A0A3Q0KQ55_SCHMA Loading...

Putative glutamate receptor, kainate

AlphaFold DB , UniProt , Accession A0A3Q0KQ55, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,098 aa.

						>A0A3Q0KQ55_SCHMA|A0A3Q0KQ55
MIYAIEILLNLFLLVTFTVNGLQCTLPSNLSANPYNTLLTRYSREIKSVIYIGIILTDEDRETEKAFENGVQAANEVLSQSGTLSSYQLEPIIQFVPKDNVFVATQQACKILDRGIIALYGPSSTSLSQALLSLANRFGLPYVETHWSMISRKTTYAIHLHPSIESYGLGLYEYLTQVEKWKRMTLIYNKPESLLKFTTLVNNFEGILKIKSWDENASGARAMMAELGSGLEKNFLVDIPSWQVTNFLVMAYVHNMTGYQYTFIFTDWDIATLDLSAFKIDVGARIKAISIIPKVTSLDINKTPQPEMLLYKKTLENTAGSKDLSNGNPTIQFSLIYDSLILLAHGLSTVTRTRPLLPQKLSCERPPGLWPLGLSLINAVKSVASETVRGLTSPFRFDKHGLRTLFDLTTLELTQGGFKPTGVWNIDERMKVAKQPVITLPKQLPKIKGVVLKVTTIPDAPFMIPIKFDAYDRPLGTPDAWMGYCIDLLNHIASDVGFNYTVHITPDRQYGSGIDVGNGTIFYNGIMGELIREEADMAVAGFTITYEREKLVDFSTPWMTLGGSILFTRPKSQKPSLFSFLQPLSPQVWLYVGFTYLAVCLCLFVAARLSPHEWTATHPCEEGGDTRKNQFTLLNSFYYNVSALLNQGTELAPHATSTRLLTGVWWFFALIIIATYTANLAAFLTVENMKSPIESAEDLANQEKIKYGTLKSGSSRDFFRTSSLPTFKKMGEFMDKYPDATVSTTQEGIERVLQGNYAFILESTWNEYYAQRDCRLTQVGTLLDSKGYGIGFPQGSPWRDPVSKSILKLQNAQILAKLKRIWWNEFNITEPCSLLRESGKAPSPLGVEQVGGVFIVLLIGFFMGFAVSIIEFLVATRDQQKTAVWRGMWKELKFATRCLTTSRRLRSDIPKLSRSRSSNRLISSVPNNLGAINYSPNSFGFSENHNNNIKLNNNTYISKNIHMSGINSKIGQDTSRDQLLISETRPFNYEQQNQQNQEGTYRTDQKSASLQFPSSFDQSDISAGISSDPQPQTYNARQQQHHPTCNIQSYQQLQQHHPYTHNETDIKRFTMPPSVVRSNFNVGTTNMNGDCELWQINQ
					

Structure Viewer

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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	44.1	Very low	50.3	Low	205 Å²	205	127.5 Å²	127.5	100%	1.01	65%	0.647	S	S	*	*				0	-67.6	0	-75.8	-176.5	175.1	0	0	111.2	Y3 A4 I5	M1-Y3 PolarHBondContact O-N 3.39Å; M1-A4 WeakPolarHBondContact O-CA 3.38Å; M1-A4 WeakPolarHBondContact O-CB 3.2Å; M1-A4 PolarHBondContact O-N 3.08Å; M1-I5 PolarHBondContact O-N 2.85Å
2	I	54.3	Low	49.5	Very low	131 Å²	131	132.6 Å²	132.6	67%	0.672	66%	0.663	S	S	*	*	H	α-helix	trans	-53.5	-52.9	172.6	-62.3	171.8	0	0	0	110.7	A4 I5 E6	I2-A4 PolarHBondContact O-N 2.94Å; I2-I5 PolarHBondContact O-N 3.43Å; I2-E6 HydrophobicContact CG2-CG 4.47Å; I2-E6 PolarHBondContact O-N 2.99Å
3	Y	46.7	Very low	48.1	Very low	189 Å²	189	132.2 Å²	132.2	74%	0.741	66%	0.663	S	S	*	*	H	α-helix	trans	-51.6	-19	170.2	-90.2	-92.7	0	0	0	116.7	M1 I7	M1-Y3 PolarHBondContact O-N 3.39Å; Y3-I7 VanDerWaalsContact O-CD1 3.27Å; Y3-I7 WeakPolarHBondContact O-CD1 3.47Å; Y3-I7 VanDerWaalsContact O-CG1 3.25Å; Y3-I7 WeakPolarHBondContact O-CG1 3.45Å
4	A	52.1	Low	47	Very low	56 Å²	56	133.9 Å²	133.9	46%	0.463	67%	0.674	S	S	.	*	H	α-helix	trans	-92.2	-23.7	176.7	0	0	0	0	0	112.3	M1 I2	M1-A4 WeakPolarHBondContact O-CA 3.38Å; M1-A4 WeakPolarHBondContact O-CB 3.2Å; M1-A4 PolarHBondContact O-N 3.08Å; I2-A4 PolarHBondContact O-N 2.94Å
5	I	57.5	Low	46.4	Very low	111 Å²	111	134.7 Å²	134.7	57%	0.569	69%	0.688	S	S	*	*	H	α-helix	trans	-80.4	-38.4	173.7	-65	166.7	0	0	0	109.2	M1 I2 I7 L8 L9	M1-I5 PolarHBondContact O-N 2.85Å; I2-I5 PolarHBondContact O-N 3.43Å; I5-I7 PolarHBondContact O-N 2.85Å; I5-L8 PolarHBondContact O-N 3.02Å; I5-L9 HydrophobicContact CG2-CD1 4.13Å; I5-L9 WeakPolarHBondContact O-CD1 3.49Å; I5-L9 PolarHBondContact O-N 2.84Å
6	E	53.1	Low	45.5	Very low	88 Å²	88	131.9 Å²	131.9	41%	0.411	68%	0.679	S	S	.	*	H	α-helix	trans	-64.2	-35.1	174.6	-69.8	174.8	115.9	0	0	113.3	I2 L8 L9 N10	I2-E6 HydrophobicContact CG2-CG 4.47Å; I2-E6 PolarHBondContact O-N 2.99Å; E6-L8 VanDerWaalsContact C-N 3.31Å; E6-L8 PolarHBondContact O-N 3.03Å; E6-L9 PolarHBondContact O-N 3.3Å; E6-N10 WeakPolarHBondContact O-CB 3.39Å; E6-N10 PolarHBondContact O-N 2.97Å; E6-N10 PolarHBondContact O-ND2 3.29Å
7	I	61.5	Low	44.7	Very low	112 Å²	112	135.2 Å²	135.2	57%	0.574	69%	0.688	S	S	*	*	H	α-helix	trans	-69.2	-29.5	176.6	-71.4	170.7	0	0	0	111.7	Y3 I5	Y3-I7 VanDerWaalsContact O-CD1 3.27Å; Y3-I7 WeakPolarHBondContact O-CD1 3.47Å; Y3-I7 VanDerWaalsContact O-CG1 3.25Å; Y3-I7 WeakPolarHBondContact O-CG1 3.45Å; I5-I7 PolarHBondContact O-N 2.85Å
8	L	47.4	Very low	44	Very low	140 Å²	140	133.8 Å²	133.8	73%	0.733	69%	0.687	S	S	*	*	H	α-helix	trans	-83.3	-24.6	175.1	-81.8	164.3	0	0	0	113.7	I5 E6	I5-L8 PolarHBondContact O-N 3.02Å; E6-L8 VanDerWaalsContact C-N 3.31Å; E6-L8 PolarHBondContact O-N 3.03Å
