.2	Low	48 Å²	48	97.1 Å²	97.1	31%	0.312	60%	0.599	S	S	.	*			trans	-75.2	131.1	171.2	30.7	-29.4	0	0	0	109.7	V663 K733 F734	P661-V663 VanDerWaalsContact C-N 3.26Å; P661-V663 PolarHBondContact O-N 3.31Å; P661-K733 WeakPolarHBondContact CD-O 3.43Å; P661-K733 HydrophobicContact CG-CG 4.26Å; P661-F734 HydrophobicContact CG-CD1 3.76Å; P661-F734 HydrophobicContact CG-CE1 3.81Å
662	S	60.8	Low	56.2	Low	97 Å²	97	92.4 Å²	92.4	68%	0.678	58%	0.583	S	S	*	*	S	Bend	trans	-79	-3.9	-179.7	49.7	0	0	0	0	114.7	V670	S662-V670 WeakPolarHBondContact O-CG2 3.04Å; S662-V670 PolarHBondContact O-N 3.33Å
663	V	62.2	Low	58.9	Low	60 Å²	60	85.8 Å²	85.8	36%	0.364	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-135.4	135.9	-173.9	-177.6	0	0	0	0	109.9	P661 N666 I668	P661-V663 VanDerWaalsContact C-N 3.26Å; P661-V663 PolarHBondContact O-N 3.31Å; V663-N666 VanDerWaalsContact CG1-C 3.42Å; V663-I668 CarbonylContact C-O 3.57Å; V663-I668 WeakPolarHBondContact CA-O 3.23Å; V663-I668 WeakPolarHBondContact CG1-O 3.39Å
664	V	69.5	Low	61.9	Low	1 Å²	1	80.5 Å²	80.5	1%	0.006	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	133.6	169.4	-162.7	0	0	0	0	108.6	N666 I668 V670 A724 E726 L727 F734	V664-N666 PolarHBondContact O-N 3.27Å; V664-I668 HydrophobicContact CB-CB 4.44Å; V664-I668 PolarHBondContact N-O 3.11Å; V664-I668 WeakPolarHBondContact O-CB 3.19Å; V664-I668 PolarHBondContact O-N 3.19Å; V664-I668 VanDerWaalsContact O-N 3.11Å; V664-V670 HydrophobicContact CG2-CG2 3.76Å; V664-A724 HydrophobicContact CG1-CB 4.03Å; V664-E726 HydrophobicContact CG1-CB 4.46Å; V664-L727 HydrophobicContact CG1-CB 4.2Å; V664-L727 HydrophobicContact CG2-CB 4.36Å; V664-L727 HydrophobicContact CG2-CD1 4.24Å; V664-F734 HydrophobicContact CB-CE1 4.29Å; V664-F734 HydrophobicContact CG1-CE1 4.28Å; V664-F734 HydrophobicContact CG1-CZ 4.01Å; V664-F734 HydrophobicContact CG2-CD1 4.2Å; V664-F734 HydrophobicContact CG2-CE1 3.83Å; V664-F734 HydrophobicContact CG2-CZ 4.28Å
665	A	57.3	Low	64.5	Low	47 Å²	47	77.4 Å²	77.4	39%	0.388	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	50.9	174.2	0	0	0	0	0	114.8	E667 G723	A665-E667 PolarHBondContact O-N 3.01Å; A665-G723 WeakPolarHBondContact CB-O 3.47Å
666	N	52.2	Low	67.4	Low	159 Å²	159	73.6 Å²	73.6	85%	0.85	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	-22.5	177.1	-69.3	0.4	0	0	0	118.5	V663 V664	V663-N666 VanDerWaalsContact CG1-C 3.42Å; V664-N666 PolarHBondContact O-N 3.27Å
667	E	62.6	Low	69.9	Low	178 Å²	178	71.5 Å²	71.5	83%	0.832	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.6	-12	-169.4	-66.8	174.9	-170.6	0	0	114.6	A665	A665-E667 PolarHBondContact O-N 3.01Å
668	I	72.5	Confident	72.4	Confident	33 Å²	33	69 Å²	69	17%	0.169	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	120	-171.6	-50	170	0	0	0	110.2	V663 V664 A721 A724	V663-I668 CarbonylContact C-O 3.57Å; V663-I668 WeakPolarHBondContact CA-O 3.23Å; V663-I668 WeakPolarHBondContact CG1-O 3.39Å; V664-I668 HydrophobicContact CB-CB 4.44Å; V664-I668 PolarHBondContact N-O 3.11Å; V664-I668 WeakPolarHBondContact O-CB 3.19Å; V664-I668 PolarHBondContact O-N 3.19Å; V664-I668 VanDerWaalsContact O-N 3.11Å; I668-A721 HydrophobicContact CD1-CB 4.01Å; I668-A724 HydrophobicContact CD1-CB 3.95Å
669	P	77.4	Confident	74.4	Confident	102 Å²	102	63.2 Å²	63.2	66%	0.662	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56	141.5	172.1	-24.8	34.6	0	0	0	112.1	P671	P669-P671 WeakPolarHBondContact O-CD 3.37Å
670	V	81.4	Confident	76.5	Confident	36 Å²	36	58.5 Å²	58.5	22%	0.218	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-64.9	122.6	175.6	170.7	0	0	0	0	109.9	S662 V664 F734 F735	S662-V670 WeakPolarHBondContact O-CG2 3.04Å; S662-V670 PolarHBondContact O-N 3.33Å; V664-V670 HydrophobicContact CG2-CG2 3.76Å; V670-F734 HydrophobicContact CG2-CD1 3.76Å; V670-F734 HydrophobicContact CG2-CE1 4.41Å; V670-F735 HydrophobicContact CG1-CE1 4.05Å; V670-F735 HydrophobicContact CG1-CE2 4.16Å; V670-F735 HydrophobicContact CG1-CZ 3.49Å; V670-F735 VanDerWaalsContact CG1-CZ 3.49Å
671	P	86.8	Confident	78.6	Confident	15 Å²	15	62.5 Å²	62.5	10%	0.097	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-64.1	156.2	179.5	-22.3	33.8	0	0	0	112.8	P669 V675 V676 L720 L727	P669-P671 WeakPolarHBondContact O-CD 3.37Å; P671-V675 HydrophobicContact CB-CB 4.41Å; P671-V675 HydrophobicContact CB-CG1 4.47Å; P671-V676 HydrophobicContact CB-CG2 4.16Å; P671-L720 HydrophobicContact CG-CD1 3.83Å; P671-L720 HydrophobicContact CG-CD2 3.92Å; P671-L727 HydrophobicContact CG-CD2 3.83Å
672	P	88.9	Confident	80.1	Confident	72 Å²	72	63.5 Å²	63.5	47%	0.468	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-55.5	143	174.3	-24.5	33.8	0	0	0	112.5	S674 V675 V676	P672-S674 PolarHBondContact O-N 3.48Å; P672-S674 VanDerWaalsContact O-N 3.12Å; P672-V675 HydrophobicContact CB-CG2 4.19Å; P672-V675 HydrophobicContact CG-CG2 4.33Å; P672-V675 WeakPolarHBondContact O-CB 3.44Å; P672-V675 PolarHBondContact O-N 2.91Å; P672-V676 PolarHBondContact O-N 3.28Å; P672-V676 VanDerWaalsContact O-N 3.15Å
673	L	87.9	Confident	81.7	Confident	48 Å²	48	59.1 Å²	59.1	25%	0.251	32%	0.318	S	S	.	.	H	α-helix	trans	-56.8	-30.9	-175.6	176.8	64.3	0	0	0	114	V676 K677 F735 E738 F740	L673-V676 PolarHBondContact O-N 3.13Å; L673-K677 HydrophobicContact CD1-CD 4.34Å; L673-K677 HydrophobicContact CD1-CG 4.39Å; L673-K677 HydrophobicContact CG-CD 4.18Å; L673-K677 WeakPolarHBondContact O-CB 3.4Å; L673-K677 WeakPolarHBondContact O-CG 3.39Å; L673-K677 PolarHBondContact O-N 2.82Å; L673-F735 HydrophobicContact CB-CD1 4.33Å; L673-F735 HydrophobicContact CB-CE1 4.01Å; L673-F735 HydrophobicContact CD1-CB 4.38Å; L673-F735 HydrophobicContact CD1-CD1 3.86Å; L673-F735 HydrophobicContact CD1-CD2 4.23Å; L673-F735 HydrophobicContact CD1-CE1 4.15Å; L673-F735 HydrophobicContact CD1-CG 3.9Å; L673-F735 HydrophobicContact CD1-CZ 4.46Å; L673-E738 HydrophobicContact CD1-CG 3.98Å; L673-E738 HydrophobicContact CD2-CG 3.66Å; L673-E738 WeakPolarHBondContact CD2-OE1 3.48Å; L673-E738 HydrophobicContact CG-CG 4.46Å; L673-F740 HydrophobicContact CD1-CE1 4.18Å; L673-F740 HydrophobicContact CD1-CZ 3.95Å
674	S	90.1	Very high	83	Confident	72 Å²	72	59.9 Å²	59.9	50%	0.503	32%	0.317	S	S	.	.	H	α-helix	trans	-58.2	-53.7	171.7	42.6	0	0	0	0	111.3	P672 V676 K677 D678	P672-S674 PolarHBondContact O-N 3.48Å; P672-S674 VanDerWaalsContact O-N 3.12Å; S674-V676 VanDerWaalsContact C-N 3.29Å; S674-V676 PolarHBondContact O-N 2.74Å; S674-K677 WeakPolarHBondContact O-CB 3.4Å; S674-K677 PolarHBondContact O-N 2.94Å; S674-D678 PolarHBondContact O-N 3.15Å
675	V	90.5	Very high	84.1	Confident	45 Å²	45	64 Å²	64	27%	0.273	34%	0.336	S	S	.	.	H	α-helix	trans	-56.2	-44.1	177.5	-172.6	0	0	0	0	110.6	P671 P672 K677 D678 M679 F718	P671-V675 HydrophobicContact CB-CB 4.41Å; P671-V675 HydrophobicContact CB-CG1 4.47Å; P672-V675 HydrophobicContact CB-CG2 4.19Å; P672-V675 HydrophobicContact CG-CG2 4.33Å; P672-V675 WeakPolarHBondContact O-CB 3.44Å; P672-V675 PolarHBondContact O-N 2.91Å; V675-K677 PolarHBondContact O-N 3.29Å; V675-D678 PolarHBondContact O-N 3.06Å; V675-M679 HydrophobicContact CG1-CG 4.48Å; V675-M679 HydrophobicContact CG1-SD 4.14Å; V675-M679 WeakPolarHBondContact O-CG 3.46Å; V675-M679 PolarHBondContact O-N 2.95Å; V675-F718 HydrophobicContact CG1-CD1 3.6Å; V675-F718 HydrophobicContact CG1-CE1 3.98Å
676	V	90.1	Very high	85.9	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-65.8	-37.2	178	-176.9	0	0	0	0	112.2	P671 P672 L673 S674 M679 I680 L727 F735 F740	P671-V676 HydrophobicContact CB-CG2 4.16Å; P672-V676 PolarHBondContact O-N 3.28Å; P672-V676 VanDerWaalsContact O-N 3.15Å; L673-V676 PolarHBondContact O-N 3.13Å; S674-V676 VanDerWaalsContact C-N 3.29Å; S674-V676 PolarHBondContact O-N 2.74Å; V676-M679 PolarHBondContact O-N 2.69Å; V676-I680 HydrophobicContact CG1-CD1 4.17Å; V676-I680 VanDerWaalsContact O-CG1 3.3Å; V676-I680 WeakPolarHBondContact O-CG1 3.08Å; V676-I680 PolarHBondContact O-N 3.43Å; V676-L727 HydrophobicContact CG2-CD1 4.39Å; V676-L727 HydrophobicContact CG2-CD2 4.14Å; V676-L727 HydrophobicContact CG2-CG 4.5Å; V676-F735 HydrophobicContact CB-CE2 4.22Å; V676-F735 HydrophobicContact CG1-CE2 4.09Å; V676-F735 HydrophobicContact CG2-CE2 3.88Å; V676-F735 HydrophobicContact CG2-CZ 3.92Å; V676-F740 HydrophobicContact CG1-CE1 4.48Å
677	K	90.1	Very high	87.7	Confident	80 Å²	80	56.9 Å²	56.9	35%	0.348	29%	0.288	S	S	.	.	H	α-helix	trans	-67.2	-37.1	173.8	-75.6	173.2	175.4	176.2	0	111.9	L673 S674 V675 I680 R681 E738 F740	L673-K677 HydrophobicContact CD1-CD 4.34Å; L673-K677 HydrophobicContact CD1-CG 4.39Å; L673-K677 HydrophobicContact CG-CD 4.18Å; L673-K677 WeakPolarHBondContact O-CB 3.4Å; L673-K677 WeakPolarHBondContact O-CG 3.39Å; L673-K677 PolarHBondContact O-N 2.82Å; S674-K677 WeakPolarHBondContact O-CB 3.4Å; S674-K677 PolarHBondContact O-N 2.94Å; V675-K677 PolarHBondContact O-N 3.29Å; K677-I680 PolarHBondContact O-N 2.94Å; K677-R681 PolarHBondContact O-N 3.3Å; K677-E738 WeakPolarHBondContact CE-OE2 3.5Å; K677-E738 IonicContact NZ-OE1 2.77Å; K677-E738 PolarHBondContact NZ-OE1 2.7Å; K677-E738 IonicContact NZ-OE2 3.44Å; K677-E738 PolarHBondContact NZ-OE2 3.19Å; K677-F740 HydrophobicContact CG-CE1 4.48Å
678	D	92.5	Very high	89	Confident	58 Å²	58	53.9 Å²	53.9	31%	0.31	27%	0.274	S	S	.	.	H	α-helix	trans	-69.2	-40.5	174.3	-65.1	-37.8	0	0	0	112.1	S674 V675 I680 R681 R682 F718	S674-D678 PolarHBondContact O-N 3.15Å; V675-D678 PolarHBondContact O-N 3.06Å; D678-I680 VanDerWaalsContact C-N 3.33Å; D678-I680 PolarHBondContact O-N 3.01Å; D678-R681 WeakPolarHBondContact O-CB 3.44Å; D678-R681 PolarHBondContact O-N 2.95Å; D678-R681 IonicContact OD1-CZ 2.74Å; D678-R681 IonicContact OD1-NH1 4Å; D678-R681 PolarHBondContact OD1-NH1 2.78Å; D678-R681 IonicContact OD1-NH2 2.86Å; D678-R681 PolarHBondContact OD1-NH2 3.3Å; D678-R682 WeakPolarHBondContact O-CB 3.49Å; D678-R682 PolarHBondContact O-N 3.19Å; D678-F718 HydrophobicContact CB-CE1 4.06Å; D678-F718 HydrophobicContact CB-CZ 4.02Å
679	M	93.1	Very high	90	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.2	-40.3	172.1	-70.2	165.6	62.3	0	0	112.2	V675 V676 R682 L683 V714 L715 F718 L720 L727 L728	V675-M679 HydrophobicContact CG1-CG 4.48Å; V675-M679 HydrophobicContact CG1-SD 4.14Å; V675-M679 WeakPolarHBondContact O-CG 3.46Å; V675-M679 PolarHBondContact O-N 2.95Å; V676-M679 PolarHBondContact O-N 2.69Å; M679-R682 PolarHBondContact O-N 3.28Å; M679-L683 WeakPolarHBondContact O-CB 3.18Å; M679-L683 PolarHBondContact O-N 3.19Å; M679-V714 HydrophobicContact CB-CG1 3.76Å; M679-V714 HydrophobicContact CE-CG1 4.47Å; M679-V714 HydrophobicContact CG-CG1 4.07Å; M679-L715 HydrophobicContact CE-CD2 3.67Å; M679-F718 HydrophobicContact CB-CE2 4.42Å; M679-F718 HydrophobicContact CB-CZ 4.41Å; M679-F718 HydrophobicContact CG-CB 4.18Å; M679-F718 HydrophobicContact CG-CD1 3.51Å; M679-F718 HydrophobicContact CG-CD2 3.69Å; M679-F718 HydrophobicContact CG-CE1 3.65Å; M679-F718 HydrophobicContact CG-CE2 3.83Å; M679-F718 HydrophobicContact CG-CG 3.51Å; M679-F718 HydrophobicContact CG-CZ 3.8Å; M679-F718 HydrophobicContact SD-CB 4.42Å; M679-F718 HydrophobicContact SD-CD1 4.3Å; M679-F718 HydrophobicContact SD-CG 4.33Å; M679-L720 HydrophobicContact CE-CD1 3.64Å; M679-L720 HydrophobicContact SD-CD1 3.74Å; M679-L727 HydrophobicContact CE-CD2 4.27Å; M679-L728 HydrophobicContact CB-CD2 4.13Å; M679-L728 HydrophobicContact CE-CD1 4.19Å; M679-L728 HydrophobicContact CE-CD2 3.99Å; M679-L728 HydrophobicContact CE-CG 3.99Å
680	I	90.5	Very high	90.7	Very high	24 Å²	24	58 Å²	58	12%	0.123	29%	0.287	C	S	.	.	H	α-helix	trans	-67.7	-41.6	176.5	-70.3	166.6	0	0	0	110.9	V676 K677 D678 R682 L683 H684 L728 P731 F740	V676-I680 HydrophobicContact CG1-CD1 4.17Å; V676-I680 VanDerWaalsContact O-CG1 3.3Å; V676-I680 WeakPolarHBondContact O-CG1 3.08Å; V676-I680 PolarHBondContact O-N 3.43Å; K677-I680 PolarHBondContact O-N 2.94Å; D678-I680 VanDerWaalsContact C-N 3.33Å; D678-I680 PolarHBondContact O-N 3.01Å; I680-R682 VanDerWaalsContact C-N 3.32Å; I680-R682 PolarHBondContact O-N 2.93Å; I680-L683 PolarHBondContact O-N 3.21Å; I680-H684 PolarHBondContact O-N 3.27Å; I680-L728 HydrophobicContact CG1-CD2 4.2Å; I680-P731 HydrophobicContact CD1-CB 4.38Å; I680-P731 HydrophobicContact CD1-CG 4.49Å; I680-F740 HydrophobicContact CD1-CD1 3.51Å; I680-F740 HydrophobicContact CD1-CE1 3.79Å; I680-F740 HydrophobicContact CD1-CG 4.41Å
681	R	92.1	Very high	91.1	Very high	138 Å²	138	59.4 Å²	59.4	52%	0.521	29%	0.291	S	S	.	.	H	α-helix	trans	-57.7	-46.3	171.9	-168.9	-169.3	-51.7	112.4	14.4	110.8	K677 D678 L683 H684 E685	K677-R681 PolarHBondContact O-N 3.3Å; D678-R681 WeakPolarHBondContact O-CB 3.44Å; D678-R681 PolarHBondContact O-N 2.95Å; D678-R681 IonicContact OD1-CZ 2.74Å; D678-R681 IonicContact OD1-NH1 4Å; D678-R681 PolarHBondContact OD1-NH1 2.78Å; D678-R681 IonicContact OD1-NH2 2.86Å; D678-R681 PolarHBondContact OD1-NH2 3.3Å; R681-L683 VanDerWaalsContact C-N 3.35Å; R681-L683 PolarHBondContact O-N 3.06Å; R681-H684 WeakPolarHBondContact O-CA 3.24Å; R681-H684 WeakPolarHBondContact O-CB 3.46Å; R681-H684 PolarHBondContact O-N 3.24Å; R681-H684 VanDerWaalsContact O-N 3.09Å; R681-E685 PolarHBondContact O-N 2.81Å
682	R	94.3	Very high	91.3	Very high	69 Å²	69	58.9 Å²	58.9	26%	0.26	29%	0.288	S	S	.	.	H	α-helix	trans	-62.4	-39.7	178.5	-175.7	56.3	177	175.1	-3.8	112.8	D678 M679 I680 H684 E685 L686 V714 E717 F718	D678-R682 WeakPolarHBondContact O-CB 3.49Å; D678-R682 PolarHBondContact O-N 3.19Å; M679-R682 PolarHBondContact O-N 3.28Å; I680-R682 VanDerWaalsContact C-N 3.32Å; I680-R682 PolarHBondContact O-N 2.93Å; R682-H684 VanDerWaalsContact C-N 3.31Å; R682-H684 PolarHBondContact O-N 2.78Å; R682-E685 WeakPolarHBondContact CD-OE2 3.25Å; R682-E685 IonicContact CZ-OE2 2.74Å; R682-E685 IonicContact NE-OE2 3.4Å; R682-E685 IonicContact NH1-OE2 2.69Å; R682-E685 PolarHBondContact NH1-OE2 2.71Å; R682-E685 WeakPolarHBondContact O-CB 3.45Å; R682-E685 PolarHBondContact O-N 3.14Å; R682-L686 HydrophobicContact CG-CD1 4.39Å; R682-L686 WeakPolarHBondContact O-CG 3.45Å; R682-L686 PolarHBondContact O-N 2.82Å; R682-L686 VanDerWaalsContact O-N 3.09Å; R682-V714 HydrophobicContact CG-CG2 4.1Å; R682-E717 WeakPolarHBondContact CG-OE2 3.41Å; R682-E717 IonicContact CZ-OE1 2.67Å; R682-E717 IonicContact CZ-OE2 3.14Å; R682-E717 IonicContact NE-OE1 3.6Å; R682-E717 IonicContact NE-OE2 3.72Å; R682-E717 PolarHBondContact NE-OE2 3Å; R682-E717 IonicContact NH2-OE1 2.74Å; R682-E717 PolarHBondContact NH2-OE1 3.02Å; R682-E717 IonicContact NH2-OE2 3.99Å; R682-E717 PolarHBondContact NH2-OE2 2.78Å; R682-F718 HydrophobicContact CB-CE2 4.12Å; R682-F718 HydrophobicContact CG-CE2 4.22Å
683	L	93.1	Very high	91.4	Very high	5 Å²	5	60 Å²	60	3%	0.026	29%	0.287	C	S	.	.	H	α-helix	trans	-63.7	-36.8	173.5	-172.8	63.7	0	0	0	111.9	M679 I680 R681 R687 L710 Q711 V714 P745	M679-L683 WeakPolarHBondContact O-CB 3.18Å; M679-L683 PolarHBondContact O-N 3.19Å; I680-L683 PolarHBondContact O-N 3.21Å; R681-L683 VanDerWaalsContact C-N 3.35Å; R681-L683 PolarHBondContact O-N 3.06Å; L683-R687 WeakPolarHBondContact O-CD 3.41Å; L683-R687 VanDerWaalsContact O-CG 3.27Å; L683-R687 WeakPolarHBondContact O-CG 3.31Å; L683-R687 PolarHBondContact O-N 3.48Å; L683-L710 HydrophobicContact CD1-CB 3.7Å; L683-Q711 HydrophobicContact CD2-CG 4.5Å; L683-V714 HydrophobicContact CB-CG2 4.17Å; L683-V714 HydrophobicContact CD1-CG2 4.12Å; L683-P745 HydrophobicContact CD2-CB 3.82Å; L683-P745 HydrophobicContact CD2-CG 4.1Å
684	H	89.8	Confident	91.4	Very high	75 Å²	75	64.6 Å²	64.6	35%	0.347	30%	0.301	S	S	.	.	H	α-helix	trans	-68.2	-42.4	174.6	-174.7	119.7	0	0	0	111.9	I680 R681 R682 R687 H688 E743	I680-H684 PolarHBondContact O-N 3.27Å; R681-H684 WeakPolarHBondContact O-CA 3.24Å; R681-H684 WeakPolarHBondContact O-CB 3.46Å; R681-H684 PolarHBondContact O-N 3.24Å; R681-H684 VanDerWaalsContact O-N 3.09Å; R682-H684 VanDerWaalsContact C-N 3.31Å; R682-H684 PolarHBondContact O-N 2.78Å; H684-R687 PolarHBondContact O-N 2.98Å; H684-H688 AromaticContact CD2-CE1 3.52Å; H684-H688 AromaticContact CD2-ND1 3.51Å; H684-H688 AromaticContact CE1-CE1 3.81Å; H684-H688 AromaticContact NE2-CE1 3.2Å; H684-H688 PolarHBondContact NE2-CE1 3.46Å; H684-H688 AromaticContact NE2-ND1 3.65Å; H684-H688 PolarHBondContact O-ND1 2.96Å; H684-E743 IonicContact CE1-OE1 3.26Å; H684-E743 IonicContact CE1-OE2 3.13Å; H684-E743 PolarHBondContact CE1-OE2 2.72Å; H684-E743 VanDerWaalsContact CE1-OE2 3.32Å; H684-E743 IonicContact CG-OE2 3.74Å; H684-E743 IonicContact ND1-OE2 3.43Å; H684-E743 PolarHBondContact ND1-OE2 2.82Å
685	E	93.5	Very high	91.4	Very high	87 Å²	87	61.1 Å²	61.1	41%	0.407	28%	0.277	S	S	.	.	H	α-helix	trans	-55.8	-52.1	173.2	-70.4	165.5	-157.4	0	0	111.6	R681 R682 R687 H688	R681-E685 PolarHBondContact O-N 2.81Å; R682-E685 WeakPolarHBondContact CD-OE2 3.25Å; R682-E685 IonicContact CZ-OE2 2.74Å; R682-E685 IonicContact NE-OE2 3.4Å; R682-E685 IonicContact NH1-OE2 2.69Å; R682-E685 PolarHBondContact NH1-OE2 2.71Å; R682-E685 WeakPolarHBondContact O-CB 3.45Å; R682-E685 PolarHBondContact O-N 3.14Å; E685-R687 VanDerWaalsContact C-N 3.28Å; E685-R687 PolarHBondContact O-N 2.72Å; E685-H688 PolarHBondContact O-N 2.82Å
686	L	93.6	Very high	91.2	Very high	9 Å²	9	62.5 Å²	62.5	5%	0.047	28%	0.277	C	S	.	.	H	α-helix	trans	-62.7	-35.7	-176.7	-67.4	169.1	0	0	0	112	R682 H688 T689 V692 L710 R713 V714	R682-L686 HydrophobicContact CG-CD1 4.39Å; R682-L686 WeakPolarHBondContact O-CG 3.45Å; R682-L686 PolarHBondContact O-N 2.82Å; R682-L686 VanDerWaalsContact O-N 3.09Å; L686-H688 PolarHBondContact O-N 3.2Å; L686-T689 PolarHBondContact O-N 3.47Å; L686-T689 VanDerWaalsContact O-N 3.16Å; L686-T689 PolarHBondContact O-OG1 2.98Å; L686-V692 WeakPolarHBondContact O-CB 3.36Å; L686-V692 WeakPolarHBondContact O-CG2 3.29Å; L686-L710 HydrophobicContact CB-CD2 4.02Å; L686-R713 HydrophobicContact CD1-CG 4.24Å; L686-V714 HydrophobicContact CD1-CG2 3.66Å
687	R	91	Very high	91.1	Very high	49 Å²	49	66.6 Å²	66.6	19%	0.185	31%	0.312	C	S	.	.	H	α-helix	trans	-58.8	-24.7	174.4	-80.5	169.6	165.5	-164.3	-9.6	113.9	L683 H684 E685 L710 P745	L683-R687 WeakPolarHBondContact O-CD 3.41Å; L683-R687 VanDerWaalsContact O-CG 3.27Å; L683-R687 WeakPolarHBondContact O-CG 3.31Å; L683-R687 PolarHBondContact O-N 3.48Å; H684-R687 PolarHBondContact O-N 2.98Å; E685-R687 VanDerWaalsContact C-N 3.28Å; E685-R687 PolarHBondContact O-N 2.72Å; R687-L710 HydrophobicContact CG-CD1 4.31Å; R687-P745 PolarHBondContact NH2-O 2.93Å
688	H	90.4	Very high	90.8	Very high	115 Å²	115	65 Å²	65	53%	0.532	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	2.9	-179.7	-70.1	88	0	0	0	114.3	H684 E685 L686 Q693	H684-H688 AromaticContact CD2-CE1 3.52Å; H684-H688 AromaticContact CD2-ND1 3.51Å; H684-H688 AromaticContact CE1-CE1 3.81Å; H684-H688 AromaticContact NE2-CE1 3.2Å; H684-H688 PolarHBondContact NE2-CE1 3.46Å; H684-H688 AromaticContact NE2-ND1 3.65Å; H684-H688 PolarHBondContact O-ND1 2.96Å; E685-H688 PolarHBondContact O-N 2.82Å; L686-H688 PolarHBondContact O-N 3.2Å; H688-Q693 PolarHBondContact O-NE2 3.44Å
689	T	93.4	Very high	89.6	Confident	53 Å²	53	67.6 Å²	67.6	33%	0.325	32%	0.32	S	S	.	.	S	Bend	trans	-77.1	141.7	174.4	64.1	0	0	0	0	111.8	L686 Q691 V692 Q693	L686-T689 PolarHBondContact O-N 3.47Å; L686-T689 VanDerWaalsContact O-N 3.16Å; L686-T689 PolarHBondContact O-OG1 2.98Å; T689-Q691 PolarHBondContact O-N 3.19Å; T689-V692 PolarHBondContact O-N 2.91Å; T689-V692 WeakPolarHBondContact OG1-CB 3.26Å; T689-V692 WeakPolarHBondContact OG1-CG2 3.41Å; T689-Q693 WeakPolarHBondContact O-CG 3.29Å; T689-Q693 PolarHBondContact O-N 3.47Å
690	E	91.1	Very high	88	Confident	168 Å²	168	67.8 Å²	67.8	79%	0.785	32%	0.322	S	S	*	.	H	α-helix	trans	-55.6	-38.2	-179.5	-61.4	-174.7	157.6	0	0	112.7	V692 Q693 R694	E690-V692 VanDerWaalsContact C-N 3.32Å; E690-V692 PolarHBondContact O-N 2.99Å; E690-Q693 PolarHBondContact O-N 3.18Å; E690-R694 VanDerWaalsContact O-CB 3.27Å; E690-R694 WeakPolarHBondContact O-CB 3.37Å; E690-R694 PolarHBondContact O-N 3.07Å
691	Q	90.5	Very high	86.4	Confident	66 Å²	66	67.3 Å²	67.3	31%	0.308	32%	0.323	S	S	.	.	H	α-helix	trans	-57.2	-44.5	176.6	-177.3	-178.8	3.2	0	0	112.1	E113 L114 T689 A695	E113-Q691 PolarHBondContact OE1-NE2 2.95Å; L114-Q691 HydrophobicContact CD2-CG 3.89Å; T689-Q691 PolarHBondContact O-N 3.19Å; Q691-A695 PolarHBondContact O-N 2.86Å; Q691-A695 VanDerWaalsContact O-N 3.12Å
692	V	91.3	Very high	85.1	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.018	33%	0.33	C	S	.	.	H	α-helix	trans	-75.9	-41.9	-179.6	171.3	0	0	0	0	111.1	L114 L686 T689 E690 R694 A695 Y696 V706 L710	L114-V692 HydrophobicContact CD1-CG2 4.42Å; L114-V692 HydrophobicContact CD2-CG2 3.59Å; L686-V692 WeakPolarHBondContact O-CB 3.36Å; L686-V692 WeakPolarHBondContact O-CG2 3.29Å; T689-V692 PolarHBondContact O-N 2.91Å; T689-V692 WeakPolarHBondContact OG1-CB 3.26Å; T689-V692 WeakPolarHBondContact OG1-CG2 3.41Å; E690-V692 VanDerWaalsContact C-N 3.32Å; E690-V692 PolarHBondContact O-N 2.99Å; V692-R694 VanDerWaalsContact C-N 3.3Å; V692-R694 PolarHBondContact O-N 3.27Å; V692-A695 PolarHBondContact O-N 2.9Å; V692-A695 VanDerWaalsContact O-N 3.15Å; V692-Y696 HydrophobicContact CG1-CD2 3.77Å; V692-Y696 HydrophobicContact CG1-CE2 3.46Å; V692-Y696 VanDerWaalsContact CG1-CE2 3.46Å; V692-Y696 VanDerWaalsContact O-CD2 3.23Å; V692-Y696 WeakPolarHBondContact O-CD2 3.29Å; V692-Y696 PolarHBondContact O-N 3.47Å; V692-V706 HydrophobicContact CG1-CG1 4.39Å; V692-L710 HydrophobicContact CG1-CD1 3.74Å; V692-L710 HydrophobicContact CG2-CD1 4.41Å; V692-L710 HydrophobicContact CG2-CD2 3.73Å
693	Q	90.4	Very high	84.4	Confident	97 Å²	97	65.3 Å²	65.3	45%	0.453	33%	0.327	S	S	.	.	H	α-helix	trans	-59.5	-41.1	174.3	-69	177.5	-5.6	0	0	111.6	H688 T689 E690 Y696 A697	H688-Q693 PolarHBondContact O-NE2 3.44Å; T689-Q693 WeakPolarHBondContact O-CG 3.29Å; T689-Q693 PolarHBondContact O-N 3.47Å; E690-Q693 PolarHBondContact O-N 3.18Å; Q693-Y696 PolarHBondContact O-N 2.92Å; Q693-A697 WeakPolarHBondContact O-CB 3.47Å; Q693-A697 PolarHBondContact O-N 3.42Å
694	R	88.9	Confident	84	Confident	143 Å²	143	67.7 Å²	67.7	54%	0.54	35%	0.348	S	S	.	.	H	α-helix	trans	-62.4	-42.8	172.9	-175	179.2	-177.1	176.4	2.6	112.2	E106 E690 V692 Y696 A697 L698	E106-R694 IonicContact OE1-CZ 2.78Å; E106-R694 IonicContact OE1-NE 3.79Å; E106-R694 IonicContact OE1-NH2 3.29Å; E106-R694 PolarHBondContact OE1-NH2 3.1Å; E690-R694 VanDerWaalsContact O-CB 3.27Å; E690-R694 WeakPolarHBondContact O-CB 3.37Å; E690-R694 PolarHBondContact O-N 3.07Å; V692-R694 VanDerWaalsContact C-N 3.3Å; V692-R694 PolarHBondContact O-N 3.27Å; R694-Y696 VanDerWaalsContact C-N 3.34Å; R694-Y696 PolarHBondContact O-N 3.38Å; R694-A697 PolarHBondContact O-N 2.86Å; R694-L698 HydrophobicContact CG-CD1 3.83Å; R694-L698 HydrophobicContact CG-CG 4.36Å; R694-L698 WeakPolarHBondContact O-CB 3.44Å; R694-L698 VanDerWaalsContact O-CG 3.32Å; R694-L698 WeakPolarHBondContact O-CG 3.26Å; R694-L698 PolarHBondContact O-N 2.95Å
695	A	88.7	Confident	83.8	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-64.6	-35	176.5	0	0	0	0	0	112.9	A110 L114 Q691 V692 C700 V706	A110-A695 HydrophobicContact CB-CB 4.22Å; L114-A695 HydrophobicContact CD1-CB 3.57Å; Q691-A695 PolarHBondContact O-N 2.86Å; Q691-A695 VanDerWaalsContact O-N 3.12Å; V692-A695 PolarHBondContact O-N 2.9Å; V692-A695 VanDerWaalsContact O-N 3.15Å; A695-C700 PolarHBondContact O-SG 3.49Å; A695-V706 HydrophobicContact CB-CG1 4.14Å; A695-V706 HydrophobicContact CB-CG2 4.09Å
696	Y	87.6	Confident	83.6	Confident	73 Å²	73	62.4 Å²	62.4	29%	0.286	33%	0.327	S	S	.	.	H	α-helix	trans	-68.8	-43.4	170.2	-76.2	-65.9	0	0	0	112.3	V692 Q693 R694 L698 N699 G703 V706 S707 L710	V692-Y696 HydrophobicContact CG1-CD2 3.77Å; V692-Y696 HydrophobicContact CG1-CE2 3.46Å; V692-Y696 VanDerWaalsContact CG1-CE2 3.46Å; V692-Y696 VanDerWaalsContact O-CD2 3.23Å; V692-Y696 WeakPolarHBondContact O-CD2 3.29Å; V692-Y696 PolarHBondContact O-N 3.47Å; Q693-Y696 PolarHBondContact O-N 2.92Å; R694-Y696 VanDerWaalsContact C-N 3.34Å; R694-Y696 PolarHBondContact O-N 3.38Å; Y696-L698 VanDerWaalsContact C-N 3.34Å; Y696-L698 PolarHBondContact O-N 3.47Å; Y696-N699 PolarHBondContact O-N 3.43Å; Y696-N699 VanDerWaalsContact O-N 3.08Å; Y696-G703 WeakPolarHBondContact CE1-O 3.5Å; Y696-V706 HydrophobicContact CD1-CB 4.2Å; Y696-V706 HydrophobicContact CD1-CG1 4.15Å; Y696-V706 HydrophobicContact CD2-CG1 4Å; Y696-V706 HydrophobicContact CE1-CB 3.75Å; Y696-V706 HydrophobicContact CE1-CG1 3.77Å; Y696-V706 HydrophobicContact CE2-CB 4.49Å; Y696-V706 HydrophobicContact CE2-CG1 3.6Å; Y696-V706 HydrophobicContact CG-CG1 4.25Å; Y696-V706 VanDerWaalsContact CZ-CG1 3.46Å; Y696-S707 PolarHBondContact OH-N 3.4Å; Y696-S707 PolarHBondContact OH-OG 3.35Å; Y696-L710 HydrophobicContact CE2-CD1 4.46Å
697	A	87.6	Confident	83.5	Confident	87 Å²	87	62.9 Å²	62.9	72%	0.719	33%	0.331	S	S	*	.	H	α-helix	trans	-64	-35.6	-179.5	0	0	0	0	0	113.3	Q693 R694 N699	Q693-A697 WeakPolarHBondContact O-CB 3.47Å; Q693-A697 PolarHBondContact O-N 3.42Å; R694-A697 PolarHBondContact O-N 2.86Å; A697-N699 PolarHBondContact O-N 3.35Å
698	L	82.9	Confident	83.5	Confident	46 Å²	46	65.2 Å²	65.2	24%	0.241	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-0.9	174.9	-70.3	169.3	0	0	0	113.7	E106 A110 R694 Y696 C700	E106-L698 HydrophobicContact CG-CD1 3.65Å; E106-L698 HydrophobicContact CG-CD2 3.92Å; E106-L698 HydrophobicContact CG-CG 4.47Å; A110-L698 HydrophobicContact CB-CD1 3.9Å; R694-L698 HydrophobicContact CG-CD1 3.83Å; R694-L698 HydrophobicContact CG-CG 4.36Å; R694-L698 WeakPolarHBondContact O-CB 3.44Å; R694-L698 VanDerWaalsContact O-CG 3.32Å; R694-L698 WeakPolarHBondContact O-CG 3.26Å; R694-L698 PolarHBondContact O-N 2.95Å; Y696-L698 VanDerWaalsContact C-N 3.34Å; Y696-L698 PolarHBondContact O-N 3.47Å; L698-C700 VanDerWaalsContact C-N 3.33Å; L698-C700 PolarHBondContact O-N 3.13Å
699	N	67.2	Low	83.6	Confident	113 Å²	113	61.2 Å²	61.2	60%	0.604	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	44.9	174	-170.9	29.4	0	0	0	113.7	Y696 A697 G701	Y696-N699 PolarHBondContact O-N 3.43Å; Y696-N699 VanDerWaalsContact O-N 3.08Å; A697-N699 PolarHBondContact O-N 3.35Å; N699-G701 PolarHBondContact O-N 3.31Å
700	C	61	Low	83.6	Confident	4 Å²	4	58.9 Å²	58.9	3%	0.027	31%	0.307	C	S	.	.			trans	-67.4	59.6	-168	-50.6	0	0	0	0	115.7	G107 A695 L698 V706	G107-C700 VanDerWaalsContact C-SG 3.51Å; G107-C700 WeakPolarHBondContact CA-SG 3.45Å; G107-C700 PolarHBondContact O-SG 3.49Å; A695-C700 PolarHBondContact O-SG 3.49Å; L698-C700 VanDerWaalsContact C-N 3.33Å; L698-C700 PolarHBondContact O-N 3.13Å; C700-V706 HydrophobicContact CB-CG2 4.39Å
701	G	56	Low	83.8	Confident	14 Å²	14	51.4 Å²	51.4	14%	0.144	27%	0.272	C	S	.	.	S	Bend	trans	73.4	58.2	-179.5	0	0	0	0	0	113.1	N699 T705	N699-G701 PolarHBondContact O-N 3.31Å; G701-T705 PolarHBondContact O-OG1 3Å
702	E	65.4	Low	84	Confident	144 Å²	144	48.7 Å²	48.7	67%	0.673	26%	0.26	S	S	*	.			trans	64.6	135.3	-178.4	-55.4	-175.2	-177.9	0	0	114	A704 T705	E702-A704 PolarHBondContact O-N 3.36Å; E702-T705 PolarHBondContact O-N 3.03Å; E702-T705 PolarHBondContact O-OG1 3.42Å
703	G	78.8	Confident	84.2	Confident	20 Å²	20	50.9 Å²	50.9	21%	0.206	27%	0.268	C	S	.	.	H	α-helix	trans	-60	-15.3	-173.8	0	0	0	0	0	115.2	Y696 T705 V706 S707	Y696-G703 WeakPolarHBondContact CE1-O 3.5Å; G703-T705 VanDerWaalsContact C-N 3.31Å; G703-T705 PolarHBondContact O-N 3.35Å; G703-V706 PolarHBondContact O-N 2.95Å; G703-S707 PolarHBondContact O-N 2.92Å; G703-S707 PolarHBondContact O-OG 3.41Å
704	A	84.2	Confident	84.5	Confident	55 Å²	55	46.3 Å²	46.3	46%	0.455	25%	0.247	S	C	.	.	H	α-helix	trans	-58.7	-39.3	170.3	0	0	0	0	0	112.6	E702 S707 Y708	E702-A704 PolarHBondContact O-N 3.36Å; A704-S707 PolarHBondContact O-N 2.92Å; A704-Y708 WeakPolarHBondContact O-CB 3.41Å; A704-Y708 PolarHBondContact O-N 3.48Å