9	L	52.4	Low	43.4	Very low	116 Å²	116	133.1 Å²	133.1	61%	0.607	69%	0.689	S	S	*	*	H	α-helix	trans	-78.9	-41.5	170.7	-95.8	73.2	0	0	0	112.5	I5 E6 L11 F12	I5-L9 HydrophobicContact CG2-CD1 4.13Å; I5-L9 WeakPolarHBondContact O-CD1 3.49Å; I5-L9 PolarHBondContact O-N 2.84Å; E6-L9 PolarHBondContact O-N 3.3Å; L9-L11 PolarHBondContact O-N 3.19Å; L9-F12 PolarHBondContact O-N 2.97Å
10	N	43	Very low	43.1	Very low	105 Å²	105	134.7 Å²	134.7	56%	0.561	70%	0.699	S	S	*	*	H	α-helix	trans	-82.5	-9.9	-172.3	-69.9	-61.4	0	0	0	114.7	E6 F12	E6-N10 WeakPolarHBondContact O-CB 3.39Å; E6-N10 PolarHBondContact O-N 2.97Å; E6-N10 PolarHBondContact O-ND2 3.29Å; N10-F12 PolarHBondContact O-N 3.23Å
11	L	41.3	Very low	42.7	Very low	149 Å²	149	131.7 Å²	131.7	78%	0.78	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-0.6	168.2	-116.3	159.4	0	0	0	113.3	L9	L9-L11 PolarHBondContact O-N 3.19Å
12	F	40.7	Very low	42	Very low	189 Å²	189	129.8 Å²	129.8	83%	0.829	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	0.3	177.6	-129.5	-94	0	0	0	114.1	L9 N10	L9-F12 PolarHBondContact O-N 2.97Å; N10-F12 PolarHBondContact O-N 3.23Å
13	L	31.8	Very low	40.8	Very low	127 Å²	127	131.7 Å²	131.7	67%	0.665	70%	0.7	S	S	*	*			trans	-147.5	94.7	-174.7	-73.1	168.7	0	0	0	112.9
14	L	32.8	Very low	39.9	Very low	157 Å²	157	128.2 Å²	128.2	82%	0.822	70%	0.702	S	S	*	*			trans	174.9	107.7	140.6	-101.1	162.7	0	0	0	114.3	T16	L14-T16 HydrophobicContact CD2-CG2 4.21Å
15	V	37.6	Very low	39	Very low	146 Å²	146	131.8 Å²	131.8	89%	0.885	72%	0.719	S	S	*	*			trans	-150	141.4	154.2	176.1	0	0	0	0	107.7
16	T	32	Very low	37.8	Very low	89 Å²	89	134 Å²	134	55%	0.546	73%	0.731	S	S	.	*				-156.6	144	-72.4	14.7	0	0	0	0	110	L14	L14-T16 HydrophobicContact CD2-CG2 4.21Å
17	F	31.6	Very low	37.1	Very low	189 Å²	189	134.6 Å²	134.6	83%	0.829	74%	0.742	S	S	*	*			trans	65.2	165	163.4	-75.1	-130	0	0	0	117.3
18	T	31.6	Very low	35.6	Very low	109 Å²	109	134 Å²	134	67%	0.669	75%	0.748	S	S	*	*			cis	-161.3	142.4	-41.4	30.4	0	0	0	0	110.6
19	V	33.7	Very low	34.8	Very low	120 Å²	120	134.2 Å²	134.2	73%	0.727	75%	0.75	S	S	*	*			trans	58.4	102.7	147.7	-179.4	0	0	0	0	120.2
20	N	36.5	Very low	33.7	Very low	165 Å²	165	135.4 Å²	135.4	88%	0.882	76%	0.756	S	S	*	*				168.1	154.6	120.5	-95.3	-40.4	0	0	0	113.7
21	G	34.3	Very low	33	Very low	73 Å²	73	135.5 Å²	135.5	75%	0.753	77%	0.765	S	S	*	*			trans	109.8	101.6	159.3	0	0	0	0	0	117.5
22	L	29.4	Very low	32.4	Very low	165 Å²	165	133 Å²	133	86%	0.864	77%	0.766	S	S	*	*			trans	-82.4	157.9	162.3	-85.5	68.5	0	0	0	110.1
23	Q	29.3	Very low	32	Very low	170 Å²	170	131.9 Å²	131.9	79%	0.794	77%	0.769	S	S	*	*				160.6	116	93.5	-166.9	157.4	-16.4	0	0	114.8
24	C	28	Very low	32.6	Very low	116 Å²	116	130 Å²	130	78%	0.784	76%	0.764	S	S	*	*			trans	59.3	158.5	151.8	-62	0	0	0	0	120
25	T	32.6	Very low	32.8	Very low	132 Å²	132	132.6 Å²	132.6	81%	0.81	77%	0.765	S	S	*	*			cis	-131.4	144	6.6	45.5	0	0	0	0	114.6
26	L	33	Very low	32.7	Very low	157 Å²	157	132.7 Å²	132.7	82%	0.822	76%	0.76	S	S	*	*			trans	-48.9	-178	151.8	-95.5	72.3	0	0	0	115.3
27	P	38.4	Very low	33	Very low	100 Å²	100	134.1 Å²	134.1	65%	0.649	77%	0.769	S	S	*	*			cis	-144.6	-167.8	-28	36.8	-16.4	0	0	0	115.2
28	S	31	Very low	33.3	Very low	100 Å²	100	133.4 Å²	133.4	70%	0.699	77%	0.773	S	S	*	*			trans	79.6	154.1	138.7	79.7	0	0	0	0	119.6
29	N	29.3	Very low	33.6	Very low	144 Å²	144	136.4 Å²	136.4	77%	0.77	78%	0.784	S	S	*	*			cis	-162.2	163.3	-31.6	-116.5	-11.5	0	0	0	111.3
30	L	29.2	Very low	33.8	Very low	142 Å²	142	137 Å²	137	74%	0.743	79%	0.788	S	S	*	*			trans	53.3	123.7	151.4	-94.5	70.8	0	0	0	121.7
31	S	29.2	Very low	33.8	Very low	107 Å²	107	141.1 Å²	141.1	75%	0.748	79%	0.791	S	S	*	*			trans	41	118	137.5	64.6	0	0	0	0	121.5
32	A	28.9	Very low	34.1	Very low	97 Å²	97	148 Å²	148	80%	0.802	80%	0.796	S	S	*	*				-172	107.7	115.6	0	0	0	0	0	114.4
33	N	32.3	Very low	34.6	Very low	164 Å²	164	145.1 Å²	145.1	88%	0.877	79%	0.789	S	S	*	*			trans	58.9	-159	139.2	-131.4	1.4	0	0	0	116.7
34	P	43.2	Very low	35.4	Very low	88 Å²	88	148 Å²	148	57%	0.571	79%	0.793	S	S	*	*			trans	-125.2	175.4	-143.2	34.9	-11.9	0	0	0	117.3
35	Y	37.5	Very low	36.7	Very low	212 Å²	212	151 Å²	151	83%	0.831	80%	0.796	S	S	*	*			trans	67.7	128.7	172.7	-63	-81.6	0	0	0	117.9
36	N	35.6	Very low	38.4	Very low	147 Å²	147	152.6 Å²	152.6	79%	0.786	80%	0.797	S	S	*	*			trans	63.8	151.3	165	-63.2	-16.9	0	0	0	115.8
37	T	37.3	Very low	40.5	Very low	119 Å²	119	148.7 Å²	148.7	73%	0.73	77%	0.774	S	S	*	*			cis	-163.7	149.1	-15.2	18.5	0	0	0	0	106.4
38	L	37.9	Very low	42.7	Very low	174 Å²	174	146.9 Å²	146.9	91%	0.911	76%	0.763	S	S	*	*			trans	-176.7	113.9	139.3	-103.4	160.2	0	0	0	110.9
39	L	38.3	Very low	45.4	Very low	172 Å²	172	144.6 Å²	144.6	90%	0.901	75%	0.745	S	S	*	*			trans	-92	126.2	172.2	-79.4	156.7	0	0	0	109.5
40	T	39.4	Very low	48.3	Very low	132 Å²	132	137.9 Å²	137.9	81%	0.81	71%	0.709	S	S	*	*			trans	-69	135.8	172	35.5	0	0	0	0	110.7	Y42	T40-Y42 PolarHBondContact O-N 3.1Å; T40-Y42 VanDerWaalsContact O-N 3.09Å
41	R	35.2	Very low	51.4	Low	253 Å²	253	134.5 Å²	134.5	96%	0.955	69%	0.687	S	S	*	*			trans	-65.2	108.2	178.4	-81.5	179.2	167.7	172.5	-4.6	110.8
42	Y	40.1	Very low	54.5	Low	217 Å²	217	129.4 Å²	129.4	85%	0.851	65%	0.651	S	S	*	*			trans	-80.4	127.8	156.4	-115.3	-94.7	0	0	0	109.4	T40 R44	T40-Y42 PolarHBondContact O-N 3.1Å; T40-Y42 VanDerWaalsContact O-N 3.09Å; Y42-R44 PolarHBondContact O-N 3.12Å
43	S	40.6	Very low	57.6	Low	104 Å²	104	124.8 Å²	124.8	73%	0.727	61%	0.613	S	S	*	*			trans	-70.7	120.6	167.6	-170.2	0	0	0	0	108.7	E45	S43-E45 PolarHBondContact O-N 2.97Å
44	R	45.7	Very low	60.6	Low	232 Å²	232	117 Å²	117	88%	0.875	57%	0.571	S	S	*	*			trans	-86.7	101.6	169.6	-79.6	-175.6	171.4	178.5	-3.6	108.7	Y42 I46	Y42-R44 PolarHBondContact O-N 3.12Å; R44-I46 PolarHBondContact O-N 2.96Å
45	E	56.8	Low	63	Low	179 Å²	179	112.8 Å²	112.8	84%	0.836	54%	0.544	S	S	*	.			trans	-61.7	127.4	162.2	-66	-173.2	137.1	0	0	109	S43 K47	S43-E45 PolarHBondContact O-N 2.97Å; E45-K47 PolarHBondContact O-N 3.29Å
46	I	67.5	Low	65.6	Low	165 Å²	165	103 Å²	103	85%	0.846	51%	0.506	S	S	*	.			trans	-82.5	106.7	-178.8	-59.4	175.9	0	0	0	107.9	R44	R44-I46 PolarHBondContact O-N 2.96Å
47	K	78	Confident	68.3	Low	75 Å²	75	96 Å²	96	33%	0.326	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-70.8	143.9	176	-65.7	-163.9	176.5	-147.8	0	111.7	E45 S85 S86 Q88	E45-K47 PolarHBondContact O-N 3.29Å; K47-S85 WeakPolarHBondContact CE-O 3.42Å; K47-S85 PolarHBondContact NZ-O 3.13Å; K47-S86 CarbonylContact C-O 3.55Å; K47-S86 VanDerWaalsContact CA-O 3.24Å; K47-S86 WeakPolarHBondContact CA-O 3.36Å; K47-S86 WeakPolarHBondContact CB-O 3.31Å; K47-Q88 HydrophobicContact CB-CB 4.29Å; K47-Q88 HydrophobicContact CB-CG 4.1Å; K47-Q88 HydrophobicContact CD-CB 4.31Å
48	S	84.2	Confident	70.6	Confident	61 Å²	61	94.8 Å²	94.8	43%	0.427	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	129.3	176.1	-68.3	0	0	0	0	111	S86 Y87 Q88	S48-S86 PolarHBondContact N-O 3.44Å; S48-Y87 CarbonylContact O-C 3.56Å; S48-Y87 WeakPolarHBondContact O-CA 3.37Å; S48-Q88 PolarHBondContact O-N 2.93Å
49	V	87.9	Confident	72.7	Confident	53 Å²	53	92.5 Å²	92.5	32%	0.321	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	136.5	-174.6	-177.1	0	0	0	0	112	Y51 Q88 E90	V49-Y51 HydrophobicContact CG1-CD1 3.9Å; V49-Y51 HydrophobicContact CG1-CE1 3.46Å; V49-Y51 VanDerWaalsContact CG1-CE1 3.46Å; V49-Y51 HydrophobicContact CG1-CE2 4.15Å; V49-Y51 HydrophobicContact CG1-CG 4.41Å; V49-Q88 CarbonylContact C-O 3.58Å; V49-Q88 WeakPolarHBondContact CA-O 3.42Å; V49-Q88 HydrophobicContact CG2-CG 4.16Å; V49-E90 HydrophobicContact CG1-CB 3.54Å; V49-E90 HydrophobicContact CG1-CG 4.37Å; V49-E90 WeakPolarHBondContact CG1-OE2 3.45Å
50	I	90	Very high	74.7	Confident	2 Å²	2	85.7 Å²	85.7	1%	0.01	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	118.1	172.9	-55.8	168	0	0	0	107.5	Y87 Q88 L89 E90 I117 L347 L356	I50-Y87 HydrophobicContact CD1-CD1 3.7Å; I50-Y87 HydrophobicContact CD1-CG 3.92Å; I50-Y87 HydrophobicContact CG1-CD1 3.73Å; I50-Y87 HydrophobicContact CG1-CG 4.39Å; I50-Q88 PolarHBondContact N-O 3.21Å; I50-L89 HydrophobicContact CB-CD2 4.11Å; I50-L89 HydrophobicContact CG2-CD2 3.93Å; I50-L89 CarbonylContact O-C 2.99Å; I50-L89 VanDerWaalsContact O-CA 3.29Å; I50-L89 WeakPolarHBondContact O-CA 3.38Å; I50-E90 PolarHBondContact O-N 3.31Å; I50-I117 HydrophobicContact CG2-CB 4.34Å; I50-I117 HydrophobicContact CG2-CD1 3.71Å; I50-I117 HydrophobicContact CG2-CG1 3.81Å; I50-I117 HydrophobicContact CG2-CG2 3.6Å; I50-L347 HydrophobicContact CD1-CD2 4.1Å; I50-L356 HydrophobicContact CD1-CD2 3.43Å; I50-L356 VanDerWaalsContact CD1-CD2 3.43Å; I50-L356 HydrophobicContact CG1-CD2 3.95Å