705	T	86.6	Confident	84.8	Confident	51 Å²	51	39.5 Å²	39.5	31%	0.313	22%	0.221	S	C	.	.	H	α-helix	trans	-66.2	-44.2	-178.9	-50.2	0	0	0	0	111.1	L111 G701 E702 G703 Y708 E709	L111-T705 HydrophobicContact CD1-CG2 4.05Å; L111-T705 HydrophobicContact CD2-CG2 3.74Å; G701-T705 PolarHBondContact O-OG1 3Å; E702-T705 PolarHBondContact O-N 3.03Å; E702-T705 PolarHBondContact O-OG1 3.42Å; G703-T705 VanDerWaalsContact C-N 3.31Å; G703-T705 PolarHBondContact O-N 3.35Å; T705-Y708 PolarHBondContact O-N 2.86Å; T705-E709 PolarHBondContact O-N 3.15Å
706	V	89.5	Confident	85.1	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-41.5	173.6	179	0	0	0	0	111	L111 L114 V692 A695 Y696 C700 G703 Y708 L710	L111-V706 HydrophobicContact CD1-CG2 4.33Å; L114-V706 HydrophobicContact CD1-CG1 3.78Å; V692-V706 HydrophobicContact CG1-CG1 4.39Å; A695-V706 HydrophobicContact CB-CG1 4.14Å; A695-V706 HydrophobicContact CB-CG2 4.09Å; Y696-V706 HydrophobicContact CD1-CB 4.2Å; Y696-V706 HydrophobicContact CD1-CG1 4.15Å; Y696-V706 HydrophobicContact CD2-CG1 4Å; Y696-V706 HydrophobicContact CE1-CB 3.75Å; Y696-V706 HydrophobicContact CE1-CG1 3.77Å; Y696-V706 HydrophobicContact CE2-CB 4.49Å; Y696-V706 HydrophobicContact CE2-CG1 3.6Å; Y696-V706 HydrophobicContact CG-CG1 4.25Å; Y696-V706 VanDerWaalsContact CZ-CG1 3.46Å; C700-V706 HydrophobicContact CB-CG2 4.39Å; G703-V706 PolarHBondContact O-N 2.95Å; V706-Y708 VanDerWaalsContact C-N 3.31Å; V706-Y708 PolarHBondContact O-N 3.41Å; V706-L710 HydrophobicContact CG1-CD1 4.35Å; V706-L710 WeakPolarHBondContact O-CD1 3.23Å; V706-L710 VanDerWaalsContact O-CG 3.28Å; V706-L710 WeakPolarHBondContact O-CG 3.32Å; V706-L710 PolarHBondContact O-N 3.16Å
707	S	90.4	Very high	85.5	Confident	18 Å²	18	39.1 Å²	39.1	13%	0.126	22%	0.221	C	C	.	.	H	α-helix	trans	-63	-33.7	174.4	-78.8	0	0	0	0	113.4	Y696 G703 A704 L710 Q711	Y696-S707 PolarHBondContact OH-N 3.4Å; Y696-S707 PolarHBondContact OH-OG 3.35Å; G703-S707 PolarHBondContact O-N 2.92Å; G703-S707 PolarHBondContact O-OG 3.41Å; A704-S707 PolarHBondContact O-N 2.92Å; S707-L710 PolarHBondContact O-N 2.69Å; S707-Q711 VanDerWaalsContact O-CG 3.26Å; S707-Q711 WeakPolarHBondContact O-CG 3.37Å; S707-Q711 PolarHBondContact O-N 3.03Å
708	Y	91.2	Very high	85.7	Confident	98 Å²	98	38.3 Å²	38.3	38%	0.384	20%	0.201	S	C	.	.	H	α-helix	trans	-70.9	-45.1	-178.7	-176	-103.5	0	0	0	112.5	A704 T705 V706 L710 Q711 L712 T725	A704-Y708 WeakPolarHBondContact O-CB 3.41Å; A704-Y708 PolarHBondContact O-N 3.48Å; T705-Y708 PolarHBondContact O-N 2.86Å; V706-Y708 VanDerWaalsContact C-N 3.31Å; V706-Y708 PolarHBondContact O-N 3.41Å; Y708-L710 PolarHBondContact O-N 3.01Å; Y708-Q711 PolarHBondContact O-N 3.33Å; Y708-Q711 VanDerWaalsContact O-N 3.1Å; Y708-L712 HydrophobicContact CD1-CD1 4.01Å; Y708-L712 HydrophobicContact CD1-CG 4.33Å; Y708-L712 HydrophobicContact CE1-CD1 3.54Å; Y708-L712 HydrophobicContact CE1-CD2 4.41Å; Y708-L712 HydrophobicContact CE1-CG 3.98Å; Y708-L712 PolarHBondContact O-N 3.45Å; Y708-T725 HydrophobicContact CD2-CG2 4.25Å; Y708-T725 HydrophobicContact CE2-CG2 3.77Å
709	E	92.9	Very high	86.1	Confident	31 Å²	31	38.8 Å²	38.8	15%	0.145	22%	0.218	C	C	.	.	H	α-helix	trans	-59.6	-36.6	174.3	-63.6	-61.2	164.5	0	0	111.8	L111 L114 S115 A118 T705 L712 R713	L111-E709 HydrophobicContact CD1-CG 3.99Å; L114-E709 HydrophobicContact CB-CB 4.3Å; S115-E709 WeakPolarHBondContact CA-OE2 3.2Å; S115-E709 WeakPolarHBondContact CB-OE2 3.41Å; A118-E709 WeakPolarHBondContact CB-O 3.41Å; T705-E709 PolarHBondContact O-N 3.15Å; E709-L712 PolarHBondContact O-N 2.92Å; E709-R713 WeakPolarHBondContact O-CB 3.47Å; E709-R713 PolarHBondContact O-N 3.38Å
710	L	93.8	Very high	87.3	Confident	4 Å²	4	35 Å²	35	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-67.6	-39.6	174.5	-64.9	170.1	0	0	0	112.6	L683 L686 R687 V692 Y696 V706 S707 Y708 R713 V714	L683-L710 HydrophobicContact CD1-CB 3.7Å; L686-L710 HydrophobicContact CB-CD2 4.02Å; R687-L710 HydrophobicContact CG-CD1 4.31Å; V692-L710 HydrophobicContact CG1-CD1 3.74Å; V692-L710 HydrophobicContact CG2-CD1 4.41Å; V692-L710 HydrophobicContact CG2-CD2 3.73Å; Y696-L710 HydrophobicContact CE2-CD1 4.46Å; V706-L710 HydrophobicContact CG1-CD1 4.35Å; V706-L710 WeakPolarHBondContact O-CD1 3.23Å; V706-L710 VanDerWaalsContact O-CG 3.28Å; V706-L710 WeakPolarHBondContact O-CG 3.32Å; V706-L710 PolarHBondContact O-N 3.16Å; S707-L710 PolarHBondContact O-N 2.69Å; Y708-L710 PolarHBondContact O-N 3.01Å; L710-R713 PolarHBondContact O-N 3Å; L710-V714 WeakPolarHBondContact O-CG2 3.46Å; L710-V714 PolarHBondContact O-N 3.42Å
711	Q	94.3	Very high	88.6	Confident	11 Å²	11	37.1 Å²	37.1	5%	0.051	22%	0.215	C	C	.	.	H	α-helix	trans	-64.5	-42.7	174.6	-71.6	164.3	-0.3	0	0	111.2	L683 S707 Y708 V714 L715 T725 L728 Q729	L683-Q711 HydrophobicContact CD2-CG 4.5Å; S707-Q711 VanDerWaalsContact O-CG 3.26Å; S707-Q711 WeakPolarHBondContact O-CG 3.37Å; S707-Q711 PolarHBondContact O-N 3.03Å; Y708-Q711 PolarHBondContact O-N 3.33Å; Y708-Q711 VanDerWaalsContact O-N 3.1Å; Q711-V714 PolarHBondContact O-N 3.42Å; Q711-L715 WeakPolarHBondContact O-CB 3.45Å; Q711-L715 VanDerWaalsContact O-CG 3.25Å; Q711-L715 WeakPolarHBondContact O-CG 3.41Å; Q711-L715 PolarHBondContact O-N 2.86Å; Q711-T725 HydrophobicContact CB-CG2 4.05Å; Q711-L728 HydrophobicContact CB-CD1 4.04Å; Q711-L728 HydrophobicContact CG-CB 4.04Å; Q711-L728 HydrophobicContact CG-CD1 4.06Å; Q711-Q729 VanDerWaalsContact OE1-CG 3.3Å
712	L	94.9	Very high	90.2	Very high	10 Å²	10	39.4 Å²	39.4	5%	0.052	22%	0.224	C	C	.	.	H	α-helix	trans	-60.1	-45.4	173.4	-70.4	-178.4	0	0	0	111.9	A118 Y708 E709 L715 R716 D722 T725	A118-L712 HydrophobicContact CB-CB 4.38Å; Y708-L712 HydrophobicContact CD1-CD1 4.01Å; Y708-L712 HydrophobicContact CD1-CG 4.33Å; Y708-L712 HydrophobicContact CE1-CD1 3.54Å; Y708-L712 HydrophobicContact CE1-CD2 4.41Å; Y708-L712 HydrophobicContact CE1-CG 3.98Å; Y708-L712 PolarHBondContact O-N 3.45Å; E709-L712 PolarHBondContact O-N 2.92Å; L712-L715 PolarHBondContact O-N 3.25Å; L712-R716 WeakPolarHBondContact O-CB 3.48Å; L712-R716 WeakPolarHBondContact O-CD 3.43Å; L712-R716 WeakPolarHBondContact O-CG 3.32Å; L712-R716 PolarHBondContact O-N 3.02Å; L712-D722 HydrophobicContact CD2-CB 3.64Å; L712-T725 HydrophobicContact CD2-CG2 3.91Å
713	R	96.5	Very high	91.1	Very high	49 Å²	49	34.5 Å²	34.5	19%	0.185	21%	0.212	C	C	.	.	H	α-helix	trans	-56.1	-52.1	175.3	179	174.8	171	143.3	15.8	111.4	A118 A121 L686 E709 L710 R716 E717	A118-R713 HydrophobicContact CB-CB 4Å; A121-R713 HydrophobicContact CB-CG 4.22Å; L686-R713 HydrophobicContact CD1-CG 4.24Å; E709-R713 WeakPolarHBondContact O-CB 3.47Å; E709-R713 PolarHBondContact O-N 3.38Å; L710-R713 PolarHBondContact O-N 3Å; R713-R716 PolarHBondContact O-N 3.46Å; R713-E717 HydrophobicContact CG-CG 4.32Å; R713-E717 IonicContact CZ-OE1 2.66Å; R713-E717 VanDerWaalsContact CZ-OE1 3.28Å; R713-E717 IonicContact NE-OE1 3.69Å; R713-E717 PolarHBondContact NE-OE1 3.13Å; R713-E717 IonicContact NH2-OE1 3.16Å; R713-E717 PolarHBondContact NH2-OE1 3.26Å; R713-E717 WeakPolarHBondContact O-CB 3.38Å; R713-E717 WeakPolarHBondContact O-CG 3.01Å; R713-E717 PolarHBondContact O-N 3.12Å
714	V	96.3	Very high	91.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.2	-44.7	-178.4	173.5	0	0	0	0	111.6	M679 R682 L683 L686 L710 Q711 R716 E717 F718 L728	M679-V714 HydrophobicContact CB-CG1 3.76Å; M679-V714 HydrophobicContact CE-CG1 4.47Å; M679-V714 HydrophobicContact CG-CG1 4.07Å; R682-V714 HydrophobicContact CG-CG2 4.1Å; L683-V714 HydrophobicContact CB-CG2 4.17Å; L683-V714 HydrophobicContact CD1-CG2 4.12Å; L686-V714 HydrophobicContact CD1-CG2 3.66Å; L710-V714 WeakPolarHBondContact O-CG2 3.46Å; L710-V714 PolarHBondContact O-N 3.42Å; Q711-V714 PolarHBondContact O-N 3.42Å; V714-R716 VanDerWaalsContact C-N 3.3Å; V714-R716 PolarHBondContact O-N 3.3Å; V714-E717 PolarHBondContact O-N 2.92Å; V714-F718 HydrophobicContact CG1-CD2 4.18Å; V714-F718 HydrophobicContact CG1-CE2 4.34Å; V714-F718 VanDerWaalsContact O-CD2 3.29Å; V714-F718 WeakPolarHBondContact O-CD2 3.49Å; V714-F718 PolarHBondContact O-N 3.17Å; V714-F718 VanDerWaalsContact O-N 3.11Å; V714-L728 HydrophobicContact CB-CD1 4.1Å; V714-L728 HydrophobicContact CG1-CD1 4.03Å
715	L	94.5	Very high	91.7	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.5	-45.7	176.9	-72.7	168.4	0	0	0	111.6	M679 Q711 L712 F718 G719 L720 A724 T725 L728	M679-L715 HydrophobicContact CE-CD2 3.67Å; Q711-L715 WeakPolarHBondContact O-CB 3.45Å; Q711-L715 VanDerWaalsContact O-CG 3.25Å; Q711-L715 WeakPolarHBondContact O-CG 3.41Å; Q711-L715 PolarHBondContact O-N 2.86Å; L712-L715 PolarHBondContact O-N 3.25Å; L715-F718 CarbonylContact O-C 3.56Å; L715-F718 PolarHBondContact O-N 3.1Å; L715-F718 VanDerWaalsContact O-N 3.15Å; L715-G719 PolarHBondContact O-N 3.48Å; L715-L720 CarbonylContact C-O 3.46Å; L715-L720 HydrophobicContact CB-CB 4.19Å; L715-L720 HydrophobicContact CD2-CB 3.8Å; L715-L720 HydrophobicContact CD2-CD1 3.81Å; L715-L720 HydrophobicContact CD2-CG 4.48Å; L715-L720 PolarHBondContact O-N 3.4Å; L715-A724 HydrophobicContact CD1-CB 4.38Å; L715-A724 HydrophobicContact CD2-CB 3.81Å; L715-T725 HydrophobicContact CD1-CG2 3.5Å; L715-T725 VanDerWaalsContact CD1-CG2 3.5Å; L715-L728 HydrophobicContact CD2-CD1 4.44Å; L715-L728 HydrophobicContact CG-CD1 4.18Å
716	R	95.4	Very high	91.5	Very high	23 Å²	23	33 Å²	33	9%	0.087	19%	0.188	C	C	.	.	H	α-helix	trans	-70.3	-38.2	-179.1	-67.5	166.8	-177.2	170.3	1.8	112.6	A118 A121 R122 A123 L712 R713 V714 F718 G719 D722	A118-R716 WeakPolarHBondContact O-CD 3.39Å; A118-R716 PolarHBondContact O-NH1 3.13Å; A121-R716 HydrophobicContact CB-CB 3.66Å; A121-R716 WeakPolarHBondContact O-CB 3.29Å; R122-R716 CarbonylContact C-O 3.33Å; R122-R716 VanDerWaalsContact CA-O 3.28Å; R122-R716 WeakPolarHBondContact CA-O 3.45Å; A123-R716 PolarHBondContact N-O 3.25Å; L712-R716 WeakPolarHBondContact O-CB 3.48Å; L712-R716 WeakPolarHBondContact O-CD 3.43Å; L712-R716 WeakPolarHBondContact O-CG 3.32Å; L712-R716 PolarHBondContact O-N 3.02Å; R713-R716 PolarHBondContact O-N 3.46Å; V714-R716 VanDerWaalsContact C-N 3.3Å; V714-R716 PolarHBondContact O-N 3.3Å; R716-F718 PolarHBondContact O-N 2.91Å; R716-G719 PolarHBondContact O-N 2.97Å; R716-G719 VanDerWaalsContact O-N 3.12Å; R716-D722 IonicContact CZ-OD1 3.94Å; R716-D722 IonicContact CZ-OD2 2.89Å; R716-D722 IonicContact NE-OD1 3.02Å; R716-D722 PolarHBondContact NE-OD1 2.96Å; R716-D722 IonicContact NE-OD2 2.66Å; R716-D722 VanDerWaalsContact NH2-CG 3.28Å; R716-D722 IonicContact NH2-OD1 3.12Å; R716-D722 PolarHBondContact NH2-OD1 3.46Å; R716-D722 IonicContact NH2-OD2 3.42Å; R716-D722 PolarHBondContact NH2-OD2 3.46Å
717	E	95.4	Very high	91.3	Very high	42 Å²	42	33 Å²	33	20%	0.196	19%	0.188	C	C	.	.	H	α-helix	trans	-59	-26.5	170	-76.3	-179.7	167.5	0	0	111.9	A121 A123 R682 R713 V714	A121-E717 HydrophobicContact CB-CG 4.05Å; A123-E717 WeakPolarHBondContact CA-O 3.46Å; R682-E717 WeakPolarHBondContact CG-OE2 3.41Å; R682-E717 IonicContact CZ-OE1 2.67Å; R682-E717 IonicContact CZ-OE2 3.14Å; R682-E717 IonicContact NE-OE1 3.6Å; R682-E717 IonicContact NE-OE2 3.72Å; R682-E717 PolarHBondContact NE-OE2 3Å; R682-E717 IonicContact NH2-OE1 2.74Å; R682-E717 PolarHBondContact NH2-OE1 3.02Å; R682-E717 IonicContact NH2-OE2 3.99Å; R682-E717 PolarHBondContact NH2-OE2 2.78Å; R713-E717 HydrophobicContact CG-CG 4.32Å; R713-E717 IonicContact CZ-OE1 2.66Å; R713-E717 VanDerWaalsContact CZ-OE1 3.28Å; R713-E717 IonicContact NE-OE1 3.69Å; R713-E717 PolarHBondContact NE-OE1 3.13Å; R713-E717 IonicContact NH2-OE1 3.16Å; R713-E717 PolarHBondContact NH2-OE1 3.26Å; R713-E717 WeakPolarHBondContact O-CB 3.38Å; R713-E717 WeakPolarHBondContact O-CG 3.01Å; R713-E717 PolarHBondContact O-N 3.12Å; V714-E717 PolarHBondContact O-N 2.92Å
718	F	93.6	Very high	91.1	Very high	70 Å²	70	32.1 Å²	32.1	31%	0.307	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	11.2	176.5	-78.5	-104.8	0	0	0	114.2	V675 D678 M679 R682 V714 L715 R716 L720	V675-F718 HydrophobicContact CG1-CD1 3.6Å; V675-F718 HydrophobicContact CG1-CE1 3.98Å; D678-F718 HydrophobicContact CB-CE1 4.06Å; D678-F718 HydrophobicContact CB-CZ 4.02Å; M679-F718 HydrophobicContact CB-CE2 4.42Å; M679-F718 HydrophobicContact CB-CZ 4.41Å; M679-F718 HydrophobicContact CG-CB 4.18Å; M679-F718 HydrophobicContact CG-CD1 3.51Å; M679-F718 HydrophobicContact CG-CD2 3.69Å; M679-F718 HydrophobicContact CG-CE1 3.65Å; M679-F718 HydrophobicContact CG-CE2 3.83Å; M679-F718 HydrophobicContact CG-CG 3.51Å; M679-F718 HydrophobicContact CG-CZ 3.8Å; M679-F718 HydrophobicContact SD-CB 4.42Å; M679-F718 HydrophobicContact SD-CD1 4.3Å; M679-F718 HydrophobicContact SD-CG 4.33Å; R682-F718 HydrophobicContact CB-CE2 4.12Å; R682-F718 HydrophobicContact CG-CE2 4.22Å; V714-F718 HydrophobicContact CG1-CD2 4.18Å; V714-F718 HydrophobicContact CG1-CE2 4.34Å; V714-F718 VanDerWaalsContact O-CD2 3.29Å; V714-F718 WeakPolarHBondContact O-CD2 3.49Å; V714-F718 PolarHBondContact O-N 3.17Å; V714-F718 VanDerWaalsContact O-N 3.11Å; L715-F718 CarbonylContact O-C 3.56Å; L715-F718 PolarHBondContact O-N 3.1Å; L715-F718 VanDerWaalsContact O-N 3.15Å; R716-F718 PolarHBondContact O-N 2.91Å; F718-L720 VanDerWaalsContact C-N 3.26Å; F718-L720 PolarHBondContact O-N 2.74Å
719	G	91.2	Very high	90.8	Very high	57 Å²	57	30.4 Å²	30.4	59%	0.588	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.8	6.9	176.6	0	0	0	0	0	116.1	L715 R716	L715-G719 PolarHBondContact O-N 3.48Å; R716-G719 PolarHBondContact O-N 2.97Å; R716-G719 VanDerWaalsContact O-N 3.12Å
720	L	90.8	Very high	90.4	Very high	32 Å²	32	32.1 Å²	32.1	17%	0.168	19%	0.188	C	C	.	.			trans	-86.1	147.3	179.5	-61.6	171.2	0	0	0	111.5	P671 M679 L715 F718 L727	P671-L720 HydrophobicContact CG-CD1 3.83Å; P671-L720 HydrophobicContact CG-CD2 3.92Å; M679-L720 HydrophobicContact CE-CD1 3.64Å; M679-L720 HydrophobicContact SD-CD1 3.74Å; L715-L720 CarbonylContact C-O 3.46Å; L715-L720 HydrophobicContact CB-CB 4.19Å; L715-L720 HydrophobicContact CD2-CB 3.8Å; L715-L720 HydrophobicContact CD2-CD1 3.81Å; L715-L720 HydrophobicContact CD2-CG 4.48Å; L715-L720 PolarHBondContact O-N 3.4Å; F718-L720 VanDerWaalsContact C-N 3.26Å; F718-L720 PolarHBondContact O-N 2.74Å; L720-L727 HydrophobicContact CD1-CD2 4.46Å