51	Y	93.8	Very high	76.8	Confident	72 Å²	72	86.8 Å²	86.8	28%	0.282	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	141	-177	-64.7	-65.5	0	0	0	113.1	V49 E90 I92 I116 I117	V49-Y51 HydrophobicContact CG1-CD1 3.9Å; V49-Y51 HydrophobicContact CG1-CE1 3.46Å; V49-Y51 VanDerWaalsContact CG1-CE1 3.46Å; V49-Y51 HydrophobicContact CG1-CE2 4.15Å; V49-Y51 HydrophobicContact CG1-CG 4.41Å; Y51-E90 WeakPolarHBondContact CA-O 3.33Å; Y51-E90 HydrophobicContact CD1-CB 4.1Å; Y51-E90 HydrophobicContact CE1-CB 4.15Å; Y51-E90 HydrophobicContact CE1-CG 4.27Å; Y51-E90 WeakPolarHBondContact CE1-OE1 3.2Å; Y51-I92 HydrophobicContact CD1-CD1 3.73Å; Y51-I92 HydrophobicContact CD1-CG1 3.83Å; Y51-I92 HydrophobicContact CG-CD1 3.71Å; Y51-I92 HydrophobicContact CG-CG1 4.3Å; Y51-I116 CarbonylContact O-C 3.5Å; Y51-I116 VanDerWaalsContact O-CA 3.26Å; Y51-I116 WeakPolarHBondContact O-CA 3.38Å; Y51-I117 PolarHBondContact O-N 2.71Å
52	I	94.2	Very high	78.8	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.6	163.1	63.4	174.8	0	0	0	109.8	I54 V71 L89 E90 P91 I92 I117 Y120 L340 L343	I52-I54 HydrophobicContact CD1-CD1 4.02Å; I52-I54 HydrophobicContact CG1-CD1 4.19Å; I52-V71 HydrophobicContact CD1-CG2 3.63Å; I52-L89 HydrophobicContact CG2-CD2 3.95Å; I52-E90 PolarHBondContact N-O 2.81Å; I52-E90 VanDerWaalsContact N-O 3.07Å; I52-P91 HydrophobicContact CG1-CB 4.32Å; I52-I92 PolarHBondContact O-N 2.9Å; I52-I117 HydrophobicContact CG2-CD1 4.41Å; I52-I117 HydrophobicContact CG2-CG1 3.93Å; I52-Y120 HydrophobicContact CD1-CE2 4.22Å; I52-L340 HydrophobicContact CD1-CD2 3.53Å; I52-L343 HydrophobicContact CG2-CD2 3.94Å
53	G	94.5	Very high	80.9	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132.9	177.1	0	0	0	0	0	110.8	A118 L119 Y120	G53-A118 PolarHBondContact N-O 2.87Å; G53-L119 CarbonylContact O-C 3.6Å; G53-L119 WeakPolarHBondContact O-CA 3.44Å; G53-Y120 PolarHBondContact O-N 3.02Å
54	I	94.8	Very high	83.1	Confident	0 Å²	0	72 Å²	72	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	126.6	178.1	-61.3	152.9	0	0	0	108.3	I52 L56 F67 P91 I92 I93 Q94 Y120	I52-I54 HydrophobicContact CD1-CD1 4.02Å; I52-I54 HydrophobicContact CG1-CD1 4.19Å; I54-L56 HydrophobicContact CG2-CD1 4.34Å; I54-L56 HydrophobicContact CG2-CD2 3.79Å; I54-L56 HydrophobicContact CG2-CG 3.87Å; I54-F67 HydrophobicContact CD1-CB 3.96Å; I54-F67 HydrophobicContact CD1-CD1 3.44Å; I54-F67 VanDerWaalsContact CD1-CD1 3.44Å; I54-F67 HydrophobicContact CD1-CE1 4.12Å; I54-F67 HydrophobicContact CD1-CG 3.78Å; I54-F67 HydrophobicContact CG1-CD1 3.85Å; I54-F67 HydrophobicContact CG1-CE1 4Å; I54-F67 HydrophobicContact CG1-CG 4.42Å; I54-F67 HydrophobicContact CG2-CD1 4.21Å; I54-F67 HydrophobicContact CG2-CD2 4.06Å; I54-F67 HydrophobicContact CG2-CE1 4.08Å; I54-F67 HydrophobicContact CG2-CE2 3.95Å; I54-F67 HydrophobicContact CG2-CG 4.21Å; I54-F67 HydrophobicContact CG2-CZ 3.95Å; I54-P91 HydrophobicContact CD1-CB 3.59Å; I54-I92 PolarHBondContact N-O 2.97Å; I54-I93 HydrophobicContact CB-CG1 4.2Å; I54-I93 HydrophobicContact CD1-CG1 3.93Å; I54-I93 HydrophobicContact CG2-CG1 4.41Å; I54-I93 HydrophobicContact CG2-CG2 4.47Å; I54-I93 CarbonylContact O-C 3.58Å; I54-I93 WeakPolarHBondContact O-CA 3.21Å; I54-Q94 PolarHBondContact O-N 3.03Å; I54-Y120 HydrophobicContact CG1-CD2 3.95Å; I54-Y120 HydrophobicContact CG1-CG 4.16Å
55	I	94.1	Very high	84.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120.6	175.6	-64	174.3	0	0	0	108.1	Q94 V96 A108 I111 L119 Y120 G121 P122 L131	I55-Q94 WeakPolarHBondContact CA-O 3.48Å; I55-V96 HydrophobicContact CG2-CG1 4.1Å; I55-V96 HydrophobicContact CG2-CG2 3.61Å; I55-A108 HydrophobicContact CD1-CB 3.6Å; I55-I111 HydrophobicContact CD1-CD1 4.14Å; I55-I111 HydrophobicContact CG1-CD1 3.85Å; I55-L119 HydrophobicContact CD1-CD1 4.13Å; I55-L119 HydrophobicContact CG1-CD1 4.32Å; I55-Y120 PolarHBondContact N-O 3.36Å; I55-G121 CarbonylContact O-C 3.58Å; I55-P122 VanDerWaalsContact O-CA 3.28Å; I55-P122 WeakPolarHBondContact O-CA 3.36Å; I55-P122 WeakPolarHBondContact O-CB 3.37Å; I55-P122 WeakPolarHBondContact O-CD 3.26Å; I55-L131 HydrophobicContact CB-CD1 4.1Å; I55-L131 HydrophobicContact CD1-CD1 3.96Å; I55-L131 HydrophobicContact CD1-CD2 3.72Å; I55-L131 HydrophobicContact CG2-CD1 4.04Å
56	L	92.3	Very high	86.3	Confident	5 Å²	5	57.9 Å²	57.9	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	152.6	-178.2	-57.7	179.7	0	0	0	109.4	I54 D60 T63 F67 I93 Q94 F95 V96	I54-L56 HydrophobicContact CG2-CD1 4.34Å; I54-L56 HydrophobicContact CG2-CD2 3.79Å; I54-L56 HydrophobicContact CG2-CG 3.87Å; L56-D60 HydrophobicContact CB-CB 4.26Å; L56-T63 WeakPolarHBondContact CD1-OG1 3.4Å; L56-F67 HydrophobicContact CD1-CD2 4.45Å; L56-F67 HydrophobicContact CD2-CD2 4.37Å; L56-F67 HydrophobicContact CD2-CE2 3.71Å; L56-F67 HydrophobicContact CD2-CZ 4.41Å; L56-I93 HydrophobicContact CD1-CG2 3.83Å; L56-I93 HydrophobicContact CG-CG2 4.31Å; L56-Q94 PolarHBondContact N-O 3.19Å; L56-F95 HydrophobicContact CB-CD1 3.87Å; L56-F95 HydrophobicContact CB-CE1 3.88Å; L56-F95 HydrophobicContact CD1-CE1 3.73Å; L56-F95 HydrophobicContact CD1-CZ 4.26Å; L56-F95 HydrophobicContact CG-CE1 4.37Å; L56-F95 WeakPolarHBondContact O-CA 3.19Å; L56-V96 PolarHBondContact O-N 2.03Å
57	T	91.5	Very high	87.4	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	161.1	165.5	70.5	0	0	0	0	110.6	E59 D60 V96 K98 P122 L127	T57-E59 PolarHBondContact O-N 3.33Å; T57-E59 PolarHBondContact OG1-N 3.13Å; T57-D60 VanDerWaalsContact CB-OD2 3.3Å; T57-D60 WeakPolarHBondContact CB-OD2 3.4Å; T57-D60 WeakPolarHBondContact CG2-OD2 3.41Å; T57-D60 PolarHBondContact N-OD2 3.13Å; T57-D60 PolarHBondContact O-N 2.91Å; T57-D60 VanDerWaalsContact O-N 3.11Å; T57-D60 PolarHBondContact OG1-N 3.21Å; T57-D60 PolarHBondContact OG1-OD2 3.43Å; T57-V96 VanDerWaalsContact CA-O 3.26Å; T57-V96 WeakPolarHBondContact CA-O 2.98Å; T57-K98 HydrophobicContact CG2-CB 4.11Å; T57-K98 HydrophobicContact CG2-CG 4.28Å; T57-P122 HydrophobicContact CG2-CB 3.93Å; T57-L127 HydrophobicContact CG2-CD1 4.11Å
58	D	87	Confident	87.9	Confident	95 Å²	95	51.6 Å²	51.6	51%	0.508	25%	0.247	S	C	.	.	S	Bend	trans	-59.7	-21.9	171	-59.1	-59	0	0	0	112.9	V96 P97	D58-V96 PolarHBondContact N-O 2.99Å; D58-V96 VanDerWaalsContact OD2-C 3.25Å; D58-P97 VanDerWaalsContact OD2-CA 3.32Å; D58-P97 WeakPolarHBondContact OD2-CA 3.48Å
59	E	80.7	Confident	88	Confident	126 Å²	126	51 Å²	51	59%	0.589	24%	0.24	S	C	*	.	S	Bend	trans	-77.7	-37	173.1	-62.3	178.2	-168.1	0	0	112.5	T57 R61 K98	T57-E59 PolarHBondContact O-N 3.33Å; T57-E59 PolarHBondContact OG1-N 3.13Å; E59-R61 PolarHBondContact O-N 3.37Å; E59-K98 VanDerWaalsContact CD-CD 3.5Å; E59-K98 HydrophobicContact CG-CD 4.5Å; E59-K98 WeakPolarHBondContact OE1-CD 3.45Å; E59-K98 IonicContact OE1-NZ 2.64Å; E59-K98 PolarHBondContact OE1-NZ 2.96Å; E59-K98 IonicContact OE2-NZ 2.72Å; E59-K98 PolarHBondContact OE2-NZ 2.95Å
60	D	81.4	Confident	87.9	Confident	29 Å²	29	48.5 Å²	48.5	16%	0.155	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-74.7	11.1	-175	-55.6	-54.1	0	0	0	113.4	L56 T57 E62 T63 S123	L56-D60 HydrophobicContact CB-CB 4.26Å; T57-D60 VanDerWaalsContact CB-OD2 3.3Å; T57-D60 WeakPolarHBondContact CB-OD2 3.4Å; T57-D60 WeakPolarHBondContact CG2-OD2 3.41Å; T57-D60 PolarHBondContact N-OD2 3.13Å; T57-D60 PolarHBondContact O-N 2.91Å; T57-D60 VanDerWaalsContact O-N 3.11Å; T57-D60 PolarHBondContact OG1-N 3.21Å; T57-D60 PolarHBondContact OG1-OD2 3.43Å; D60-E62 PolarHBondContact O-N 3.2Å; D60-E62 VanDerWaalsContact O-N 3.08Å; D60-T63 WeakPolarHBondContact O-CB 3.34Å; D60-T63 WeakPolarHBondContact O-CG2 3.26Å; D60-T63 PolarHBondContact O-N 2.97Å; D60-T63 PolarHBondContact O-OG1 2.94Å; D60-S123 WeakPolarHBondContact OD1-CB 3.49Å; D60-S123 PolarHBondContact OD1-OG 3.1Å; D60-S123 PolarHBondContact OD2-N 2.9Å; D60-S123 PolarHBondContact OD2-OG 3.43Å
61	R	82.5	Confident	88	Confident	155 Å²	155	48.7 Å²	48.7	59%	0.585	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-59.6	-28.4	-165.7	-170.3	170.9	-175.2	-180	2.2	114.5	E59 T63 E64 F95	E59-R61 PolarHBondContact O-N 3.37Å; R61-T63 PolarHBondContact O-N 3.13Å; R61-E64 IonicContact NE-OE2 2.68Å; R61-E64 WeakPolarHBondContact O-CB 3.26Å; R61-E64 PolarHBondContact O-N 3.28Å; R61-E64 VanDerWaalsContact O-N 3.16Å; R61-F95 HydrophobicContact CB-CE1 4.14Å; R61-F95 HydrophobicContact CG-CE1 3.88Å; R61-F95 HydrophobicContact CG-CZ 4Å
62	E	78	Confident	87.7	Confident	181 Å²	181	49.9 Å²	49.9	85%	0.846	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-62.4	-24	175.2	-59.6	-173	167.5	0	0	113.1	D60 E64	D60-E62 PolarHBondContact O-N 3.2Å; D60-E62 VanDerWaalsContact O-N 3.08Å; E62-E64 VanDerWaalsContact C-N 3.26Å; E62-E64 PolarHBondContact O-N 3.35Å