721	A	88.3	Confident	89.8	Confident	49 Å²	49	32 Å²	32	41%	0.405	19%	0.187	S	C	.	.			trans	-77	148.9	179.1	0	0	0	0	0	112.6	I668 G723 A724	I668-A721 HydrophobicContact CD1-CB 4.01Å; A721-G723 PolarHBondContact O-N 3.18Å; A721-A724 WeakPolarHBondContact O-CB 3.29Å; A721-A724 PolarHBondContact O-N 3.2Å
722	D	89.5	Confident	89.2	Confident	62 Å²	62	35 Å²	35	33%	0.332	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-48.6	-29.2	-177.7	-61.7	0.6	0	0	0	115.3	L712 R716 A724 T725	L712-D722 HydrophobicContact CD2-CB 3.64Å; R716-D722 IonicContact CZ-OD1 3.94Å; R716-D722 IonicContact CZ-OD2 2.89Å; R716-D722 IonicContact NE-OD1 3.02Å; R716-D722 PolarHBondContact NE-OD1 2.96Å; R716-D722 IonicContact NE-OD2 2.66Å; R716-D722 VanDerWaalsContact NH2-CG 3.28Å; R716-D722 IonicContact NH2-OD1 3.12Å; R716-D722 PolarHBondContact NH2-OD1 3.46Å; R716-D722 IonicContact NH2-OD2 3.42Å; R716-D722 PolarHBondContact NH2-OD2 3.46Å; D722-A724 PolarHBondContact O-N 2.93Å; D722-T725 WeakPolarHBondContact O-CG2 3.26Å; D722-T725 PolarHBondContact O-N 3.13Å; D722-T725 PolarHBondContact O-OG1 3.42Å
723	G	85.6	Confident	88.6	Confident	42 Å²	42	39.2 Å²	39.2	43%	0.433	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-63.9	-21.7	176	0	0	0	0	0	114.2	A665 A721 T725	A665-G723 WeakPolarHBondContact CB-O 3.47Å; A721-G723 PolarHBondContact O-N 3.18Å; G723-T725 PolarHBondContact O-N 2.93Å; G723-T725 VanDerWaalsContact O-N 3.13Å
724	A	87.8	Confident	87.9	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.008	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-76.5	11	179.1	0	0	0	0	0	114.4	V664 I668 L715 A721 D722 E726 L727	V664-A724 HydrophobicContact CG1-CB 4.03Å; I668-A724 HydrophobicContact CD1-CB 3.95Å; L715-A724 HydrophobicContact CD1-CB 4.38Å; L715-A724 HydrophobicContact CD2-CB 3.81Å; A721-A724 WeakPolarHBondContact O-CB 3.29Å; A721-A724 PolarHBondContact O-N 3.2Å; D722-A724 PolarHBondContact O-N 2.93Å; A724-E726 PolarHBondContact O-N 2.74Å; A724-L727 WeakPolarHBondContact O-CB 3.32Å; A724-L727 PolarHBondContact O-N 2.91Å
725	T	86.6	Confident	87.3	Confident	16 Å²	16	38.9 Å²	38.9	10%	0.098	23%	0.227	C	C	.	.	H	α-helix	trans	-58.4	-26.3	176.2	39.3	0	0	0	0	113.6	Y708 Q711 L712 L715 D722 G723 L727 L728 Q729	Y708-T725 HydrophobicContact CD2-CG2 4.25Å; Y708-T725 HydrophobicContact CE2-CG2 3.77Å; Q711-T725 HydrophobicContact CB-CG2 4.05Å; L712-T725 HydrophobicContact CD2-CG2 3.91Å; L715-T725 HydrophobicContact CD1-CG2 3.5Å; L715-T725 VanDerWaalsContact CD1-CG2 3.5Å; D722-T725 WeakPolarHBondContact O-CG2 3.26Å; D722-T725 PolarHBondContact O-N 3.13Å; D722-T725 PolarHBondContact O-OG1 3.42Å; G723-T725 PolarHBondContact O-N 2.93Å; G723-T725 VanDerWaalsContact O-N 3.13Å; T725-L727 VanDerWaalsContact C-N 3.25Å; T725-L727 PolarHBondContact O-N 3.47Å; T725-L728 PolarHBondContact O-N 3.49Å; T725-Q729 VanDerWaalsContact O-CG 3.26Å; T725-Q729 WeakPolarHBondContact O-CG 3.3Å; T725-Q729 PolarHBondContact O-N 3.11Å
726	E	83.9	Confident	86.5	Confident	78 Å²	78	42.4 Å²	42.4	36%	0.364	25%	0.25	S	S	.	.	H	α-helix	trans	-57.5	-34.6	170.3	-77.7	-158.4	176.5	0	0	113.7	V664 A724 L728 Q729 N730 K733 F734	V664-E726 HydrophobicContact CG1-CB 4.46Å; A724-E726 PolarHBondContact O-N 2.74Å; E726-L728 VanDerWaalsContact C-N 3.34Å; E726-L728 PolarHBondContact O-N 3.26Å; E726-Q729 PolarHBondContact O-N 3.45Å; E726-N730 PolarHBondContact O-N 2.87Å; E726-K733 IonicContact OE1-NZ 3.16Å; E726-K733 IonicContact OE2-NZ 2.71Å; E726-K733 PolarHBondContact OE2-NZ 3.01Å; E726-F734 HydrophobicContact CB-CE2 4.34Å; E726-F734 HydrophobicContact CB-CZ 4.26Å
727	L	85.1	Confident	85.8	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-42.6	-178.3	-178.2	65.7	0	0	0	111.4	V664 P671 V676 M679 L720 A724 T725 P731 F734 F735	V664-L727 HydrophobicContact CG1-CB 4.2Å; V664-L727 HydrophobicContact CG2-CB 4.36Å; V664-L727 HydrophobicContact CG2-CD1 4.24Å; P671-L727 HydrophobicContact CG-CD2 3.83Å; V676-L727 HydrophobicContact CG2-CD1 4.39Å; V676-L727 HydrophobicContact CG2-CD2 4.14Å; V676-L727 HydrophobicContact CG2-CG 4.5Å; M679-L727 HydrophobicContact CE-CD2 4.27Å; L720-L727 HydrophobicContact CD1-CD2 4.46Å; A724-L727 WeakPolarHBondContact O-CB 3.32Å; A724-L727 PolarHBondContact O-N 2.91Å; T725-L727 VanDerWaalsContact C-N 3.25Å; T725-L727 PolarHBondContact O-N 3.47Å; L727-P731 WeakPolarHBondContact O-CA 3.12Å; L727-F734 HydrophobicContact CD1-CB 4.12Å; L727-F734 HydrophobicContact CD1-CD1 4.48Å; L727-F734 HydrophobicContact CD1-CD2 3.81Å; L727-F734 HydrophobicContact CD1-CE2 4.39Å; L727-F734 HydrophobicContact CD1-CG 3.87Å; L727-F735 HydrophobicContact CD1-CE2 4.14Å
728	L	85.7	Confident	85.1	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-77.5	-35.1	175.5	-74.3	176.6	0	0	0	112.1	M679 I680 Q711 V714 L715 T725 E726 P745	M679-L728 HydrophobicContact CB-CD2 4.13Å; M679-L728 HydrophobicContact CE-CD1 4.19Å; M679-L728 HydrophobicContact CE-CD2 3.99Å; M679-L728 HydrophobicContact CE-CG 3.99Å; I680-L728 HydrophobicContact CG1-CD2 4.2Å; Q711-L728 HydrophobicContact CB-CD1 4.04Å; Q711-L728 HydrophobicContact CG-CB 4.04Å; Q711-L728 HydrophobicContact CG-CD1 4.06Å; V714-L728 HydrophobicContact CB-CD1 4.1Å; V714-L728 HydrophobicContact CG1-CD1 4.03Å; L715-L728 HydrophobicContact CD2-CD1 4.44Å; L715-L728 HydrophobicContact CG-CD1 4.18Å; T725-L728 PolarHBondContact O-N 3.49Å; E726-L728 VanDerWaalsContact C-N 3.34Å; E726-L728 PolarHBondContact O-N 3.26Å; L728-P745 WeakPolarHBondContact O-CG 3.29Å
729	Q	85.2	Confident	84.1	Confident	62 Å²	62	58.1 Å²	58.1	29%	0.29	32%	0.321	S	S	.	.	H	α-helix	trans	-68.9	-43.7	-179.5	-71.3	169.3	16.8	0	0	112.2	Q711 T725 E726 I746	Q711-Q729 VanDerWaalsContact OE1-CG 3.3Å; T725-Q729 VanDerWaalsContact O-CG 3.26Å; T725-Q729 WeakPolarHBondContact O-CG 3.3Å; T725-Q729 PolarHBondContact O-N 3.11Å; E726-Q729 PolarHBondContact O-N 3.45Å; Q729-I746 WeakPolarHBondContact O-CD1 3.3Å; Q729-I746 WeakPolarHBondContact O-CG1 3.38Å
730	N	83.1	Confident	83	Confident	66 Å²	66	57 Å²	57	35%	0.353	30%	0.299	S	S	.	.			trans	-130.9	63.1	-173.7	-60.2	-83.6	0	0	0	111.4	E726 S732 K733 F734	E726-N730 PolarHBondContact O-N 2.87Å; N730-S732 PolarHBondContact O-N 2.99Å; N730-K733 HydrophobicContact CB-CB 4.12Å; N730-K733 WeakPolarHBondContact O-CB 3.28Å; N730-K733 PolarHBondContact O-N 2.95Å; N730-F734 WeakPolarHBondContact O-CD2 3.11Å
731	P	82	Confident	81.3	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.019	31%	0.311	C	S	.	.	H	α-helix	trans	-61.9	-31.5	-173.2	25.5	-35.2	0	0	0	113	I680 L727 K733 F734 F735 F740	I680-P731 HydrophobicContact CD1-CB 4.38Å; I680-P731 HydrophobicContact CD1-CG 4.49Å; L727-P731 WeakPolarHBondContact O-CA 3.12Å; P731-K733 PolarHBondContact O-N 2.83Å; P731-F734 PolarHBondContact O-N 3.37Å; P731-F735 PolarHBondContact O-N 3.32Å; P731-F740 HydrophobicContact CB-CD1 4.34Å; P731-F740 HydrophobicContact CB-CD2 3.88Å; P731-F740 HydrophobicContact CB-CE1 4.22Å; P731-F740 HydrophobicContact CB-CE2 3.75Å; P731-F740 HydrophobicContact CB-CG 4.18Å; P731-F740 HydrophobicContact CB-CZ 3.93Å; P731-F740 HydrophobicContact CG-CD2 4.01Å; P731-F740 HydrophobicContact CG-CE2 4.39Å; P731-F740 HydrophobicContact CG-CG 4.1Å
732	S	80.9	Confident	79.4	Confident	74 Å²	74	62.1 Å²	62.1	52%	0.517	33%	0.33	S	S	.	.	H	α-helix	trans	-66.5	-14	173.6	53.6	0	0	0	0	114.8	N730 F734 P736	N730-S732 PolarHBondContact O-N 2.99Å; S732-F734 VanDerWaalsContact C-N 3.31Å; S732-P736 WeakPolarHBondContact O-CA 3.45Å
733	K	82.9	Confident	77.3	Confident	98 Å²	98	64.2 Å²	64.2	43%	0.426	34%	0.337	S	S	.	.	H	α-helix	trans	-66.7	-36.2	168.2	-177.9	-178.5	172.3	-179.3	0	110.9	P661 E726 N730 P731	P661-K733 WeakPolarHBondContact CD-O 3.43Å; P661-K733 HydrophobicContact CG-CG 4.26Å; E726-K733 IonicContact OE1-NZ 3.16Å; E726-K733 IonicContact OE2-NZ 2.71Å; E726-K733 PolarHBondContact OE2-NZ 3.01Å; N730-K733 HydrophobicContact CB-CB 4.12Å; N730-K733 WeakPolarHBondContact O-CB 3.28Å; N730-K733 PolarHBondContact O-N 2.95Å; P731-K733 PolarHBondContact O-N 2.83Å
734	F	82.3	Confident	75.1	Confident	8 Å²	8	63.5 Å²	63.5	4%	0.035	33%	0.326	C	S	.	.	H	α-helix	trans	-97.4	-30.8	-173.7	-58.2	-83.8	0	0	0	112.6	A660 P661 V664 V670 E726 L727 N730 P731 S732	A660-F734 WeakPolarHBondContact CB-O 3.38Å; P661-F734 HydrophobicContact CG-CD1 3.76Å; P661-F734 HydrophobicContact CG-CE1 3.81Å; V664-F734 HydrophobicContact CB-CE1 4.29Å; V664-F734 HydrophobicContact CG1-CE1 4.28Å; V664-F734 HydrophobicContact CG1-CZ 4.01Å; V664-F734 HydrophobicContact CG2-CD1 4.2Å; V664-F734 HydrophobicContact CG2-CE1 3.83Å; V664-F734 HydrophobicContact CG2-CZ 4.28Å; V670-F734 HydrophobicContact CG2-CD1 3.76Å; V670-F734 HydrophobicContact CG2-CE1 4.41Å; E726-F734 HydrophobicContact CB-CE2 4.34Å; E726-F734 HydrophobicContact CB-CZ 4.26Å; L727-F734 HydrophobicContact CD1-CB 4.12Å; L727-F734 HydrophobicContact CD1-CD1 4.48Å; L727-F734 HydrophobicContact CD1-CD2 3.81Å; L727-F734 HydrophobicContact CD1-CE2 4.39Å; L727-F734 HydrophobicContact CD1-CG 3.87Å; N730-F734 WeakPolarHBondContact O-CD2 3.11Å; P731-F734 PolarHBondContact O-N 3.37Å; S732-F734 VanDerWaalsContact C-N 3.31Å
735	F	84	Confident	73.1	Confident	34 Å²	34	63.9 Å²	63.9	15%	0.149	33%	0.328	C	S	.	.			trans	-128.6	82	175.7	-46.1	-90.4	0	0	0	109.7	V670 L673 V676 L727 P731 D737 E738 F740	V670-F735 HydrophobicContact CG1-CE1 4.05Å; V670-F735 HydrophobicContact CG1-CE2 4.16Å; V670-F735 HydrophobicContact CG1-CZ 3.49Å; V670-F735 VanDerWaalsContact CG1-CZ 3.49Å; L673-F735 HydrophobicContact CB-CD1 4.33Å; L673-F735 HydrophobicContact CB-CE1 4.01Å; L673-F735 HydrophobicContact CD1-CB 4.38Å; L673-F735 HydrophobicContact CD1-CD1 3.86Å; L673-F735 HydrophobicContact CD1-CD2 4.23Å; L673-F735 HydrophobicContact CD1-CE1 4.15Å; L673-F735 HydrophobicContact CD1-CG 3.9Å; L673-F735 HydrophobicContact CD1-CZ 4.46Å; V676-F735 HydrophobicContact CB-CE2 4.22Å; V676-F735 HydrophobicContact CG1-CE2 4.09Å; V676-F735 HydrophobicContact CG2-CE2 3.88Å; V676-F735 HydrophobicContact CG2-CZ 3.92Å; L727-F735 HydrophobicContact CD1-CE2 4.14Å; P731-F735 PolarHBondContact O-N 3.32Å; F735-D737 VanDerWaalsContact C-N 3.34Å; F735-D737 PolarHBondContact O-N 2.84Å; F735-E738 HydrophobicContact CB-CB 3.91Å; F735-E738 HydrophobicContact CB-CG 4.35Å; F735-E738 PolarHBondContact O-N 2.86Å; F735-F740 HydrophobicContact CB-CE2 3.91Å; F735-F740 HydrophobicContact CB-CZ 3.91Å; F735-F740 HydrophobicContact CD2-CE2 4.27Å; F735-F740 AromaticContact CD2-CZ 3.74Å; F735-F740 HydrophobicContact CD2-CZ 3.74Å; F735-F740 HydrophobicContact CG-CZ 4.11Å
736	P	78.2	Confident	70.9	Confident	74 Å²	74	67.6 Å²	67.6	48%	0.481	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-26	-171.6	27.9	-35.5	0	0	0	114	A660 S732 E738	A660-P736 HydrophobicContact CB-CG 4.34Å; S732-P736 WeakPolarHBondContact O-CA 3.45Å; P736-E738 VanDerWaalsContact C-N 3.34Å
737	D	79.1	Confident	68.8	Low	158 Å²	158	68.4 Å²	68.4	85%	0.845	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-13.6	178.8	-55.3	-70	0	0	0	112.9	F735	F735-D737 VanDerWaalsContact C-N 3.34Å; F735-D737 PolarHBondContact O-N 2.84Å
738	E	80.7	Confident	66.6	Low	69 Å²	69	72.1 Å²	72.1	32%	0.322	38%	0.383	S	S	.	.			trans	-92.1	123.5	-175.7	-90	-76.5	169.3	0	0	112.4	L673 K677 F735 P736 F740	L673-E738 HydrophobicContact CD1-CG 3.98Å; L673-E738 HydrophobicContact CD2-CG 3.66Å; L673-E738 WeakPolarHBondContact CD2-OE1 3.48Å; L673-E738 HydrophobicContact CG-CG 4.46Å; K677-E738 WeakPolarHBondContact CE-OE2 3.5Å; K677-E738 IonicContact NZ-OE1 2.77Å; K677-E738 PolarHBondContact NZ-OE1 2.7Å; K677-E738 IonicContact NZ-OE2 3.44Å; K677-E738 PolarHBondContact NZ-OE2 3.19Å; F735-E738 HydrophobicContact CB-CB 3.91Å; F735-E738 HydrophobicContact CB-CG 4.35Å; F735-E738 PolarHBondContact O-N 2.86Å; P736-E738 VanDerWaalsContact C-N 3.34Å; E738-F740 VanDerWaalsContact C-N 3.34Å; E738-F740 HydrophobicContact CB-CD2 4.45Å; E738-F740 HydrophobicContact CB-CE2 3.86Å; E738-F740 HydrophobicContact CB-CZ 4.04Å; E738-F740 WeakPolarHBondContact O-CD2 3.45Å; E738-F740 PolarHBondContact O-N 2.87Å; E738-F740 VanDerWaalsContact O-N 3.12Å
739	R	73.7	Confident	64.3	Low	238 Å²	238	77.8 Å²	77.8	90%	0.898	41%	0.413	S	S	*	.			trans	-86.8	77	174.4	-63.9	-172.8	-172.8	-176.9	3.4	110.4	G741	R739-G741 PolarHBondContact O-N 2.93Å
740	F	67.3	Low	61.9	Low	33 Å²	33	85.4 Å²	85.4	15%	0.145	44%	0.439	C	S	.	.			trans	-53	123.3	147.6	-44.5	-81	0	0	0	106.9	L673 V676 K677 I680 P731 F735 E738	L673-F740 HydrophobicContact CD1-CE1 4.18Å; L673-F740 HydrophobicContact CD1-CZ 3.95Å; V676-F740 HydrophobicContact CG1-CE1 4.48Å; K677-F740 HydrophobicContact CG-CE1 4.48Å; I680-F740 HydrophobicContact CD1-CD1 3.51Å; I680-F740 HydrophobicContact CD1-CE1 3.79Å; I680-F740 HydrophobicContact CD1-CG 4.41Å; P731-F740 HydrophobicContact CB-CD1 4.34Å; P731-F740 HydrophobicContact CB-CD2 3.88Å; P731-F740 HydrophobicContact CB-CE1 4.22Å; P731-F740 HydrophobicContact CB-CE2 3.75Å; P731-F740 HydrophobicContact CB-CG 4.18Å; P731-F740 HydrophobicContact CB-CZ 3.93Å; P731-F740 HydrophobicContact CG-CD2 4.01Å; P731-F740 HydrophobicContact CG-CE2 4.39Å; P731-F740 HydrophobicContact CG-CG 4.1Å; F735-F740 HydrophobicContact CB-CE2 3.91Å; F735-F740 HydrophobicContact CB-CZ 3.91Å; F735-F740 HydrophobicContact CD2-CE2 4.27Å; F735-F740 AromaticContact CD2-CZ 3.74Å; F735-F740 HydrophobicContact CD2-CZ 3.74Å; F735-F740 HydrophobicContact CG-CZ 4.11Å; E738-F740 VanDerWaalsContact C-N 3.34Å; E738-F740 HydrophobicContact CB-CD2 4.45Å; E738-F740 HydrophobicContact CB-CE2 3.86Å; E738-F740 HydrophobicContact CB-CZ 4.04Å; E738-F740 WeakPolarHBondContact O-CD2 3.45Å; E738-F740 PolarHBondContact O-N 2.87Å; E738-F740 VanDerWaalsContact O-N 3.12Å
741	G	54.9	Low	59.3	Low	40 Å²	40	89 Å²	89	41%	0.412	45%	0.454	S	S	.	.			trans	-70.1	-163.4	-173.3	0	0	0	0	0	113.2	R739 E743 S744	R739-G741 PolarHBondContact O-N 2.93Å; G741-E743 PolarHBondContact O-N 3.05Å; G741-S744 WeakPolarHBondContact O-CB 3.35Å; G741-S744 PolarHBondContact O-N 2.67Å; G741-S744 PolarHBondContact O-OG 3.03Å