63	T	83.6	Confident	87.3	Confident	24 Å²	24	50.1 Å²	50.1	15%	0.147	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-72.6	-13.8	177.4	69.1	0	0	0	0	113.9	L56 D60 R61 K65 A66 F67 I336	L56-T63 WeakPolarHBondContact CD1-OG1 3.4Å; D60-T63 WeakPolarHBondContact O-CB 3.34Å; D60-T63 WeakPolarHBondContact O-CG2 3.26Å; D60-T63 PolarHBondContact O-N 2.97Å; D60-T63 PolarHBondContact O-OG1 2.94Å; R61-T63 PolarHBondContact O-N 3.13Å; T63-K65 VanDerWaalsContact C-N 3.27Å; T63-K65 PolarHBondContact O-N 3.22Å; T63-A66 WeakPolarHBondContact O-CA 3.34Å; T63-A66 VanDerWaalsContact O-CB 3.3Å; T63-A66 WeakPolarHBondContact O-CB 3.36Å; T63-A66 PolarHBondContact O-N 2.92Å; T63-F67 WeakPolarHBondContact O-CD2 3.25Å; T63-F67 PolarHBondContact O-N 2.98Å; T63-F67 VanDerWaalsContact O-N 3.16Å; T63-I336 HydrophobicContact CG2-CD1 4.28Å
64	E	87.2	Confident	87.1	Confident	57 Å²	57	50.1 Å²	50.1	27%	0.266	24%	0.236	S	C	.	.	H	α-helix	trans	-49	-49.1	175.8	-177.7	164.8	-136.9	0	0	111.3	R61 E62 A66 F67 E68 I93 F95	R61-E64 IonicContact NE-OE2 2.68Å; R61-E64 WeakPolarHBondContact O-CB 3.26Å; R61-E64 PolarHBondContact O-N 3.28Å; R61-E64 VanDerWaalsContact O-N 3.16Å; E62-E64 VanDerWaalsContact C-N 3.26Å; E62-E64 PolarHBondContact O-N 3.35Å; E64-A66 VanDerWaalsContact C-N 3.3Å; E64-A66 PolarHBondContact O-N 3.42Å; E64-F67 PolarHBondContact O-N 3.38Å; E64-E68 PolarHBondContact O-N 2.94Å; E64-E68 VanDerWaalsContact O-N 3.1Å; E64-I93 HydrophobicContact CG-CD1 3.94Å; E64-F95 HydrophobicContact CB-CZ 4.27Å; E64-F95 HydrophobicContact CG-CZ 4.28Å; E64-F95 WeakPolarHBondContact OE1-CE2 3Å; E64-F95 WeakPolarHBondContact OE1-CZ 3.49Å
65	K	84.2	Confident	86.9	Confident	110 Å²	110	51.9 Å²	51.9	48%	0.478	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-27.1	176.9	-65	177	-180	174.2	0	113.9	T63 N69	T63-K65 VanDerWaalsContact C-N 3.27Å; T63-K65 PolarHBondContact O-N 3.22Å; K65-N69 WeakPolarHBondContact O-CB 3.39Å; K65-N69 PolarHBondContact O-N 3.13Å; K65-N69 VanDerWaalsContact O-N 3.12Å; K65-N69 PolarHBondContact O-ND2 3.19Å
66	A	85.7	Confident	86.6	Confident	6 Å²	6	55.3 Å²	55.3	5%	0.05	26%	0.261	C	S	.	.	H	α-helix	trans	-70.9	-38.5	176	0	0	0	0	0	110.8	T63 E64 G70 F333 I336	T63-A66 WeakPolarHBondContact O-CA 3.34Å; T63-A66 VanDerWaalsContact O-CB 3.3Å; T63-A66 WeakPolarHBondContact O-CB 3.36Å; T63-A66 PolarHBondContact O-N 2.92Å; E64-A66 VanDerWaalsContact C-N 3.3Å; E64-A66 PolarHBondContact O-N 3.42Å; A66-G70 PolarHBondContact O-N 3.2Å; A66-F333 HydrophobicContact CB-CB 4.4Å; A66-F333 HydrophobicContact CB-CD2 3.67Å; A66-F333 HydrophobicContact CB-CE2 4.37Å; A66-F333 HydrophobicContact CB-CG 4.4Å; A66-I336 HydrophobicContact CB-CB 4.27Å; A66-I336 HydrophobicContact CB-CD1 3.78Å; A66-I336 HydrophobicContact CB-CG2 4.11Å
67	F	90.3	Very high	86.2	Confident	1 Å²	1	56.5 Å²	56.5	0%	0.004	27%	0.268	C	S	.	.	H	α-helix	trans	-66.4	-44.1	173.1	-77.4	-78.3	0	0	0	112.2	I54 L56 T63 E64 G70 V71 I93 Y120 I336 L340	I54-F67 HydrophobicContact CD1-CB 3.96Å; I54-F67 HydrophobicContact CD1-CD1 3.44Å; I54-F67 VanDerWaalsContact CD1-CD1 3.44Å; I54-F67 HydrophobicContact CD1-CE1 4.12Å; I54-F67 HydrophobicContact CD1-CG 3.78Å; I54-F67 HydrophobicContact CG1-CD1 3.85Å; I54-F67 HydrophobicContact CG1-CE1 4Å; I54-F67 HydrophobicContact CG1-CG 4.42Å; I54-F67 HydrophobicContact CG2-CD1 4.21Å; I54-F67 HydrophobicContact CG2-CD2 4.06Å; I54-F67 HydrophobicContact CG2-CE1 4.08Å; I54-F67 HydrophobicContact CG2-CE2 3.95Å; I54-F67 HydrophobicContact CG2-CG 4.21Å; I54-F67 HydrophobicContact CG2-CZ 3.95Å; L56-F67 HydrophobicContact CD1-CD2 4.45Å; L56-F67 HydrophobicContact CD2-CD2 4.37Å; L56-F67 HydrophobicContact CD2-CE2 3.71Å; L56-F67 HydrophobicContact CD2-CZ 4.41Å; T63-F67 WeakPolarHBondContact O-CD2 3.25Å; T63-F67 PolarHBondContact O-N 2.98Å; T63-F67 VanDerWaalsContact O-N 3.16Å; E64-F67 PolarHBondContact O-N 3.38Å; F67-G70 PolarHBondContact O-N 2.91Å; F67-V71 WeakPolarHBondContact O-CB 3.31Å; F67-V71 VanDerWaalsContact O-CG2 3.28Å; F67-V71 WeakPolarHBondContact O-CG2 3.37Å; F67-V71 PolarHBondContact O-N 3.44Å; F67-I93 HydrophobicContact CB-CD1 4.33Å; F67-Y120 AromaticContact CE1-CD1 3.53Å; F67-Y120 HydrophobicContact CE1-CD1 3.53Å; F67-Y120 HydrophobicContact CE1-CD2 4.32Å; F67-Y120 AromaticContact CE1-CE1 3.99Å; F67-Y120 HydrophobicContact