742	D	49.3	Very low	56.8	Low	149 Å²	149	95.4 Å²	95.4	80%	0.797	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-13.7	168.7	-69.3	-39.5	0	0	0	112.5	S744 L747	D742-S744 PolarHBondContact O-N 3.03Å; D742-S744 VanDerWaalsContact O-N 3.1Å; D742-L747 HydrophobicContact CB-CD1 4.24Å
743	E	46.1	Very low	54.3	Low	105 Å²	105	94.7 Å²	94.7	49%	0.491	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-19.3	161.2	-65.5	-60.7	139.8	0	0	115.4	H684 G741	H684-E743 IonicContact CE1-OE1 3.26Å; H684-E743 IonicContact CE1-OE2 3.13Å; H684-E743 PolarHBondContact CE1-OE2 2.72Å; H684-E743 VanDerWaalsContact CE1-OE2 3.32Å; H684-E743 IonicContact CG-OE2 3.74Å; H684-E743 IonicContact ND1-OE2 3.43Å; H684-E743 PolarHBondContact ND1-OE2 2.82Å; G741-E743 PolarHBondContact O-N 3.05Å
744	S	39.6	Very low	51.8	Low	28 Å²	28	101.1 Å²	101.1	20%	0.196	52%	0.519	C	S	.	.	S	Bend	trans	-52.7	122.2	178.9	-66.6	0	0	0	0	111.2	G741 D742 I746 L747	G741-S744 WeakPolarHBondContact O-CB 3.35Å; G741-S744 PolarHBondContact O-N 2.67Å; G741-S744 PolarHBondContact O-OG 3.03Å; D742-S744 PolarHBondContact O-N 3.03Å; D742-S744 VanDerWaalsContact O-N 3.1Å; S744-I746 PolarHBondContact O-N 3.41Å; S744-L747 PolarHBondContact O-N 2.71Å
745	P	44.3	Very low	49.1	Very low	9 Å²	9	107.1 Å²	107.1	6%	0.058	56%	0.56	C	S	.	*	G	3₁₀ helix	trans	-69	-10.6	-155.2	23.4	-34.2	0	0	0	116.1	L683 R687 L728	L683-P745 HydrophobicContact CD2-CB 3.82Å; L683-P745 HydrophobicContact CD2-CG 4.1Å; R687-P745 PolarHBondContact NH2-O 2.93Å; L728-P745 WeakPolarHBondContact O-CG 3.29Å
746	I	40.8	Very low	46.4	Very low	94 Å²	94	117.1 Å²	117.1	48%	0.482	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-70.9	-25.1	172.5	-75.1	179.8	0	0	0	113.1	Q729 S744 A748 L749	Q729-I746 WeakPolarHBondContact O-CD1 3.3Å; Q729-I746 WeakPolarHBondContact O-CG1 3.38Å; S744-I746 PolarHBondContact O-N 3.41Å; I746-A748 VanDerWaalsContact C-N 3.25Å; I746-A748 PolarHBondContact O-N 2.89Å; I746-L749 PolarHBondContact O-N 3.42Å
747	L	39.5	Very low	44	Very low	95 Å²	95	120.3 Å²	120.3	50%	0.497	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-75.8	-6.9	-173	-69.7	176	0	0	0	115.2	D742 S744 L749	D742-L747 HydrophobicContact CB-CD1 4.24Å; S744-L747 PolarHBondContact O-N 2.71Å; L747-L749 PolarHBondContact O-N 2.8Å
748	A	38.3	Very low	41.4	Very low	77 Å²	77	120 Å²	120	64%	0.636	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-65.5	-12.2	171	0	0	0	0	0	114.1	I746	I746-A748 VanDerWaalsContact C-N 3.25Å; I746-A748 PolarHBondContact O-N 2.89Å
749	L	38.8	Very low	38.8	Very low	120 Å²	120	122.4 Å²	122.4	63%	0.628	64%	0.638	S	S	*	*	G	3₁₀ helix	trans	-99.3	25.8	-169.5	-151.8	77.2	0	0	0	115.1	I746 L747	I746-L749 PolarHBondContact O-N 3.42Å; L747-L749 PolarHBondContact O-N 2.8Å
750	R	33.8	Very low	36.6	Very low	221 Å²	221	116.8 Å²	116.8	83%	0.834	64%	0.635	S	S	*	*			trans	-127.6	37.4	-173.4	-121.1	-178.4	-171.9	-153.2	0	118
751	Q	28.9	Very low	34.9	Very low	141 Å²	141	121.3 Å²	121.3	66%	0.659	67%	0.667	S	S	*	*			trans	-129.1	89.2	162.4	-67.2	-169.8	5.8	0	0	112.5	C645	C645-Q751 PolarHBondContact SG-OE1 3.2Å
752	V	30.2	Very low	33.6	Very low	138 Å²	138	124.4 Å²	124.4	84%	0.836	69%	0.689	S	S	*	*			trans	-138.9	88.8	166.4	-175.2	0	0	0	0	109.7
753	G	27.9	Very low	32.5	Very low	60 Å²	60	124.8 Å²	124.8	62%	0.619	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-78.7	132	170.7	0	0	0	0	0	111.3
754	R	31.1	Very low	31.6	Very low	233 Å²	233	126.1 Å²	126.1	88%	0.879	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-88.4	122.7	167.4	-78.6	-167.9	178.5	-162	2.6	110.1
755	C	24.6	Very low	31.1	Very low	133 Å²	133	128.6 Å²	128.6	90%	0.899	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-56.9	145.7	170.1	-52.2	0	0	0	0	111.5
756	R	28.5	Very low	30.2	Very low	245 Å²	245	136.2 Å²	136.2	93%	0.925	75%	0.752	S	S	*	*			trans	-120.1	151.5	164.3	-137.4	176.3	-174.3	177.4	0.6	108.8
757	V	26.7	Very low	29.6	Very low	141 Å²	141	138.2 Å²	138.2	86%	0.855	76%	0.763	S	S	*	*			trans	-71.7	146.6	-165.1	-179.8	0	0	0	0	112.4
758	N	23.9	Very low	29.1	Very low	152 Å²	152	138.7 Å²	138.7	81%	0.813	77%	0.77	S	S	*	*			trans	-51.3	145.2	-176.3	-58.3	-3.4	0	0	0	114.9
759	S	26.8	Very low	28.6	Very low	119 Å²	119	141.9 Å²	141.9	83%	0.832	78%	0.776	S	S	*	*			trans	-151.3	139.1	149.7	-72.2	0	0	0	0	107.7
760	S	26.8	Very low	28	Very low	119 Å²	119	143.6 Å²	143.6	83%	0.832	79%	0.785	S	S	*	*			trans	-72.7	153	-163.2	-56.3	0	0	0	0	114.5
761	P	33.3	Very low	27.8	Very low	128 Å²	128	142 Å²	142	83%	0.831	79%	0.787	S	S	*	*			trans	-83.3	164.6	-178.7	35.3	-36.9	0	0	0	113.4
762	A	26.3	Very low	27.8	Very low	105 Å²	105	139 Å²	139	87%	0.868	79%	0.794	S	S	*	*			trans	-124.5	146.6	161.2	0	0	0	0	0	109.8
763	M	27.3	Very low	27.8	Very low	157 Å²	157	139.4 Å²	139.4	77%	0.773	80%	0.796	S	S	*	*			trans	-84.3	140.2	-175.2	162.9	-179.2	167.5	0	0	111
764	D	27	Very low	27.9	Very low	134 Å²	134	141.2 Å²	141.2	72%	0.717	81%	0.806	S	S	*	*				-167.5	-179.1	103.8	-129.4	-45.2	0	0	0	114.9
765	S	28.6	Very low	27.9	Very low	79 Å²	79	133.4 Å²	133.4	55%	0.552	80%	0.798	S	S	*	*			trans	-107.4	-173.3	-149.7	-47	0	0	0	0	114.3
766	M	26.3	Very low	28.1	Very low	169 Å²	169	137 Å²	137	83%	0.833	80%	0.799	S	S	*	*			trans	84.1	143.4	159.3	-54.2	-164.2	-163.3	0	0	118.1
767	I	27.8	Very low	28.5	Very low	137 Å²	137	134 Å²	134	70%	0.703	79%	0.794	S	S	*	*			cis	-166.2	152.2	-26.8	-125.7	164.3	0	0	0	110.5
768	T	27.7	Very low	29.1	Very low	104 Å²	104	133 Å²	133	64%	0.638	79%	0.791	S	S	*	*			trans	49.9	122.5	159.4	58.9	0	0	0	0	124.2
769	D	27.5	Very low	29.9	Very low	144 Å²	144	131.9 Å²	131.9	77%	0.77	79%	0.792	S	S	*	*				82.3	137.7	115.8	-55.1	-7	0	0	0	126.5
770	L	27.6	Very low	30.7	Very low	157 Å²	157	134.3 Å²	134.3	82%	0.822	80%	0.795	S	S	*	*			trans	97.8	156.6	137.9	-118.1	69.5	0	0	0	122.9
771	E	28.5	Very low	31.4	Very low	187 Å²	187	134 Å²	134	87%	0.874	79%	0.79	S	S	*	*			trans	-93.6	161.8	-164.9	-52.1	162.9	109	0	0	112.4
772	G	29.2	Very low	32	Very low	79 Å²	79	133.7 Å²	133.7	81%	0.814	79%	0.788	S	S	*	*			trans	179.3	95.6	175.6	0	0	0	0	0	117.7
773	V	30.1	Very low	33	Very low	145 Å²	145	134.4 Å²	134.4	88%	0.879	78%	0.784	S	S	*	*			trans	-49.6	131.4	175.4	171.8	0	0	0	0	116.4
774	A	29.9	Very low	33.6	Very low	99 Å²	99	132.8 Å²	132.8	82%	0.818	79%	0.785	S	S	*	*			trans	33.5	140.4	147	0	0	0	0	0	124.1
775	G	30.8	Very low	34.2	Very low	68 Å²	68	132 Å²	132	70%	0.701	79%	0.787	S	S	*	*			trans	146.4	99.7	140.6	0	0	0	0	0	120.5
776	F	29	Very low	35.1	Very low	210 Å²	210	133.6 Å²	133.6	92%	0.921	80%	0.796	S	S	*	*			trans	61.3	164.8	154	-78.2	-90.5	0	0	0	121.3
777	H	38.2	Very low	35.2	Very low	181 Å²	181	136.4 Å²	136.4	84%	0.838	80%	0.798	S	S	*	*			trans	-114	153	-163.9	-61.1	-92.7	0	0	0	115.1
778	P	38.5	Very low	35.5	Very low	120 Å²	120	138.3 Å²	138.3	78%	0.779	80%	0.804	S	S	*	*			trans	-105.8	168.1	145.8	-2.6	24.1	0	0	0	113
779	P	40.8	Very low	37.1	Very low	129 Å²	129	138.9 Å²	138.9	84%	0.838	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-92.2	167.7	-165.3	36.2	-37.5	0	0	0	116.9
780	L	42.9	Very low	37.6	Very low	169 Å²	169	138.2 Å²	138.2	89%	0.885	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-82.2	148.9	179.6	-66.5	167.1	0	0	0	114.2
781	P	42.2	Very low	37.6	Very low	114 Å²	114	135.4 Å²	135.4	74%	0.74	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-83.5	160.6	162.6	34.7	-33.6	0	0	0	112.8
782	P	45.6	Very low	38	Very low	120 Å²	120	133 Å²	133	78%	0.779	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-90.5	162.4	-168.8	35.8	-37.5	0	0	0	115.6
783	P	48.6	Very low	38.6	Very low	121 Å²	121	134.9 Å²	134.9	79%	0.786	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-87.1	150	177.4	35	-35.3	0	0	0	114.1
784	P	39.4	Very low	38.6	Very low	122 Å²	122	132.7 Å²	132.7	79%	0.792	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-82.1	163.9	171.3	33.5	-34.6	0	0	0	113.8
785	P	39	Very low	38.6	Very low	117 Å²	117	137 Å²	137	76%	0.76	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-96.9	167.6	-160.2	-3.1	25	0	0	0	116
786	P	48.6	Very low	38.5	Very low	114 Å²	114	137.6 Å²	137.6	74%	0.74	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-92.4	157.2	-176.9	37.1	-35.8	0	0	0	114.4
787	Y	28.4	Very low	38.5	Very low	227 Å²	227	137 Å²	137	89%	0.89	80%	0.801	S	S	*	*			trans	-145.7	139	165.5	-95.8	-83.8	0	0	0	113.4
788	H	34.2	Very low	38.1	Very low	178 Å²	178	135.9 Å²	135.9	82%	0.824	80%	0.8	S	S	*	*			trans	-146.1	177.5	170.6	-74.1	-66.8	0	0	0	107.4
789	P	59.2	Low	37.6	Very low	116 Å²	116	140.2 Å²	140.2	75%	0.753	81%	0.807	S	S	*	*				-105.1	-149	-63.1	30.2	-11	0	0	0	109.1
790	P	38.9	Very low	37	Very low	129 Å²	129	137.6 Å²	137.6	84%	0.838	80%	0.803	S	S	*	*				-147.7	-152	80.7	39.7	-18.4	0	0	0	114.1
791	A	28.1	Very low	36.1	Very low	98 Å²	98	133.3 Å²	133.3	81%	0.81	80%	0.799	S	S	*	*			trans	-122.1	-164.6	-150.5	0	0	0	0	0	117.6
792	T	36.4	Very low	35.2	Very low	136 Å²	136	138 Å²	138	83%	0.834	80%	0.803	S	S	*	*			trans	-74.7	166.1	-166.4	52.7	0	0	0	0	116.9
793	P	41.2	Very low	34.5	Very low	119 Å²	119	142 Å²	142	77%	0.773	80%	0.802	S	S	*	*				-148.4	179.4	115.8	37.2	-21.1	0	0	0	114.3
794	S	29.9	Very low	33.6	Very low	99 Å²	99	142.4 Å²	142.4	69%	0.692	80%	0.804	S	S	*	*			cis	-173	132.4	-43.7	61.2	0	0	0	0	112.3
795	H	30.4	Very low	33.1	Very low	191 Å²	191	148 Å²	148	88%	0.884	81%	0.81	S	S	*	*			trans	63.1	162.4	161.7	-78.1	-117.7	0	0	0	120
796	A	28.1	Very low	32.7	Very low	79 Å²	79	149 Å²	149	65%	0.653	81%	0.813	S	S	*	*			cis	-177.7	148.9	-33.5	0	0	0	0	0	111
797	Q	30.5	Very low	31.8	Very low	198 Å²	198	148.9 Å²	148.9	93%	0.925	81%	0.813	S	S	*	*			trans	-175.3	169.7	139.2	-107.5	-174.8	23.8	0	0	115.7
798	L	29.8	Very low	31.9	Very low	157 Å²	157	146.8 Å²	146.8	82%	0.822	81%	0.813	S	S	*	*			trans	-92.1	143.8	-161.6	-61.9	125	0	0	0	117
799	K	28.1	Very low	31.6	Very low	212 Å²	212	143.9 Å²	143.9	92%	0.922	81%	0.81	S	S	*	*				151.9	150.6	115.1	-94.9	179.4	172.5	173.9	0	111.7
800	G	26.6	Very low	30.2	Very low	73 Å²	73	144.5 Å²	144.5	75%	0.753	81%	0.812	S	S	*	*			trans	156.3	-17.4	151.3	0	0	0	0	0	124.1
801	G	24.6	Very low	29.7	Very low	79 Å²	79	144.6 Å²	144.6	81%	0.814	81%	0.812	S	S	*	*			trans	73.4	-177.7	165.6	0	0	0	0	0	120.6
802	W	24.3	Very low	29.6	Very low	214 Å²	214	146.6 Å²	146.6	81%	0.811	82%	0.815	S	S	*	*			trans	75.8	101.2	174.7	-64.4	86.4	0	0	0	121.1
803	R	29.5	Very low	29.2	Very low	203 Å²	203	151.1 Å²	151.1	77%	0.766	82%	0.816	S	S	*	*			trans	63.6	114.6	152	-55.6	-161.2	-174.3	-74.5	5.8	119.6	R805	R803-R805 PolarHBondContact O-N 2.94Å
804	P	30.9	Very low	28.5	Very low	129 Å²	129	151 Å²	151	84%	0.838	82%	0.818	S	S	*	*			trans	-76.8	111.7	168.5	31.3	-31.9	0	0	0	111.5
805	R	28	Very low	28.3	Very low	241 Å²	241	156 Å²	156	91%	0.909	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-92.1	122	151.6	-105.7	-170.1	-73.9	-166.2	-2.9	107.3	R803 P807	R803-R805 PolarHBondContact O-N 2.94Å; R805-P807 WeakPolarHBondContact O-CD 3.48Å
806	V	30.4	Very low	28	Very low	136 Å²	136	151.8 Å²	151.8	82%	0.824	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-79.6	124.2	176.7	179.3	0	0	0	0	109.2
807	P	30.1	Very low	27.9	Very low	112 Å²	112	157.4 Å²	157.4	73%	0.727	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-75.6	156.5	174.1	-17	33.1	0	0	0	113.2	R805	R805-P807 WeakPolarHBondContact O-CD 3.48Å
808	M	30.2	Very low	27.8	Very low	184 Å²	184	153.3 Å²	153.3	91%	0.906	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-59.8	138.8	-176.5	-64.8	-74.5	-150.5	0	0	114.8
809	P	29.4	Very low	27.7	Very low	116 Å²	116	151.9 Å²	151.9	75%	0.753	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-77.9	153.6	141.4	-1.9	21	0	0	0	110.8
810	T	28.6	Very low	27.7	Very low	129 Å²	129	149.8 Å²	149.8	79%	0.791	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-69.9	154.2	175.4	43.8	0	0	0	0	113.1	T812	T810-T812 PolarHBondContact O-N 3.25Å
811	P	28.2	Very low	27.8	Very low	131 Å²	131	155.9 Å²	155.9	85%	0.851	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-70.4	123.8	-170.7	27.8	-35.7	0	0	0	113.7
812	T	27.5	Very low	27.9	Very low	140 Å²	140	158.9 Å²	158.9	86%	0.859	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-73.1	147.8	168.6	-20.9	0	0	0	0	110.8	T810	T810-T812 PolarHBondContact O-N 3.25Å
813	R	27.5	Very low	28.1	Very low	231 Å²	231	156.8 Å²	156.8	87%	0.872	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-59.7	144.7	-179.5	-87.5	177.5	159.1	-146.2	0.4	113.2
814	S	25.8	Very low	28	Very low	116 Å²	116	153.9 Å²	153.9	81%	0.811	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-57.4	131.2	165.7	52.6	0	0	0	0	112.5
815	F	25.5	Very low	28.1	Very low	206 Å²	206	155.6 Å²	155.6	90%	0.904	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-89.9	142.9	157.5	-88.9	-95.4	0	0	0	110
816	S	24.6	Very low	27.9	Very low	101 Å²	101	154.8 Å²	154.8	71%	0.706	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-101.8	133.8	176.4	49.5	0	0	0	0	110.8
817	Y	25.8	Very low	27.8	Very low	197 Å²	197	156.5 Å²	156.5	77%	0.773	81%	0.814	S	S	*	*			trans	39	132	160.3	-69.4	-80.9	0	0	0	120.9
818	P	29.1	Very low	27.6	Very low	113 Å²	113	156.1 Å²	156.1	73%	0.734	82%	0.821	S	S	*	*			trans	-110.6	145.5	132.1	34.8	-30	0	0	0	111.3
819	C	27.1	Very low	27.5	Very low	127 Å²	127	152.1 Å²	152.1	86%	0.858	82%	0.817	S	S	*	*			trans	-79	137.6	171.4	-62	0	0	0	0	110.6
820	N	28.9	Very low	27.5	Very low	167 Å²	167	152.4 Å²	152.4	89%	0.893	82%	0.822	S	S	*	*			trans	-91.9	108.3	-177	-83.6	-35	0	0	0	112.8
821	R	27.4	Very low	27.4	Very low	202 Å²	202	155.4 Å²	155.4	76%	0.762	82%	0.824	S	S	*	*			trans	-158.3	96.8	147.1	-159.2	173.8	-167.3	149.3	8.3	113.8
822	T	27.9	Very low	27.4	Very low	141 Å²	141	159.1 Å²	159.1	87%	0.865	83%	0.829	S	S	*	*			trans	-160.3	147	149.9	18.1	0	0	0	0	108.9
823	L	28.1	Very low	27.4	Very low	170 Å²	170	156.1 Å²	156.1	89%	0.89	83%	0.826	S	S	*	*			trans	-74.5	142.7	169.2	-85.4	70	0	0	0	109.6
824	I	27	Very low	27.2	Very low	142 Å²	142	148.9 Å²	148.9	73%	0.728	82%	0.823	S	S	*	*			trans	-129.4	116	146.6	-65.9	-174.4	0	0	0	108.8	R826	I824-R826 HydrophobicContact CG2-CG 4.25Å; I824-R826 PolarHBondContact O-N 3.43Å
825	Q	32.4	Very low	27.2	Very low	165 Å²	165	148.1 Å²	148.1	77%	0.771	82%	0.818	S	S	*	*			trans	-61	119.4	167.4	178.4	-179.9	-2.1	0	0	109.8
826	R	25.4	Very low	27.3	Very low	225 Å²	225	145 Å²	145	85%	0.849	81%	0.806	S	S	*	*			trans	-130.5	114.6	172	-92	-176.1	173.3	174.2	-0.2	111.3	I824 A828	I824-R826 HydrophobicContact CG2-CG 4.25Å; I824-R826 PolarHBondContact O-N 3.43Å; R826-A828 PolarHBondContact O-N 2.84Å
827	H	26.8	Very low	27.5	Very low	171 Å²	171	150.1 Å²	150.1	79%	0.792	81%	0.812	S	S	*	*			trans	-62.2	127.9	167.5	-71	-97.9	0	0	0	110
828	A	26.9	Very low	27.5	Very low	105 Å²	105	145.9 Å²	145.9	87%	0.868	81%	0.811	S	S	*	*			trans	-88.5	105.9	168.9	0	0	0	0	0	109.4	R826	R826-A828 PolarHBondContact O-N 2.84Å
829	A	27.5	Very low	27.5	Very low	99 Å²	99	145.8 Å²	145.8	82%	0.818	81%	0.813	S	S	*	*			trans	-82.8	119.1	170.3	0	0	0	0	0	110
830	S	28.9	Very low	27.5	Very low	123 Å²	123	143.8 Å²	143.8	86%	0.86	81%	0.805	S	S	*	*			trans	-78.3	161.9	175.7	54	0	0	0	0	112.1
831	K	27.6	Very low	27.7	Very low	191 Å²	191	142.1 Å²	142.1	83%	0.83	80%	0.804	S	S	*	*			trans	-118.5	103.9	179.9	-79.9	-174.4	174.1	-179	0	112.3
832	H	27.9	Very low	27.7	Very low	209 Å²	209	143.9 Å²	143.9	97%	0.968	81%	0.811	S	S	*	*			trans	-167.7	144.7	151.5	-73.5	-59.3	0	0	0	106.8
833	G	26.6	Very low	27.6	Very low	77 Å²	77	142.9 Å²	142.9	79%	0.794	81%	0.809	S	S	*	*			cis	170.6	101.4	-10.2	0	0	0	0	0	111.7
834	G	24.8	Very low	27.5	Very low	79 Å²	79	143.8 Å²	143.8	81%	0.814	81%	0.809	S	S	*	*			trans	76.3	159.6	-172.9	0	0	0	0	0	113.6
835	S	25.9	Very low	28.6	Very low	101 Å²	101	142.2 Å²	142.2	71%	0.706	81%	0.808	S	S	*	*			cis	-169.6	166.3	-14.7	-127.8	0	0	0	0	107.5
836	E	26.2	Very low	28.8	Very low	139 Å²	139	140 Å²	140	65%	0.65	81%	0.808	S	S	*	*			cis	-162	160	1.9	-151.7	156.3	-71.3	0	0	110.1
837	Y	28.8	Very low	28.9	Very low	209 Å²	209	136.2 Å²	136.2	82%	0.82	81%	0.805	S	S	*	*			trans	60.5	157.5	-179.7	-61.3	-82.8	0	0	0	115.2
838	S	26.9	Very low	29	Very low	109 Å²	109	132.6 Å²	132.6	76%	0.762	80%	0.798	S	S	*	*			cis	-159.8	166.5	-33.7	-153.8	0	0	0	0	105.9
839	S	28.1	Very low	29	Very low	111 Å²	111	134.4 Å²	134.4	78%	0.776	80%	0.798	S	S	*	*			cis	-150.6	-136.7	13.1	63.6	0	0	0	0	110.5
840	A	26.4	Very low	28.9	Very low	84 Å²	84	137.1 Å²	137.1	69%	0.694	80%	0.798	S	S	*	*			trans	-153.5	164.8	170.3	0	0	0	0	0	109.7
841	P	33.3	Very low	29.9	Very low	133 Å²	133	136.1 Å²	136.1	86%	0.864	79%	0.789	S	S	*	*				-142	179.7	82.6	35.4	-17.2	0	0	0	115.5
842	R	28.9	Very low	29.8	Very low	239 Å²	239	136.6 Å²	136.6	90%	0.902	79%	0.794	S	S	*	*			trans	-111.6	162.9	-178.1	-59.3	168.9	168.3	172.8	-6.7	112.5
843	S	25	Very low	29.7	Very low	120 Å²	120	130.6 Å²	130.6	84%	0.839	78%	0.781	S	S	*	*				-170.2	162.8	126.9	35.6	0	0	0	0	112.6
844	Q	25.4	Very low	29.7	Very low	188 Å²	188	136.2 Å²	136.2	88%	0.879	79%	0.789	S	S	*	*			trans	-122.1	-147.9	177.5	-63.5	179.7	-85.1	0	0	110.8
845	P	50.6	Low	29.7	Very low	109 Å²	109	136.4 Å²	136.4	71%	0.708	79%	0.791	S	S	*	*				-110	-172.4	-122.2	39.6	-19.4	0	0	0	113.7
846	P	37.1	Very low	29.8	Very low	120 Å²	120	142.3 Å²	142.3	78%	0.779	80%	0.798	S	S	*	*				-138.2	174.9	90.2	22.9	-0.6	0	0	0	113.1
847	D	27.1	Very low	30.4	Very low	145 Å²	145	141.2 Å²	141.2	78%	0.775	80%	0.802	S	S	*	*			cis	105.9	145.9	10.5	-150.3	1.8	0	0	0	116.5
848	C	28.3	Very low	30.2	Very low	95 Å²	95	137.7 Å²	137.7	64%	0.642	80%	0.797	S	S	*	*			trans	81.6	108.5	166.5	-65.3	0	0	0	0	124.9
849	T	26.8	Very low	30.1	Very low	143 Å²	143	140 Å²	140	88%	0.877	80%	0.8	S	S	*	*				74.1	135.9	125.5	57.9	0	0	0	0	127
850	N	25.6	Very low	30	Very low	155 Å²	155	140 Å²	140	83%	0.829	80%	0.8	S	S	*	*			trans	-62.6	-172.9	166.6	-112.9	-16.7	0	0	0	116.2
851	P	49.5	Very low	30	Very low	103 Å²	103	143.7 Å²	143.7	67%	0.669	81%	0.808	S	S	*	*			cis	-138.9	176.3	-33.4	39.5	-22.8	0	0	0	115
852	Q	25.6	Very low	29.6	Very low	200 Å²	200	146.4 Å²	146.4	94%	0.935	81%	0.809	S	S	*	*			trans	167.8	160.3	152.6	-97	169.6	32.9	0	0	110.6
853	A	26.6	Very low	29.7	Very low	83 Å²	83	144.1 Å²	144.1	69%	0.686	81%	0.809	S	S	*	*			cis	-169.1	155.1	-29.6	0	0	0	0	0	112
854	M	26	Very low	29.7	Very low	195 Å²	195	143.3 Å²	143.3	96%	0.961	81%	0.809	S	S	*	*			trans	54.5	128.4	159.2	-70.2	-68.5	-162.9	0	0	122.1
855	G	25.9	Very low	30.1	Very low	83 Å²	83	143.9 Å²	143.9	86%	0.856	81%	0.814	S	S	*	*			trans	162	108.8	159.3	0	0	0	0	0	117.2
856	R	27.8	Very low	28.8	Very low	226 Å²	226	142 Å²	142	85%	0.853	82%	0.815	S	S	*	*			trans	-132.8	164.3	166.8	-117.9	-167.3	176.3	-164.3	-0.3	107.2
857	P	38.3	Very low	28.3	Very low	115 Å²	115	141.2 Å²	141.2	75%	0.747	82%	0.819	S	S	*	*			cis	-154.2	159.2	44	44.2	-23.2	0	0	0	120.6
858	L	25.2	Very low	28.2	Very low	136 Å²	136	142.9 Å²	142.9	71%	0.712	82%	0.822	S	S	*	*			trans	68.8	153.1	141.2	-127.4	71.2	0	0	0	125.1
859	L	24.6	Very low	28.3	Very low	158 Å²	158	144.5 Å²	144.5	83%	0.827	83%	0.831	S	S	*	*			trans	75.8	138.3	167.5	-57.6	176.3	0	0	0	116.8
860	S	26	Very low	28.4	Very low	110 Å²	110	144.7 Å²	144.7	77%	0.769	82%	0.824	S	S	*	*			cis	-152.5	165.7	-3.2	48.7	0	0	0	0	112.1
861	D	25.7	Very low	28.4	Very low	161 Å²	161	146.1 Å²	146.1	86%	0.861	83%	0.828	S	S	*	*			trans	-66.3	144.6	-178.2	-60.2	-78.2	0	0	0	115.6
862	Q	26.1	Very low	27.4	Very low	190 Å²	190	151 Å²	151	89%	0.888	83%	0.833	S	S	*	*			trans	-155.6	157	132	-154.8	140.7	37	0	0	111.6
863	Q	30.3	Very low	27.5	Very low	192 Å²	192	149.5 Å²	149.5	90%	0.897	83%	0.826	S	S	*	*			trans	-77.1	145	-174.1	-62.4	158.6	-71.3	0	0	112.8
864	A	26	Very low	27.5	Very low	102 Å²	102	154.4 Å²	154.4	84%	0.843	83%	0.832	S	S	*	*			trans	-146.4	144.2	166.6	0	0	0	0	0	111.1
865	M	32.3	Very low	27.7	Very low	200 Å²	200	153.5 Å²	153.5	99%	0.985	83%	0.828	S	S	*	*			trans	-83.9	145.2	171.7	-67	-128.3	-88.6	0	0	111
866	G	24.7	Very low	28	Very low	70 Å²	70	154.5 Å²	154.5	72%	0.722	82%	0.819	S	S	*	*			trans	-132.3	124.9	160.4	0	0	0	0	0	108.2
867	A	25.8	Very low	28	Very low	104 Å²	104	151.8 Å²	151.8	86%	0.86	82%	0.821	S	S	*	*				76.4	100.9	53.3	0	0	0	0	0	111.7
868	E	24.8	Very low	27.7	Very low	179 Å²	179	153.9 Å²	153.9	84%	0.836	83%	0.825	S	S	*	*			trans	-74.9	147.7	175.7	-65.8	-170.5	131.9	0	0	111.8	M870	E868-M870 PolarHBondContact O-N 2.98Å
869	P	30.8	Very low	27.8	Very low	130 Å²	130	152.1 Å²	152.1	84%	0.844	83%	0.829	S	S	*	*			trans	-80.1	109.4	-178.1	31.4	-33.7	0	0	0	112
870	M	28.2	Very low	28	Very low	146 Å²	146	152.2 Å²	152.2	72%	0.719	83%	0.83	S	S	*	*			trans	-85.6	118.6	172	-169.5	179.8	-164.5	0	0	110.5	E868 R872	E868-M870 PolarHBondContact O-N 2.98Å; M870-R872 HydrophobicContact CE-CG 4.25Å
871	M	25.8	Very low	28.1	Very low	185 Å²	185	150.4 Å²	150.4	91%	0.911	83%	0.829	S	S	*	*			trans	-119.5	110.9	165.3	-70.2	-163	-64.4	0	0	110.1
872	R	28.5	Very low	28.2	Very low	205 Å²	205	149.1 Å²	149.1	77%	0.774	83%	0.827	S	S	*	*			trans	-118.5	130.4	162.7	-74.2	-176.5	176.9	172.9	-2.3	107.2	M870	M870-R872 HydrophobicContact CE-CG 4.25Å
873	E	28.5	Very low	28.2	Very low	169 Å²	169	145.8 Å²	145.8	79%	0.79	82%	0.824	S	S	*	*			trans	-148.4	151.8	166.1	-129.6	171.4	-156.3	0	0	108.8
874	F	27.4	Very low	28.1	Very low	187 Å²	187	143.2 Å²	143.2	82%	0.82	82%	0.821	S	S	*	*			trans	67.5	64.3	-179.4	-55.1	-76.3	0	0	0	118.4
875	M	29.9	Very low	28.1	Very low	176 Å²	176	146 Å²	146	87%	0.867	82%	0.819	S	S	*	*	S	Bend		-138.1	153.1	129.7	-78.9	-136.1	87.3	0	0	108.4
876	P	30.8	Very low	27.9	Very low	104 Å²	104	140.6 Å²	140.6	68%	0.675	80%	0.801	S	S	*	*			trans	-79.5	149	-164.8	31.6	-35.6	0	0	0	113.8	I878	P876-I878 PolarHBondContact O-N 2.81Å
877	D	29.1	Very low	28.1	Very low	169 Å²	169	145.6 Å²	145.6	90%	0.904	81%	0.81	S	S	*	*			trans	-65.1	127.2	172.3	-64.5	-63	0	0	0	111.7
878	I	31.2	Very low	28.1	Very low	159 Å²	159	150.7 Å²	150.7	82%	0.815	81%	0.807	S	S	*	*			trans	-118.4	123.2	162.9	-61.8	-179.4	0	0	0	107.1	P876	P876-I878 PolarHBondContact O-N 2.81Å
879	A	27.4	Very low	28.3	Very low	98 Å²	98	148.6 Å²	148.6	81%	0.81	80%	0.797	S	S	*	*			trans	-76.1	130.5	-169.9	0	0	0	0	0	112.5	G881	A879-G881 PolarHBondContact O-N 2.88Å
880	L	29.6	Very low	28.1	Very low	161 Å²	161	150 Å²	150	84%	0.843	79%	0.793	S	S	*	*			trans	-76.3	103	167.2	-70.2	172.1	0	0	0	109.6
881	G	27.6	Very low	28	Very low	72 Å²	72	151 Å²	151	74%	0.742	80%	0.795	S	S	*	*			trans	-72.6	122	175.5	0	0	0	0	0	112.2	A879	A879-G881 PolarHBondContact O-N 2.88Å
882	V	27.4	Very low	27.9	Very low	134 Å²	134	149.7 Å²	149.7	81%	0.812	79%	0.788	S	S	*	*			trans	-96	99.5	175.3	-173.6	0	0	0	0	109.4
883	S	26.9	Very low	27.9	Very low	120 Å²	120	144 Å²	144	84%	0.839	79%	0.785	S	S	*	*			trans	-94.1	107.4	-177.8	-70.9	0	0	0	0	112.6
884	V	27.8	Very low	27.8	Very low	138 Å²	138	143 Å²	143	84%	0.836	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-91.5	147.5	167	-175.2	0	0	0	0	109.3
885	M	26.7	Very low	27.9	Very low	160 Å²	160	141 Å²	141	79%	0.788	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-69.2	153.7	-165.6	-67.2	-166.5	80.1	0	0	116.1
886	S	27.4	Very low	27.7	Very low	87 Å²	87	140.3 Å²	140.3	61%	0.608	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-66.3	158.8	-168	61.3	0	0	0	0	118.2
887	L	28.6	Very low	27.7	Very low	175 Å²	175	139.2 Å²	139.2	92%	0.916	79%	0.788	S	S	*	*			trans	-136.4	155.7	139.1	-106	171.1	0	0	0	111.8
888	R	26.1	Very low	27.5	Very low	210 Å²	210	141.2 Å²	141.2	79%	0.792	79%	0.792	S	S	*	*			trans	-82.1	168.7	-179.7	-93.9	-180	179.2	176.8	0.5	110.8
889	E	27.8	Very low	27.3	Very low	136 Å²	136	136.8 Å²	136.8	64%	0.636	79%	0.786	S	S	*	*			cis	-164.3	176.4	20.7	-135.5	168.2	113.9	0	0	113.9
890	Q	27.3	Very low	28.2	Very low	160 Å²	160	137.2 Å²	137.2	75%	0.748	78%	0.78	S	S	*	*			trans	65.7	79.8	150.6	-71.6	172.2	36.6	0	0	122.5
891	H	25.9	Very low	28.1	Very low	167 Å²	167	137.4 Å²	137.4	77%	0.773	78%	0.777	S	S	*	*				58.3	124.3	112.8	-132.2	-148.1	0	0	0	123.7
892	M	24.5	Very low	28.3	Very low	156 Å²	156	139.3 Å²	139.3	77%	0.768	78%	0.779	S	S	*	*			trans	96.5	140.5	142.5	-74.1	-72.2	175.9	0	0	123.8
893	A	28	Very low	29.2	Very low	85 Å²	85	139 Å²	139	70%	0.702	78%	0.779	S	S	*	*			trans	82.8	83.1	156.7	0	0	0	0	0	121.7
894	D	26.2	Very low	29.4	Very low	149 Å²	149	142.4 Å²	142.4	80%	0.797	78%	0.784	S	S	*	*				63.2	142.1	113.3	-89.4	-4.7	0	0	0	125.1
895	M	28.8	Very low	29.6	Very low	146 Å²	146	139.3 Å²	139.3	72%	0.719	78%	0.78	S	S	*	*			trans	82.7	107.5	159.1	-60.4	-62.2	134.9	0	0	122
896	D	27.5	Very low	30.4	Very low	160 Å²	160	137.9 Å²	137.9	86%	0.856	78%	0.782	S	S	*	*			trans	44.9	123.2	134.8	-62.6	-13.6	0	0	0	123.4
897	G	29.3	Very low	30.5	Very low	82 Å²	82	139.4 Å²	139.4	85%	0.845	79%	0.793	S	S	*	*			trans	144.6	93.7	141.5	0	0	0	0	0	119.1
898	E	25.8	Very low	30.4	Very low	210 Å²	210	134.5 Å²	134.5	98%	0.981	79%	0.785	S	S	*	*			trans	-99.6	147.4	151.9	-69.6	-162.2	115.2	0	0	109.5
899	G	27.2	Very low	30.7	Very low	67 Å²	67	132.8 Å²	132.8	69%	0.691	79%	0.785	S	S	*	*			cis	-168.8	-140.3	-2.1	0	0	0	0	0	107.2
900	P	46.7	Very low	30.8	Very low	107 Å²	107	133.5 Å²	133.5	70%	0.695	79%	0.788	S	S	*	*			cis	-134.4	-176.3	-33.2	26.4	-2.7	0	0	0	113.4
901	H	27	Very low	30.9	Very low	165 Å²	165	133.4 Å²	133.4	76%	0.764	79%	0.792	S	S	*	*			trans	72.3	116.3	160.1	-53.1	-61	0	0	0	123.5
902	S	32.2	Very low	30.9	Very low	112 Å²	112	129.9 Å²	129.9	78%	0.783	79%	0.786	S	S	*	*				66	-178.4	127.3	-57.6	0	0	0	0	118.6
903	P	45.3	Very low	30.9	Very low	126 Å²	126	127.8 Å²	127.8	82%	0.818	79%	0.786	S	S	*	*			cis	-137.3	-160.5	4	45.6	-26.2	0	0	0	116.8
904	M	31.2	Very low	30.9	Very low	193 Å²	193	128.8 Å²	128.8	95%	0.951	79%	0.787	S	S	*	*			trans	-100.4	170.1	179.6	-60.3	156.3	56.5	0	0	113.7
905	G	32.4	Very low	30.9	Very low	72 Å²	72	126.7 Å²	126.7	74%	0.742	79%	0.791	S	S	*	*			trans	152.9	153.3	165.9	0	0	0	0	0	112.2
906	P	42.2	Very low	31	Very low	130 Å²	130	124 Å²	124	84%	0.844	79%	0.792	S	S	*	*			cis	-132.7	-169.4	39.3	43.9	-26.4	0	0	0	113.2
907	S	29.8	Very low	31.1	Very low	120 Å²	120	126.8 Å²	126.8	84%	0.839	79%	0.79	S	S	*	*			cis	-161.3	159.8	25.8	53.5	0	0	0	0	114.5
908	G	28	Very low	31.1	Very low	71 Å²	71	131.6 Å²	131.6	73%	0.732	79%	0.789	S	S	*	*			trans	174	132.8	171.6	0	0	0	0	0	113.2
909	H	32.1	Very low	31.3	Very low	174 Å²	174	125.2 Å²	125.2	81%	0.806	77%	0.767	S	S	*	*			trans	-82.5	175	-171.3	-53.8	-92.8	0	0	0	113.8
910	H	30.3	Very low	31.5	Very low	152 Å²	152	130.6 Å²	130.6	70%	0.704	77%	0.774	S	S	*	*			cis	-159.3	147.3	22.5	-107.3	-70.6	0	0	0	112.7
911	L	28.6	Very low	30.6	Very low	158 Å²	158	128.5 Å²	128.5	83%	0.827	77%	0.771	S	S	*	*			trans	60.3	147	147.8	-64.6	166.8	0	0	0	119.8
912	S	24.9	Very low	30.7	Very low	93 Å²	93	132.1 Å²	132.1	65%	0.65	78%	0.78	S	S	*	*			cis	-157.8	154.1	4.5	-161.2	0	0	0	0	113
913	C	24.7	Very low	30.2	Very low	112 Å²	112	130 Å²	130	76%	0.757	78%	0.776	S	S	*	*			trans	57.9	147.2	160.9	-69.4	0	0	0	0	120.7
914	S	28.6	Very low	30.2	Very low	105 Å²	105	130.7 Å²	130.7	73%	0.734	78%	0.78	S	S	*	*			cis	-166.2	147.1	-12	-101.3	0	0	0	0	112.5
915	A	26	Very low	30.1	Very low	105 Å²	105	124.6 Å²	124.6	87%	0.868	77%	0.767	S	S	*	*			trans	65	155	166.6	0	0	0	0	0	118.9
916	A	31.5	Very low	30	Very low	90 Å²	90	130.2 Å²	130.2	74%	0.744	77%	0.774	S	S	*	*			cis	-174.1	175.5	-30.5	0	0	0	0	0	107.2
917	R	29.8	Very low	29.3	Very low	218 Å²	218	126.9 Å²	126.9	82%	0.823	76%	0.763	S	S	*	*			cis	-153.4	159.6	14.9	-75.3	-177.6	173	166.6	-1.3	110.9
918	F	29.1	Very low	29.3	Very low	184 Å²	184	129.4 Å²	129.4	81%	0.807	76%	0.761	S	S	*	*			trans	31.5	148.5	138.3	-56.4	-47.5	0	0	0	123.3
919	S	29.3	Very low	29.5	Very low	76 Å²	76	130.5 Å²	130.5	53%	0.531	76%	0.757	S	S	.	*			cis	-172.8	156.2	-2.2	-113.8	0	0	0	0	114.9
920	H	31.1	Very low	29.4	Very low	180 Å²	180	126.8 Å²	126.8	83%	0.833	75%	0.75	S	S	*	*			trans	56.7	158.7	154.5	-55.1	-51.4	0	0	0	120.1
921	G	27.7	Very low	29.4	Very low	62 Å²	62	126.8 Å²	126.8	64%	0.639	75%	0.748	S	S	*	*			cis	162.7	136	-6.1	0	0	0	0	0	110.1