CE1-CE1 3.99Å; F67-Y120 AromaticContact CE1-CG 3.72Å; F67-Y120 HydrophobicContact CE1-CG 3.72Å; F67-Y120 HydrophobicContact CZ-CD1 4.01Å; F67-Y120 HydrophobicContact CZ-CG 4.29Å; F67-I336 HydrophobicContact CB-CG2 4.47Å; F67-I336 HydrophobicContact CD1-CG2 3.66Å; F67-I336 HydrophobicContact CD2-CD1 4.08Å; F67-I336 HydrophobicContact CD2-CG2 4.09Å; F67-I336 HydrophobicContact CE1-CG1 4.36Å; F67-I336 HydrophobicContact CE1-CG2 3.76Å; F67-I336 HydrophobicContact CE2-CD1 3.57Å; F67-I336 HydrophobicContact CE2-CG1 3.95Å; F67-I336 HydrophobicContact CE2-CG2 4.16Å; F67-I336 HydrophobicContact CG-CG2 3.83Å; F67-I336 HydrophobicContact CZ-CD1 3.99Å; F67-I336 HydrophobicContact CZ-CG1 3.83Å; F67-I336 HydrophobicContact CZ-CG2 4.01Å; F67-L340 HydrophobicContact CD1-CD1 4.12Å
68	E	89	Confident	86.1	Confident	106 Å²	106	56.5 Å²	56.5	50%	0.495	27%	0.268	S	S	.	.	H	α-helix	trans	-57.2	-51.8	176	-67.5	179.6	134.4	0	0	111.9	E64 G70 V71 Q72	E64-E68 PolarHBondContact O-N 2.94Å; E64-E68 VanDerWaalsContact O-N 3.1Å; E68-G70 PolarHBondContact O-N 3.33Å; E68-V71 PolarHBondContact O-N 2.8Å; E68-Q72 PolarHBondContact O-N 3.3Å
69	N	84.8	Confident	86	Confident	50 Å²	50	54.6 Å²	54.6	27%	0.267	26%	0.262	S	S	.	.	H	α-helix	trans	-64.5	-40.6	179.4	-73.9	-49.4	0	0	0	112.6	K65 Q72 A73 T314 F333	K65-N69 WeakPolarHBondContact O-CB 3.39Å; K65-N69 PolarHBondContact O-N 3.13Å; K65-N69 VanDerWaalsContact O-N 3.12Å; K65-N69 PolarHBondContact O-ND2 3.19Å; N69-Q72 PolarHBondContact O-N 3.48Å; N69-A73 PolarHBondContact O-N 3.28Å; N69-A73 VanDerWaalsContact O-N 3.12Å; N69-T314 WeakPolarHBondContact OD1-CG2 3.3Å; N69-F333 HydrophobicContact CB-CE2 3.97Å; N69-F333 HydrophobicContact CB-CZ 4.28Å
70	G	87.3	Confident	86.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.3	-36.3	176.1	0	0	0	0	0	112.9	A66 F67 E68 A73 A74	A66-G70 PolarHBondContact O-N 3.2Å; F67-G70 PolarHBondContact O-N 2.91Å; E68-G70 PolarHBondContact O-N 3.33Å; G70-A73 PolarHBondContact O-N 2.91Å; G70-A74 VanDerWaalsContact O-CB 3.29Å; G70-A74 WeakPolarHBondContact O-CB 3.22Å; G70-A74 PolarHBondContact O-N 3.44Å
71	V	90.9	Very high	86.1	Confident	6 Å²	6	55.3 Å²	55.3	4%	0.036	27%	0.266	C	S	.	.	H	α-helix	trans	-68.9	-37.5	174.2	169.4	0	0	0	0	111.3	I52 F67 E68 A74 N75 L89 P91 L340	I52-V71 HydrophobicContact CD1-CG2 3.63Å; F67-V71 WeakPolarHBondContact O-CB 3.31Å; F67-V71 VanDerWaalsContact O-CG2 3.28Å; F67-V71 WeakPolarHBondContact O-CG2 3.37Å; F67-V71 PolarHBondContact O-N 3.44Å; E68-V71 PolarHBondContact O-N 2.8Å; V71-A74 PolarHBondContact O-N 2.87Å; V71-N75 WeakPolarHBondContact O-CB 3.45Å; V71-N75 PolarHBondContact O-N 2.83Å; V71-N75 PolarHBondContact O-ND2 3.07Å; V71-L89 HydrophobicContact CG1-CB 4.02Å; V71-L89 VanDerWaalsContact CG1-O 3.28Å; V71-L89 WeakPolarHBondContact CG1-O 3.39Å; V71-P91 HydrophobicContact CG2-CB 4.34Å; V71-P91 HydrophobicContact CG2-CG 4.48Å; V71-L340 HydrophobicContact CG2-CD1 4.2Å; V71-L340 HydrophobicContact CG2-CD2 4.03Å
72	Q	88.8	Confident	85.9	Confident	96 Å²	96	51.8 Å²	51.8	45%	0.449	28%	0.277	S	S	.	.	H	α-helix	trans	-59.1	-50.1	172.7	-172.1	-171.9	-45.6	0	0	111.1	E68 N69 A74 N75 E76	E68-Q72 PolarHBondContact O-N 3.3Å; N69-Q72 PolarHBondContact O-N 3.48Å; Q72-A74 PolarHBondContact O-N 3.46Å; Q72-N75 WeakPolarHBondContact O-CB 3.22Å; Q72-N75 PolarHBondContact O-N 3.47Å; Q72-N75 VanDerWaalsContact O-N 3.1Å; Q72-E76 PolarHBondContact NE2-OE1 3.3Å; Q72-E76 PolarHBondContact O-N 2.91Å
73	A	86	Confident	86	Confident	6 Å²	6	46 Å²	46	5%	0.05	26%	0.255	C	S	.	.	H	α-helix	trans	-65.4	-37.2	179.5	0	0	0	0	0	112.7	N69 G70 N75 E76 V77 Y337 I341	N69-A73 PolarHBondContact O-N 3.28Å; N69-A73 VanDerWaalsContact O-N 3.12Å; G70-A73 PolarHBondContact O-N 2.91Å; A73-N75 VanDerWaalsContact C-N 3.3Å; A73-N75 PolarHBondContact O-N 2.91Å; A73-E76 WeakPolarHBondContact O-CB 3.47Å; A73-E76 PolarHBondContact O-N 3.48Å; A73-V77 PolarHBondContact O-N 3.39Å; A73-V77 VanDerWaalsContact O-N 3.07Å; A73-Y337 HydrophobicContact CB-CD2 4.29Å; A73-Y337 HydrophobicContact CB-CE2 3.4Å; A73-Y337 VanDerWaalsContact CB-CE2 3.4Å; A73-I341 HydrophobicContact CB-CD1 3.83Å