922	Y	29.3	Very low	29.5	Very low	241 Å²	241	128.6 Å²	128.6	95%	0.945	74%	0.744	S	S	*	*				163.8	165.1	101.2	-95.1	-87.1	0	0	0	110.3
923	G	23.4	Very low	29.8	Very low	68 Å²	68	132.2 Å²	132.2	70%	0.701	75%	0.75	S	S	*	*			trans	-105.5	-148.6	169.3	0	0	0	0	0	112.7
924	P	44.8	Very low	30.1	Very low	140 Å²	140	130.8 Å²	130.8	91%	0.909	75%	0.747	S	S	*	*			cis	-143.4	-167.8	-1.8	44.7	-25.5	0	0	0	116
925	G	28.4	Very low	30.9	Very low	66 Å²	66	131.7 Å²	131.7	68%	0.68	75%	0.75	S	S	*	*			trans	128.1	114.6	159.5	0	0	0	0	0	115.9
926	H	30.3	Very low	31.3	Very low	190 Å²	190	135 Å²	135	88%	0.88	75%	0.747	S	S	*	*				63	128.9	83.7	-89	54.3	0	0	0	116.2
927	G	28	Very low	32.2	Very low	59 Å²	59	135.7 Å²	135.7	61%	0.608	74%	0.744	S	S	*	*			cis	167.9	173.2	-6.8	0	0	0	0	0	114.2
928	H	30	Very low	32.2	Very low	174 Å²	174	134.8 Å²	134.8	81%	0.806	75%	0.746	S	S	*	*			trans	74.9	152	166.8	-49.7	-66.8	0	0	0	118.9
929	S	30.7	Very low	32.4	Very low	93 Å²	93	133.3 Å²	133.3	65%	0.65	75%	0.746	S	S	*	*			cis	-175.8	136.9	-21.3	179.3	0	0	0	0	113.4
930	C	30.1	Very low	32.5	Very low	96 Å²	96	138.4 Å²	138.4	65%	0.649	76%	0.761	S	S	*	*			trans	67.7	156.6	153.8	-70.7	0	0	0	0	120.2
931	K	30	Very low	32.5	Very low	153 Å²	153	134.1 Å²	134.1	67%	0.665	76%	0.757	S	S	*	*			cis	-168.6	142.1	-9.6	-112.7	164.8	-176.6	158	0	112.7
932	R	32.6	Very low	32.5	Very low	195 Å²	195	140 Å²	140	74%	0.736	77%	0.768	S	S	*	*			trans	66.3	152	147	-65.7	-177.6	-66.9	-168.1	5.9	118.5
933	H	30.1	Very low	32.6	Very low	169 Å²	169	132.8 Å²	132.8	78%	0.782	76%	0.758	S	S	*	*			cis	-153.6	163	-7.8	-114	-46.7	0	0	0	110.9
934	A	31.6	Very low	32.7	Very low	83 Å²	83	138.8 Å²	138.8	69%	0.686	77%	0.768	S	S	*	*			trans	-103.6	-169.5	166.9	0	0	0	0	0	109.4
935	P	45.7	Very low	31.9	Very low	123 Å²	123	141.1 Å²	141.1	80%	0.799	76%	0.764	S	S	*	*			cis	-147	-175.9	15.6	42.3	-19.6	0	0	0	119
936	E	34	Very low	32.9	Very low	175 Å²	175	143.1 Å²	143.1	82%	0.818	77%	0.765	S	S	*	*			trans	-50.6	174.9	151.9	-92.8	-176.3	-165.3	0	0	114.8
937	P	50.6	Low	32.8	Very low	105 Å²	105	140.4 Å²	140.4	68%	0.682	76%	0.757	S	S	*	*			cis	-162.3	176.3	43.2	45.9	-22.9	0	0	0	123.3
938	K	29.7	Very low	33	Very low	198 Å²	198	145.5 Å²	145.5	86%	0.861	77%	0.77	S	S	*	*			trans	80.2	157.7	136.4	-90.4	178.5	178.2	-168.1	0	126
939	L	32	Very low	33.1	Very low	153 Å²	153	147 Å²	147	80%	0.801	77%	0.77	S	S	*	*			trans	-78	171.4	174	-67.5	69.7	0	0	0	111.6
940	E	31.4	Very low	33	Very low	183 Å²	183	147.7 Å²	147.7	86%	0.855	77%	0.766	S	S	*	*				170.8	155.5	71.5	-162.8	161.8	-127.7	0	0	112.7
941	A	32.1	Very low	33	Very low	91 Å²	91	151.3 Å²	151.3	75%	0.752	77%	0.771	S	S	*	*			trans	59.4	168.8	160.3	0	0	0	0	0	121.7
942	Q	27.3	Very low	33	Very low	184 Å²	184	148.7 Å²	148.7	86%	0.86	77%	0.772	S	S	*	*			cis	-172.4	137.6	-41.3	-179.9	177	3.3	0	0	111.6
943	A	31.5	Very low	32.7	Very low	90 Å²	90	145.5 Å²	145.5	74%	0.744	78%	0.778	S	S	*	*			trans	61.6	166.2	166.7	0	0	0	0	0	118.2
944	E	26.4	Very low	32.9	Very low	194 Å²	194	148.9 Å²	148.9	91%	0.907	78%	0.784	S	S	*	*			cis	-141.4	-177.2	18.1	-69.1	-176.3	122.6	0	0	114.2
945	F	27.8	Very low	33.5	Very low	190 Å²	190	150.8 Å²	150.8	83%	0.833	79%	0.79	S	S	*	*			trans	-95.9	-170.2	176	-98.1	-106	0	0	0	111.5
946	P	48.2	Very low	32.7	Very low	108 Å²	108	149.6 Å²	149.6	70%	0.701	79%	0.79	S	S	*	*			cis	-139.7	170.9	8.6	42.6	-23.1	0	0	0	119.8
947	D	29.7	Very low	32.7	Very low	132 Å²	132	147.6 Å²	147.6	71%	0.706	79%	0.79	S	S	*	*			trans	30.2	134.5	143.9	-54.1	-15.3	0	0	0	124.7
948	L	31	Very low	32.5	Very low	167 Å²	167	147.8 Å²	147.8	87%	0.874	79%	0.791	S	S	*	*				-168	151.2	116.5	-105.6	159.8	0	0	0	115.5
949	Y	32.7	Very low	32.5	Very low	206 Å²	206	145.1 Å²	145.1	81%	0.808	79%	0.792	S	S	*	*			trans	-54.4	164.8	176.6	-81.9	-110.5	0	0	0	116.7
950	D	27.9	Very low	32.7	Very low	106 Å²	106	143.1 Å²	143.1	57%	0.567	79%	0.79	S	S	*	*			cis	-177.7	168.1	-18.7	-162.1	0.5	0	0	0	112
951	F	30.7	Very low	32.7	Very low	172 Å²	172	139.1 Å²	139.1	75%	0.754	79%	0.789	S	S	*	*			trans	54.2	118.5	155.7	-81	-50.1	0	0	0	125.8
952	S	29.8	Very low	33	Very low	99 Å²	99	143.7 Å²	143.7	69%	0.692	79%	0.794	S	S	*	*				115.7	145.3	107.9	-87.1	0	0	0	0	124.6
953	C	26	Very low	34.3	Very low	128 Å²	128	140.9 Å²	140.9	87%	0.865	79%	0.792	S	S	*	*			trans	95.1	133.4	151.7	-73	0	0	0	0	123.7
954	R	34.4	Very low	34.7	Very low	240 Å²	240	144.3 Å²	144.3	91%	0.906	80%	0.797	S	S	*	*			trans	-88.2	-172.3	165	-72.8	-177.7	167.7	-170.1	-2.1	109.6
955	P	45.5	Very low	35.9	Very low	123 Å²	123	140.7 Å²	140.7	80%	0.799	79%	0.791	S	S	*	*			cis	-147.1	-165.7	11.4	44.3	-22.4	0	0	0	118.4
956	A	28.7	Very low	36.2	Very low	98 Å²	98	136.1 Å²	136.1	81%	0.81	79%	0.788	S	S	*	*			trans	103.9	149.8	147.4	0	0	0	0	0	121.4
957	T	33.8	Very low	35.5	Very low	132 Å²	132	140.6 Å²	140.6	81%	0.81	80%	0.796	S	S	*	*			trans	-118.6	161.9	175.4	54.6	0	0	0	0	109.1
958	P	45.4	Very low	35.7	Very low	109 Å²	109	141 Å²	141	71%	0.708	80%	0.804	S	S	*	*				-164.6	170.8	88.8	41.9	-19.9	0	0	0	120.2
959	T	31.2	Very low	35.5	Very low	142 Å²	142	136.3 Å²	136.3	87%	0.871	80%	0.796	S	S	*	*			trans	71.6	159.4	145	42.5	0	0	0	0	125.1
960	S	34.9	Very low	36.7	Very low	111 Å²	111	131.8 Å²	131.8	78%	0.776	79%	0.792	S	S	*	*			trans	-103.6	164.2	-159.2	54.7	0	0	0	0	118
961	A	31.6	Very low	37	Very low	100 Å²	100	133.8 Å²	133.8	83%	0.826	80%	0.802	S	S	*	*				171.3	167	128	0	0	0	0	0	116.4
962	H	38.3	Very low	37.3	Very low	186 Å²	186	131.8 Å²	131.8	86%	0.861	80%	0.799	S	S	*	*			trans	-87.3	179	-178.6	-76.2	-64.3	0	0	0	114
963	P	55.5	Low	37.3	Very low	126 Å²	126	136 Å²	136	82%	0.818	80%	0.801	S	S	*	*			cis	-151.2	-164.1	33.8	44.7	-20.3	0	0	0	120.4
964	L	39.8	Very low	37.6	Very low	161 Å²	161	133.5 Å²	133.5	84%	0.843	79%	0.785	S	S	*	*			trans	-103.4	170.7	-177.9	-79.6	171.4	0	0	0	112.1
965	P	50.7	Low	37.6	Very low	119 Å²	119	129.2 Å²	129.2	77%	0.773	78%	0.775	S	S	*	*				-164	171.8	62.6	45.5	-22.3	0	0	0	122.7
966	A	35.3	Very low	36.8	Very low	94 Å²	94	128.4 Å²	128.4	78%	0.777	77%	0.772	S	S	*	*			trans	58.7	164.8	139.5	0	0	0	0	0	124.5
967	F	32.5	Very low	36.8	Very low	201 Å²	201	129.2 Å²	129.2	88%	0.882	77%	0.77	S	S	*	*			cis	-179.7	140.9	-43	-144.7	-76.4	0	0	0	111.1
968	T	33	Very low	36.4	Very low	142 Å²	142	129.1 Å²	129.1	87%	0.871	77%	0.77	S	S	*	*			trans	-166.2	152.1	157.9	17.5	0	0	0	0	114.2
969	G	27.6	Very low	35.7	Very low	68 Å²	68	132.5 Å²	132.5	70%	0.701	78%	0.776	S	S	*	*			trans	-119.8	-144.4	173.7	0	0	0	0	0	112.6
970	P	58.2	Low	35.8	Very low	111 Å²	111	131.5 Å²	131.5	72%	0.721	78%	0.775	S	S	*	*			cis	-141.9	170.2	1.8	43.4	-25.3	0	0	0	117.8
971	D	34.4	Very low	35.6	Very low	147 Å²	147	129.7 Å²	129.7	79%	0.786	77%	0.774	S	S	*	*				23	169.9	130	-43.8	-41.4	0	0	0	122.9
972	L	35.9	Very low	35.3	Very low	130 Å²	130	130.7 Å²	130.7	68%	0.681	78%	0.775	S	S	*	*			cis	-139.8	171	17.9	-71	160	0	0	0	109.1
973	Y	31.3	Very low	34.7	Very low	189 Å²	189	132.4 Å²	132.4	74%	0.741	78%	0.775	S	S	*	*			cis	-146.8	178.8	30.8	-89.8	-111.6	0	0	0	109.1	H975	Y973-H975 AromaticContact CD1-CE1 3.9Å; Y973-H975 AromaticContact CD1-NE2 3.75Å
974	S	31.7	Very low	33.7	Very low	74 Å²	74	132 Å²	132	52%	0.517	77%	0.772	S	S	.	*			cis	172.3	176.9	-30.4	-74.3	0	0	0	0	105.7
975	H	34.2	Very low	34.2	Very low	150 Å²	150	129.6 Å²	129.6	69%	0.694	77%	0.767	S	S	*	*			cis	-145.3	154.6	10.3	-67.9	-99.2	0	0	0	110.9	Y973	Y973-H975 AromaticContact CD1-CE1 3.9Å; Y973-H975 AromaticContact CD1-NE2 3.75Å
976	S	28.9	Very low	34	Very low	107 Å²	107	129.1 Å²	129.1	75%	0.748	76%	0.764	S	S	*	*			trans	53.9	136.9	142.3	63.7	0	0	0	0	122.2
977	C	27.8	Very low	33.6	Very low	114 Å²	114	134.7 Å²	134.7	77%	0.77	77%	0.766	S	S	*	*			cis	-176.4	156.4	-3.1	-105.3	0	0	0	0	107.1
978	T	27.2	Very low	33.6	Very low	131 Å²	131	131.3 Å²	131.3	80%	0.804	76%	0.761	S	S	*	*			cis	-158.7	-177.2	-12.8	2.1	0	0	0	0	107.8
979	Q	29.6	Very low	33.4	Very low	179 Å²	179	128 Å²	128	84%	0.836	74%	0.744	S	S	*	*			trans	-126.4	152.2	173.2	-71	-178	-21.9	0	0	113.4
980	S	33.7	Very low	33.5	Very low	122 Å²	122	130.9 Å²	130.9	85%	0.853	74%	0.744	S	S	*	*			trans	44.5	130.3	146.5	62.4	0	0	0	0	122.7
981	G	29.5	Very low	32.1	Very low	72 Å²	72	130.1 Å²	130.1	74%	0.742	74%	0.74	S	S	*	*			trans	-176.9	117.5	161.9	0	0	0	0	0	117.4
982	S	27	Very low	31.8	Very low	121 Å²	121	130.9 Å²	130.9	85%	0.846	74%	0.739	S	S	*	*			trans	19.9	134.7	151.7	55.8	0	0	0	0	125.2
983	Y	24.8	Very low	31.5	Very low	222 Å²	222	128.6 Å²	128.6	87%	0.871	73%	0.734	S	S	*	*			trans	-40.4	171.8	152.4	-71.7	-84.1	0	0	0	118.2
984	P	35	Very low	31.4	Very low	117 Å²	117	128.5 Å²	128.5	76%	0.76	74%	0.74	S	S	*	*			cis	-127.6	-120.2	-8.8	25.7	1.8	0	0	0	116
985	P	50.8	Low	31.2	Very low	112 Å²	112	127.8 Å²	127.8	73%	0.727	74%	0.743	S	S	*	*				-121.8	-156.5	-128.9	44.4	-23	0	0	0	113.5
986	P	45.2	Very low	30.9	Very low	109 Å²	109	128.9 Å²	128.9	71%	0.708	75%	0.749	S	S	*	*			cis	-140.5	-177.1	-3.3	44.3	-25.9	0	0	0	117.9
987	Y	28.5	Very low	30.8	Very low	211 Å²	211	129.8 Å²	129.8	83%	0.827	74%	0.744	S	S	*	*			trans	67	142.6	158.5	-106.3	-137.4	0	0	0	116.6
988	V	30.9	Very low	30.8	Very low	129 Å²	129	133.1 Å²	133.1	78%	0.782	75%	0.748	S	S	*	*			cis	-153	149.9	29.6	176.1	0	0	0	0	107.3
989	S	29.2	Very low	30.6	Very low	73 Å²	73	130.1 Å²	130.1	51%	0.51	74%	0.744	S	S	.	*			cis	-165.5	-168.5	-21.3	-165.2	0	0	0	0	108.1
990	D	29.8	Very low	30.3	Very low	129 Å²	129	133.1 Å²	133.1	69%	0.69	75%	0.748	S	S	*	*			trans	23.3	139.1	156.8	-57.2	-62.6	0	0	0	122.2
991	C	27.8	Very low	29.9	Very low	95 Å²	95	133.1 Å²	133.1	64%	0.642	74%	0.743	S	S	*	*			cis	-152	122.7	13.9	-137.4	0	0	0	0	113.7
992	Q	29.7	Very low	29.6	Very low	163 Å²	163	134.3 Å²	134.3	76%	0.762	75%	0.745	S	S	*	*				54.8	146.2	127.1	-68.3	-177.6	35.7	0	0	122.3
993	S	28.9	Very low	30	Very low	82 Å²	82	133.8 Å²	133.8	57%	0.573	74%	0.739	S	S	*	*			cis	169.1	161	-21.8	47.5	0	0	0	0	106.9
994	H	30.1	Very low	30	Very low	187 Å²	187	129.6 Å²	129.6	87%	0.866	73%	0.732	S	S	*	*			cis	-155.3	171.4	-15.3	-92.2	-39.5	0	0	0	105.1
995	G	27.5	Very low	29.9	Very low	58 Å²	58	129.3 Å²	129.3	60%	0.598	73%	0.73	S	S	*	*			cis	-178.6	149.6	2.5	0	0	0	0	0	107.7
996	H	26.8	Very low	28.8	Very low	174 Å²	174	130.3 Å²	130.3	81%	0.806	73%	0.728	S	S	*	*				65.2	138.9	84	-84	12.5	0	0	0	114.4
997	L	27.4	Very low	27.9	Very low	126 Å²	126	136.1 Å²	136.1	66%	0.66	74%	0.736	S	S	*	*			cis	-165.4	-175.8	0.4	-127.7	174.4	0	0	0	110.2
998	Q	26.9	Very low	27.6	Very low	183 Å²	183	131.2 Å²	131.2	86%	0.855	72%	0.724	S	S	*	*			trans	67.8	161.3	166	-65.2	157.1	-9.7	0	0	116.2
999	G	23.4	Very low	27.5	Very low	69 Å²	69	132.7 Å²	132.7	71%	0.711	73%	0.727	S	S	*	*			cis	146.5	142	-14.9	0	0	0	0	0	115.1
1000	R	24.1	Very low	27.3	Very low	241 Å²	241	133.7 Å²	133.7	91%	0.909	73%	0.73	S	S	*	*			trans	81.1	157.6	166.3	-126.5	-178.8	-173.3	-165.1	0.4	118.7
1001	T	24.3	Very low	27.2	Very low	123 Å²	123	134.9 Å²	134.9	76%	0.755	74%	0.736	S	S	*	*			trans	67.5	116.5	159.1	44.3	0	0	0	0	122.7
1002	A	24.6	Very low	27.1	Very low	96 Å²	96	134.6 Å²	134.6	79%	0.793	74%	0.735	S	S	*	*			trans	70.1	147.3	136	0	0	0	0	0	121.6
1003	P	33.5	Very low	27	Very low	110 Å²	110	133.3 Å²	133.3	71%	0.714	73%	0.732	S	S	*	*			trans	-93.5	-177.2	169.6	40.2	-36	0	0	0	113.1
1004	D	26.6	Very low	26.9	Very low	134 Å²	134	138.6 Å²	138.6	72%	0.717	75%	0.745	S	S	*	*			trans	72.2	157.3	165.1	-83.3	-51	0	0	0	118.7
1005	P	32.3	Very low	26.7	Very low	111 Å²	111	136 Å²	136	72%	0.721	75%	0.748	S	S	*	*			cis	-120.8	151	12.6	40.4	-27.7	0	0	0	117.8
1006	L	27	Very low	26.8	Very low	133 Å²	133	140.9 Å²	140.9	70%	0.696	76%	0.755	S	S	*	*			trans	36.9	129.9	134.7	-58.1	172	0	0	0	120.5	L1008	L1006-L1008 HydrophobicContact CD2-CD1 4.14Å
1007	R	26.4	Very low	26.9	Very low	232 Å²	232	144.3 Å²	144.3	88%	0.875	76%	0.761	S	S	*	*				-148.6	119.7	122.5	-133.5	179.8	-172	-167.3	-2	113.3
1008	L	23.7	Very low	26.9	Very low	108 Å²	108	146.9 Å²	146.9	57%	0.565	77%	0.769	S	S	*	*			trans	-77	150.5	159.3	-67.3	75.5	0	0	0	108.7	L1006 V1010	L1006-L1008 HydrophobicContact CD2-CD1 4.14Å; L1008-V1010 HydrophobicContact CB-CG2 4.07Å; L1008-V1010 HydrophobicContact CD2-CG2 3.95Å
1009	D	27.6	Very low	26.8	Very low	159 Å²	159	146.2 Å²	146.2	85%	0.85	77%	0.771	S	S	*	*			trans	-127.3	135.6	145.9	-92.7	-48.6	0	0	0	107
1010	V	25.9	Very low	27	Very low	94 Å²	94	146 Å²	146	57%	0.57	77%	0.769	S	S	*	*			trans	-129.7	156.7	-170.3	-175.5	0	0	0	0	109	L1008	L1008-V1010 HydrophobicContact CB-CG2 4.07Å; L1008-V1010 HydrophobicContact CD2-CG2 3.95Å
1011	L	27.8	Very low	27.1	Very low	155 Å²	155	140.8 Å²	140.8	81%	0.812	76%	0.764	S	S	*	*			trans	81.9	157	176.5	-49.1	175.2	0	0	0	116.4
1012	S	25.7	Very low	27.4	Very low	89 Å²	89	142.7 Å²	142.7	62%	0.622	77%	0.768	S	S	*	*			cis	-177.6	174.4	-33.6	-172.4	0	0	0	0	108.5
1013	L	27.5	Very low	27.5	Very low	135 Å²	135	143.6 Å²	143.6	71%	0.707	77%	0.769	S	S	*	*			trans	67.3	126.8	172.5	-60.1	113.4	0	0	0	115.5
1014	K	25.5	Very low	27.1	Very low	193 Å²	193	143.6 Å²	143.6	84%	0.839	77%	0.772	S	S	*	*				63.1	108.2	53.6	-66.4	-167.9	173	-177.9	0	113.4
1015	S	25.5	Very low	27.8	Very low	132 Å²	132	142.6 Å²	142.6	92%	0.923	77%	0.773	S	S	*	*			trans	-72.7	140.2	165.1	-170.7	0	0	0	0	110.2
1016	Q	31.5	Very low	27.6	Very low	162 Å²	162	143 Å²	143	76%	0.757	78%	0.778	S	S	*	*			trans	-123.9	151.5	-172	-165.3	173.9	7.6	0	0	110.6
1017	R	27.6	Very low	27.4	Very low	245 Å²	245	140.1 Å²	140.1	93%	0.925	78%	0.78	S	S	*	*			trans	-65.8	141	170.1	-69.7	179.5	177	166	-1.3	109.7
1018	H	27.9	Very low	27.9	Very low	181 Å²	181	135.6 Å²	135.6	84%	0.838	78%	0.781	S	S	*	*			trans	-88	132.4	174.8	-87.9	-65.5	0	0	0	112
1019	D	25	Very low	28	Very low	168 Å²	168	138.9 Å²	138.9	90%	0.898	79%	0.793	S	S	*	*				-122.8	168.5	128.8	-109.3	-48.8	0	0	0	107.1
1020	G	26.6	Very low	28.7	Very low	64 Å²	64	136.3 Å²	136.3	66%	0.66	79%	0.785	S	S	*	*			trans	-153.1	-175.1	-170.7	0	0	0	0	0	115.3
1021	V	27.2	Very low	28.9	Very low	133 Å²	133	142.7 Å²	142.7	81%	0.806	80%	0.799	S	S	*	*			trans	164.7	124.5	158.1	147.3	0	0	0	0	109.7
1022	L	29.4	Very low	28.8	Very low	162 Å²	162	141.8 Å²	141.8	85%	0.848	80%	0.8	S	S	*	*			trans	43.5	144.3	149.7	-55.4	176.5	0	0	0	120.8
1023	S	26.7	Very low	28.7	Very low	115 Å²	115	140.9 Å²	140.9	80%	0.804	81%	0.805	S	S	*	*			cis	-160.3	176.2	14.8	32.9	0	0	0	0	113.2
1024	S	26.1	Very low	29.5	Very low	111 Å²	111	140.8 Å²	140.8	78%	0.776	81%	0.812	S	S	*	*			trans	-81.8	-169.3	-175.1	-38.1	0	0	0	0	114.2
1025	P	41.5	Very low	29.5	Very low	113 Å²	113	141 Å²	141	73%	0.734	81%	0.814	S	S	*	*			cis	-144.6	-175.8	1.2	42.8	-22.7	0	0	0	119
1026	S	26.5	Very low	30.4	Very low	120 Å²	120	139.5 Å²	139.5	84%	0.839	80%	0.8	S	S	*	*			trans	83.4	144.2	147.6	66.1	0	0	0	0	122.5
1027	G	24.4	Very low	30.2	Very low	71 Å²	71	141.6 Å²	141.6	73%	0.732	81%	0.807	S	S	*	*			trans	-113.8	-147	176.3	0	0	0	0	0	112.7
1028	P	35.5	Very low	30.1	Very low	137 Å²	137	133.3 Å²	133.3	89%	0.89	80%	0.798	S	S	*	*			cis	-144.9	-169.3	31.2	43.5	-22.5	0	0	0	118
1029	Q	27.3	Very low	30.1	Very low	177 Å²	177	136.7 Å²	136.7	83%	0.827	80%	0.803	S	S	*	*			trans	-61.6	163.5	176.5	-107.5	-177.7	13.4	0	0	116.9
1030	P	42.4	Very low	31	Very low	106 Å²	106	134.7 Å²	134.7	69%	0.688	80%	0.799	S	S	*	*				-162.4	147.1	85.7	40.3	-18.5	0	0	0	122.1
1031	R	28.9	Very low	31	Very low	228 Å²	228	137.9 Å²	137.9	86%	0.86	80%	0.801	S	S	*	*			trans	61.7	159	136.4	-63	178.5	179.3	-174.2	-0.6	120.3
1032	T	27.1	Very low	31	Very low	136 Å²	136	139.2 Å²	139.2	83%	0.834	80%	0.799	S	S	*	*			cis	-156.7	167.1	0.7	-2.2	0	0	0	0	112
1033	G	22.3	Very low	31	Very low	69 Å²	69	137.6 Å²	137.6	71%	0.711	80%	0.796	S	S	*	*			trans	-89.3	-166.5	174.5	0	0	0	0	0	115.7
1034	P	44.2	Very low	31	Very low	133 Å²	133	138.5 Å²	138.5	86%	0.864	79%	0.791	S	S	*	*				-151.9	-170.8	58.4	43	-21.6	0	0	0	119.5
1035	F	25.1	Very low	31.2	Very low	199 Å²	199	139.8 Å²	139.8	87%	0.873	79%	0.789	S	S	*	*			trans	-65.4	-177.9	176.6	-75.4	-82.8	0	0	0	116.5
1036	P	44.7	Very low	30.8	Very low	99 Å²	99	139 Å²	139	64%	0.643	78%	0.782	S	S	*	*			cis	-155.5	173.7	24.3	46.3	-24.6	0	0	0	123.1
1037	K	28	Very low	30.8	Very low	207 Å²	207	142.1 Å²	142.1	90%	0.9	78%	0.783	S	S	*	*			trans	63.7	153.3	154.4	-67.9	159.9	-178.9	-180	0	120.5
1038	G	25.2	Very low	31	Very low	70 Å²	70	142.5 Å²	142.5	72%	0.722	79%	0.787	S	S	*	*			cis	150.4	121.1	-23.6	0	0	0	0	0	119.1
1039	R	28	Very low	30.7	Very low	252 Å²	252	144.3 Å²	144.3	95%	0.951	79%	0.788	S	S	*	*			trans	69.2	169.4	164.2	-69.1	-170.2	175.6	-157.6	-2	118.1
1040	P	43.6	Very low	30.8	Very low	126 Å²	126	139.2 Å²	139.2	82%	0.818	78%	0.783	S	S	*	*			cis	-131.8	-160.1	3.9	40.5	-19.5	0	0	0	117.4
1041	N	26.7	Very low	30.1	Very low	132 Å²	132	142.6 Å²	142.6	71%	0.706	79%	0.789	S	S	*	*			trans	-81.1	177.9	-169	-95.6	22.8	0	0	0	119.1
1042	E	26.7	Very low	30.3	Very low	161 Å²	161	139.2 Å²	139.2	75%	0.752	79%	0.787	S	S	*	*			trans	72.2	149.8	150.6	-75	144.1	-124.2	0	0	116.7
1043	T	29.7	Very low	30.3	Very low	128 Å²	128	144.4 Å²	144.4	79%	0.785	79%	0.791	S	S	*	*			cis	-167	171.8	-0.9	24.2	0	0	0	0	107.7
1044	D	28.4	Very low	30.8	Very low	133 Å²	133	146.2 Å²	146.2	71%	0.711	79%	0.793	S	S	*	*			cis	-175.1	-178.3	-21.3	-179.7	30.3	0	0	0	108.6
1045	L	29.5	Very low	30.7	Very low	138 Å²	138	146.3 Å²	146.3	72%	0.723	79%	0.794	S	S	*	*			trans	76.8	151.6	167.1	-50.7	174.5	0	0	0	118.5
1046	T	32.4	Very low	30.9	Very low	96 Å²	96	142.6 Å²	142.6	59%	0.589	79%	0.792	S	S	*	*			cis	-163.1	158.2	-27.5	21.6	0	0	0	0	111.1
1047	H	27.1	Very low	30	Very low	187 Å²	187	141.4 Å²	141.4	87%	0.866	80%	0.798	S	S	*	*			trans	134.8	131.5	136	-70.4	-63.1	0	0	0	116.6
1048	G	27.4	Very low	30.1	Very low	78 Å²	78	138.8 Å²	138.8	80%	0.804	79%	0.794	S	S	*	*			trans	137.4	113.7	164.7	0	0	0	0	0	115.6
1049	L	31	Very low	30.2	Very low	176 Å²	176	142.6 Å²	142.6	92%	0.921	80%	0.795	S	S	*	*			trans	-131.2	164.5	173.7	-65.6	171.4	0	0	0	108.6
1050	G	27.8	Very low	30.2	Very low	69 Å²	69	137.3 Å²	137.3	71%	0.711	79%	0.785	S	S	*	*			cis	-164.4	-146.8	3.4	0	0	0	0	0	108.5
1051	H	29.5	Very low	29.4	Very low	177 Å²	177	134.6 Å²	134.6	82%	0.819	78%	0.781	S	S	*	*			cis	-162.3	144.6	-0.5	-150.8	-67.1	0	0	0	109.7
1052	L	31.7	Very low	29.5	Very low	158 Å²	158	139.3 Å²	139.3	83%	0.827	79%	0.79	S	S	*	*			trans	-96.6	167.4	170.6	-77.3	168.4	0	0	0	111.8
1053	R	26.6	Very low	29.6	Very low	245 Å²	245	140.1 Å²	140.1	93%	0.925	79%	0.794	S	S	*	*			trans	-144.9	121.3	160.6	-128.7	-175.4	-164	-164.4	5.1	113.9
1054	S	33.8	Very low	29.4	Very low	106 Å²	106	141.3 Å²	141.3	74%	0.741	80%	0.795	S	S	*	*			trans	-102.4	-172.4	157.2	-48.9	0	0	0	0	109.1
1055	P	42.2	Very low	29.2	Very low	135 Å²	135	145.5 Å²	145.5	88%	0.877	80%	0.801	S	S	*	*				-139.3	176.3	112.2	35.4	-21.9	0	0	0	114.1
1056	S	28.6	Very low	29.7	Very low	121 Å²	121	144 Å²	144	85%	0.846	80%	0.8	S	S	*	*			trans	-133.1	167.7	-167	53.9	0	0	0	0	113.2
1057	G	26.2	Very low	29.4	Very low	74 Å²	74	149.8 Å²	149.8	76%	0.763	81%	0.811	S	S	*	*			trans	-159	130.8	170.5	0	0	0	0	0	112.9
1058	N	29.3	Very low	29.4	Very low	153 Å²	153	147.4 Å²	147.4	82%	0.818	80%	0.804	S	S	*	*			trans	-91.1	178.9	174.3	-59	-9.2	0	0	0	110
1059	M	28.2	Very low	29.7	Very low	149 Å²	149	148 Å²	148	73%	0.734	80%	0.802	S	S	*	*			cis	-157.4	169.5	2.5	-148.2	170.3	160	0	0	110.7
1060	D	28.1	Very low	30.3	Very low	141 Å²	141	145.7 Å²	145.7	75%	0.754	80%	0.798	S	S	*	*			trans	48.4	137.7	155.5	-68.9	-15.9	0	0	0	121.5
1061	G	27.5	Very low	30.5	Very low	70 Å²	70	151.1 Å²	151.1	72%	0.722	80%	0.804	S	S	*	*			trans	-123.1	-172.8	-179.9	0	0	0	0	0	114.1
1062	Y	28.1	Very low	30.4	Very low	231 Å²	231	150.9 Å²	150.9	91%	0.906	80%	0.804	S	S	*	*			trans	-153.8	179.1	160	-127.7	-91.9	0	0	0	110.4
1063	E	28	Very low	30.2	Very low	178 Å²	178	150.7 Å²	150.7	83%	0.832	80%	0.8	S	S	*	*			trans	-84.4	162.8	-169.3	-66.7	-170.5	104	0	0	117.1
1064	D	26.4	Very low	30.3	Very low	152 Å²	152	144.2 Å²	144.2	81%	0.813	79%	0.788	S	S	*	*			trans	91.8	163.6	144.6	-136.3	-4.8	0	0	0	121
1065	R	24.9	Very low	30.2	Very low	222 Å²	222	146 Å²	146	84%	0.838	79%	0.788	S	S	*	*			trans	-101.2	-167.8	-170.6	-52.8	168.8	157.1	-178.3	-6.4	109.1
1066	P	38.8	Very low	29.6	Very low	107 Å²	107	146.6 Å²	146.6	70%	0.695	78%	0.784	S	S	*	*			cis	-139.5	173.6	-5	42.6	-25.2	0	0	0	117.2
1067	R	26.6	Very low	29.5	Very low	216 Å²	216	144 Å²	144	82%	0.815	78%	0.776	S	S	*	*			trans	73.6	151.8	137.3	-94.7	-169.9	-166.3	-173.9	4.1	123.3
1068	D	27.4	Very low	29.9	Very low	137 Å²	137	147.5 Å²	147.5	73%	0.733	78%	0.778	S	S	*	*			trans	67.9	145.8	149.8	-53.8	-16.8	0	0	0	120.4
1069	A	33.4	Very low	31.1	Very low	90 Å²	90	145.5 Å²	145.5	74%	0.744	77%	0.773	S	S	*	*			trans	-97.9	173.5	176.6	0	0	0	0	0	110.6
1070	P	44.4	Very low	31.1	Very low	129 Å²	129	143.7 Å²	143.7	84%	0.838	78%	0.775	S	S	*	*				-147.2	-151.7	89.9	41.8	-24.3	0	0	0	113.8
1071	E	30.1	Very low	31.2	Very low	182 Å²	182	140.4 Å²	140.4	85%	0.85	78%	0.775	S	S	*	*			trans	-101.9	169.9	-165	-60.9	164.5	115.9	0	0	114.8
1072	E	28.7	Very low	32.2	Very low	173 Å²	173	142.8 Å²	142.8	81%	0.808	78%	0.777	S	S	*	*			trans	81.8	141.6	146.2	-99.6	-167.8	169.6	0	0	124.7
1073	M	27.9	Very low	32.6	Very low	154 Å²	154	137.4 Å²	137.4	76%	0.759	77%	0.768	S	S	*	*			trans	68.4	156.7	152.3	-69.5	-175	70.1	0	0	121.7
1074	V	28.3	Very low	33.6	Very low	108 Å²	108	134.4 Å²	134.4	66%	0.655	76%	0.764	S	S	*	*			cis	-176.7	166.4	-42.8	123.1	0	0	0	0	109
1075	L	31.3	Very low	34	Very low	143 Å²	143	134.2 Å²	134.2	75%	0.749	76%	0.762	S	S	*	*			trans	77.2	152.3	-177.9	-47.6	-179.8	0	0	0	115.2
1076	D	30.5	Very low	34.2	Very low	149 Å²	149	130.8 Å²	130.8	80%	0.797	76%	0.756	S	S	*	*			cis	-157.2	167.5	-14.4	-114.8	-27.3	0	0	0	108.3
1077	G	26.3	Very low	33.8	Very low	66 Å²	66	133.9 Å²	133.9	68%	0.68	76%	0.761	S	S	*	*			cis	-175.3	-172.4	4.5	0	0	0	0	0	113
1078	D	34.6	Very low	33.8	Very low	148 Å²	148	128.1 Å²	128.1	79%	0.791	75%	0.754	S	S	*	*			trans	-92	179.1	-173.7	-156.3	23.4	0	0	0	112.3	S1080	D1078-S1080 PolarHBondContact OD2-N 3Å
1079	P	53.3	Low	33.9	Very low	110 Å²	110	129.8 Å²	129.8	71%	0.714	76%	0.757	S	S	*	*				-149.9	145	65	37.5	-16.2	0	0	0	118.6
1080	S	29.6	Very low	33.6	Very low	111 Å²	111	135.7 Å²	135.7	78%	0.776	76%	0.76	S	S	*	*				169.8	135.4	120.5	44.9	0	0	0	0	116.1	D1078	D1078-S1080 PolarHBondContact OD2-N 3Å
1081	G	29.2	Very low	32.9	Very low	73 Å²	73	135.7 Å²	135.7	75%	0.753	75%	0.753	S	S	*	*			trans	-109	-154	174.5	0	0	0	0	0	113.5
1082	P	49.6	Very low	32.7	Very low	120 Å²	120	132.8 Å²	132.8	78%	0.779	75%	0.753	S	S	*	*			cis	-117.3	163.4	4.6	33.9	-15.8	0	0	0	114.4
1083	V	34.8	Very low	32.7	Very low	118 Å²	118	131.6 Å²	131.6	72%	0.715	76%	0.757	S	S	*	*			cis	76.1	126.4	46.3	178.6	0	0	0	0	112.4	L1085	V1083-L1085 HydrophobicContact CG1-CD1 4.01Å; V1083-L1085 HydrophobicContact CG1-CG 4.16Å
1084	P	50.4	Low	32.7	Very low	115 Å²	115	127.3 Å²	127.3	75%	0.747	75%	0.752	S	S	*	*			cis	-124.5	152.9	48.9	13	13.1	0	0	0	116.7
1085	L	33.3	Very low	32.6	Very low	147 Å²	147	131.2 Å²	131.2	77%	0.77	76%	0.763	S	S	*	*				77.1	147.8	68.5	-59.6	167.2	0	0	0	114.4	V1083	V1083-L1085 HydrophobicContact CG1-CD1 4.01Å; V1083-L1085 HydrophobicContact CG1-CG 4.16Å
1086	Q	30	Very low	32.5	Very low	150 Å²	150	132.2 Å²	132.2	70%	0.701	76%	0.764	S	S	*	*			cis	-164.3	140.3	27.4	-159.8	171.4	-30.2	0	0	116.9
1087	Q	29.8	Very low	32.6	Very low	172 Å²	172	131.3 Å²	131.3	80%	0.804	76%	0.758	S	S	*	*			trans	55.4	-169.3	148.1	-68.2	175.6	-36.1	0	0	123.6
1088	S	28	Very low	32.8	Very low	95 Å²	95	134 Å²	134	66%	0.664	76%	0.756	S	S	*	*			trans	-152.5	172	-144	56.9	0	0	0	0	115.7
1089	H	28.6	Very low	32.6	Very low	172 Å²	172	136.8 Å²	136.8	80%	0.796	76%	0.756	S	S	*	*			trans	97.9	116.4	163.3	-67.8	-71.4	0	0	0	122.5
1090	R	28.1	Very low	31.6	Very low	215 Å²	215	137.7 Å²	137.7	81%	0.811	75%	0.754	S	S	*	*			trans	71.5	123.6	137.9	-89.1	-167.2	162.4	170.5	-3.2	124.1
1091	N	27.8	Very low	31.7	Very low	129 Å²	129	144 Å²	144	69%	0.69	76%	0.761	S	S	*	*			trans	90.7	144.5	135.4	-67.7	5.6	0	0	0	121.8
1092	S	27.5	Very low	31.7	Very low	121 Å²	121	152.1 Å²	152.1	85%	0.846	77%	0.769	S	S	*	*			trans	72.3	156.2	166.6	75.7	0	0	0	0	117.5
1093	V	28.5	Very low	30.9	Very low	148 Å²	148	151.7 Å²	151.7	90%	0.897	77%	0.769	S	S	*	*			cis	-171.7	156.9	-38.9	127.7	0	0	0	0	107.9
1094	G	26.7	Very low	31.3	Very low	63 Å²	63	151.9 Å²	151.9	65%	0.649	77%	0.773	S	S	*	*			trans	105.5	127.9	176	0	0	0	0	0	112.6
1095	E	27.6	Very low	30.4	Very low	190 Å²	190	151.5 Å²	151.5	89%	0.888	77%	0.773	S	S	*	*			cis	78.5	99	42.7	-69.3	-160.4	114.3	0	0	116
1096	E	28.5	Very low	30.4	Very low	165 Å²	165	151.6 Å²	151.6	77%	0.771	77%	0.767	S	S	*	*				-174.7	129	121.8	-86.8	-127.9	102.4	0	0	108.3
1097	L	31.7	Very low	30.6	Very low	130 Å²	130	150.9 Å²	150.9	68%	0.681	78%	0.775	S	S	*	*				53.5	127.8	95.5	-77.5	84.9	0	0	0	114.1
1098	L	31.8	Very low	30.6	Very low	122 Å²	122	147.2 Å²	147.2	64%	0.639	76%	0.761	S	S	*	*			cis	-151.5	-167.8	5	-98.5	168.9	0	0	0	107.9
1099	R	30.5	Very low	30.5	Very low	207 Å²	207	152.8 Å²	152.8	78%	0.781	77%	0.769	S	S	*	*			cis	-157.9	-179.7	15.8	-151.8	146.4	-165.2	153.4	7.9	113.5
1100	D	31.1	Very low	31	Very low	128 Å²	128	150.5 Å²	150.5	68%	0.684	77%	0.769	S	S	*	*			trans	-68.6	152.9	-175.5	-45.5	-98.7	0	0	0	118
1101	R	31.9	Very low	31.1	Very low	244 Å²	244	150 Å²	150	92%	0.921	77%	0.769	S	S	*	*				-163.6	100.7	116.1	-107.1	174.2	-170.8	-155.7	2.4	115.2
1102	R	29.9	Very low	31.1	Very low	243 Å²	243	153.6 Å²	153.6	92%	0.917	78%	0.779	S	S	*	*			trans	35.7	127.3	145.7	-63.9	-173.4	175.9	-166.3	-2.5	122.3
1103	S	31.9	Very low	31.2	Very low	112 Å²	112	157 Å²	157	78%	0.783	78%	0.778	S	S	*	*			trans	-71.4	177.7	153.9	-39.6	0	0	0	0	112.9
1104	P	44.5	Very low	31.2	Very low	122 Å²	122	155.8 Å²	155.8	79%	0.792	78%	0.776	S	S	*	*				-148.2	157.2	91.5	40	-23.4	0	0	0	118.3
1105	S	30	Very low	31.3	Very low	106 Å²	106	157.1 Å²	157.1	74%	0.741	78%	0.781	S	S	*	*			trans	8.1	136.3	155.4	58	0	0	0	0	124.5
1106	K	34.9	Very low	31.5	Very low	150 Å²	150	160.1 Å²	160.1	65%	0.652	80%	0.802	S	S	*	*			trans	-3.2	157.8	133.1	-62.2	-163.1	179.6	-164.8	0	120.4	D1108	K1106-D1108 WeakPolarHBondContact CD-OD1 3.36Å; K1106-D1108 WeakPolarHBondContact CD-OD2 3.14Å; K1106-D1108 IonicContact NZ-OD1 2.67Å; K1106-D1108 PolarHBondContact NZ-OD1 3.26Å; K1106-D1108 IonicContact NZ-OD2 2.72Å; K1106-D1108 PolarHBondContact NZ-OD2 3.44Å
1107	P	33.1	Very low	31.7	Very low	134 Å²	134	159.9 Å²	159.9	87%	0.87	80%	0.803	S	S	*	*				-115.2	174.4	101.8	35.3	-36.5	0	0	0	114.7
1108	D	29.2	Very low	31.7	Very low	95 Å²	95	161.4 Å²	161.4	51%	0.508	81%	0.81	S	S	.	*			trans	-122.5	156.6	-173.7	-81.8	-55.6	0	0	0	113.3	K1106	K1106-D1108 WeakPolarHBondContact CD-OD1 3.36Å; K1106-D1108 WeakPolarHBondContact CD-OD2 3.14Å; K1106-D1108 IonicContact NZ-OD1 2.67Å; K1106-D1108 PolarHBondContact NZ-OD1 3.26Å; K1106-D1108 IonicContact NZ-OD2 2.72Å; K1106-D1108 PolarHBondContact NZ-OD2 3.44Å
1109	Y	27.6	Very low	31.7	Very low	213 Å²	213	163.6 Å²	163.6	84%	0.835	82%	0.819	S	S	*	*			trans	67	166.6	158.6	-72.6	-55.3	0	0	0	118.2
1110	P	38.1	Very low	31.8	Very low	123 Å²	123	161.1 Å²	161.1	80%	0.799	82%	0.821	S	S	*	*			cis	-125.5	171.5	7.3	40.6	-24.7	0	0	0	117.9
1111	Y	30.9	Very low	31.8	Very low	206 Å²	206	163.1 Å²	163.1	81%	0.808	83%	0.83	S	S	*	*			trans	-82.1	142.7	177.8	-177	-90	0	0	0	112.4
1112	K	27.9	Very low	31.8	Very low	204 Å²	204	157.7 Å²	157.7	89%	0.887	82%	0.824	S	S	*	*			trans	-140.7	150.3	161.9	-90.6	-168.1	177.2	-179.9	0	111.5
1113	K	29.5	Very low	31.9	Very low	193 Å²	193	151.6 Å²	151.6	84%	0.839	82%	0.817	S	S	*	*			trans	-67	148.1	178.5	-61.1	173.5	174.7	-179.6	0	111.8
1114	S	27	Very low	31.9	Very low	122 Å²	122	154.7 Å²	154.7	85%	0.853	82%	0.82	S	S	*	*			trans	-107.6	149.5	135.9	47.8	0	0	0	0	108.5
1115	A	29.6	Very low	30.9	Very low	91 Å²	91	157.4 Å²	157.4	75%	0.752	82%	0.822	S	S	*	*			trans	-130.5	120.9	172.2	0	0	0	0	0	108
1116	L	32.6	Very low	30.9	Very low	252 Å²	252	162.1 Å²	162.1	100%	1.319	83%	0.829	S	S	*	*			trans	-144.4	0	167.2	-76.4	175.2	0	0	0	106

Retrieved 1,116 of 1,116 residues in 1199.2 ms (Link to these results)

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