74	A	88.7	Confident	86	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.9	-36.6	171.6	0	0	0	0	0	112.3	G70 V71 Q72 V77 L78 L89 L340 A344	G70-A74 VanDerWaalsContact O-CB 3.29Å; G70-A74 WeakPolarHBondContact O-CB 3.22Å; G70-A74 PolarHBondContact O-N 3.44Å; V71-A74 PolarHBondContact O-N 2.87Å; Q72-A74 PolarHBondContact O-N 3.46Å; A74-V77 PolarHBondContact O-N 2.89Å; A74-L78 WeakPolarHBondContact O-CG 3.49Å; A74-L78 PolarHBondContact O-N 2.85Å; A74-L89 HydrophobicContact CB-CD1 3.8Å; A74-L340 HydrophobicContact CB-CB 4.16Å; A74-L340 WeakPolarHBondContact CB-O 3.48Å; A74-A344 HydrophobicContact CB-CB 4.09Å
75	N	91.2	Very high	85.8	Confident	36 Å²	36	44.9 Å²	44.9	19%	0.193	25%	0.254	C	S	.	.	H	α-helix	trans	-69.3	-33.9	174.2	-80.4	-35.6	0	0	0	113.2	V71 Q72 A73 L78 S79 Q88 L89	V71-N75 WeakPolarHBondContact O-CB 3.45Å; V71-N75 PolarHBondContact O-N 2.83Å; V71-N75 PolarHBondContact O-ND2 3.07Å; Q72-N75 WeakPolarHBondContact O-CB 3.22Å; Q72-N75 PolarHBondContact O-N 3.47Å; Q72-N75 VanDerWaalsContact O-N 3.1Å; A73-N75 VanDerWaalsContact C-N 3.3Å; A73-N75 PolarHBondContact O-N 2.91Å; N75-L78 PolarHBondContact O-N 3.03Å; N75-S79 WeakPolarHBondContact O-CB 3.24Å; N75-S79 PolarHBondContact O-N 3.24Å; N75-Q88 WeakPolarHBondContact OD1-CA 3.34Å; N75-L89 PolarHBondContact ND2-O 3.4Å; N75-L89 PolarHBondContact OD1-N 3.26Å
76	E	86.9	Confident	85.9	Confident	73 Å²	73	42.7 Å²	42.7	34%	0.341	25%	0.253	S	S	.	.	H	α-helix	trans	-63.5	-43	171.3	-69.4	172.4	-157.1	0	0	110.7	Q72 A73 S79 L310	Q72-E76 PolarHBondContact NE2-OE1 3.3Å; Q72-E76 PolarHBondContact O-N 2.91Å; A73-E76 WeakPolarHBondContact O-CB 3.47Å; A73-E76 PolarHBondContact O-N 3.48Å; E76-S79 PolarHBondContact O-N 3.33Å; E76-S79 PolarHBondContact O-OG 2.92Å; E76-L310 WeakPolarHBondContact OE2-CD2 3.24Å
77	V	85.6	Confident	85.9	Confident	29 Å²	29	45.8 Å²	45.8	18%	0.176	26%	0.264	C	S	.	.	H	α-helix	trans	-62.3	-46.5	172.5	169.7	0	0	0	0	112.3	A73 A74 S79 Q80 I341 A344 H345	A73-V77 PolarHBondContact O-N 3.39Å; A73-V77 VanDerWaalsContact O-N 3.07Å; A74-V77 PolarHBondContact O-N 2.89Å; V77-S79 VanDerWaalsContact C-N 3.26Å; V77-S79 PolarHBondContact O-N 3.19Å; V77-Q80 PolarHBondContact O-N 3.36Å; V77-I341 HydrophobicContact CG2-CD1 4.04Å; V77-I341 HydrophobicContact CG2-CG2 4.42Å; V77-A344 HydrophobicContact CB-CB 4.16Å; V77-A344 HydrophobicContact CG1-CB 3.82Å; V77-H345 VanDerWaalsContact CG1-CD2 3.49Å; V77-H345 WeakPolarHBondContact CG1-CD2 3.43Å; V77-H345 WeakPolarHBondContact CG1-NE2 3.38Å
78	L	87.8	Confident	85.9	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.4	-32.9	177.7	-70.5	-173.2	0	0	0	112.4	A74 N75 Q80 S81 L84 L89 A344 L347	A74-L78 WeakPolarHBondContact O-CG 3.49Å; A74-L78 PolarHBondContact O-N 2.85Å; N75-L78 PolarHBondContact O-N 3.03Å; L78-Q80 PolarHBondContact O-N 2.79Å; L78-S81 WeakPolarHBondContact O-CB 3.45Å; L78-S81 PolarHBondContact O-N 3.45Å; L78-L84 HydrophobicContact CD2-CB 4.25Å; L78-L84 HydrophobicContact CD2-CD1 3.7Å; L78-L84 CarbonylContact O-C 3.48Å; L78-L89 HydrophobicContact CD1-CD1 3.68Å; L78-L89 HydrophobicContact CD1-CG 3.67Å; L78-L89 HydrophobicContact CG-CD1 4.5Å; L78-A344 HydrophobicContact CD2-CB 3.96Å; L78-A344 HydrophobicContact CG-CB 4.07Å; L78-L347 HydrophobicContact CD1-CD2 4.24Å; L78-L347 HydrophobicContact CD2-CD2 4.33Å
79	S	85.9	Confident	86	Confident	55 Å²	55	44.1 Å²	44.1	39%	0.385	26%	0.256	S	S	.	.	H	α-helix	trans	-61.3	-27.9	176.8	81.3	0	0	0	0	113.6	N75 E76 V77 S81	N75-S79 WeakPolarHBondContact O-CB 3.24Å; N75-S79 PolarHBondContact O-N 3.24Å; E76-S79 PolarHBondContact O-N 3.33Å; E76-S79 PolarHBondContact O-OG 2.92Å; V77-S79 VanDerWaalsContact C-N 3.26Å; V77-S79 PolarHBondContact O-N 3.19Å; S79-S81 VanDerWaalsContact C-N 3.35Å
80	Q	83.3	Confident	86.4	Confident	163 Å²	163	45.3 Å²	45.3	76%	0.762	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-10.6	177.5	-60.1	172.4	30.8	0	0	113	V77 L78	V77-Q80 PolarHBondContact O-N 3.36Å; L78-Q80 PolarHBondContact O-N 2.79Å
81	S	81.3	Confident	86.7	Confident	8 Å²	8	47.2 Å²	47.2	6%	0.056	27%	0.272	C	S	.	.			trans	-86.9	120.4	179.8	-174.2	0	0	0	0	111.7	L78 S79 T83 L84 S85 S348	L78-S81 WeakPolarHBondContact O-CB 3.45Å; L78-S81 PolarHBondContact O-N 3.45Å; S79-S81 VanDerWaalsContact C-N 3.35Å; S81-T83 PolarHBondContact O-N 3.34Å; S81-T83 PolarHBondContact OG-OG1 3.29Å; S81-L84 PolarHBondContact O-N 3.48Å; S81-S85 PolarHBondContact O-N 3.33Å; S81-S348 WeakPolarHBondContact CB-OG 3.47Å; S81-S348 PolarHBondContact OG-OG 3.39Å
82	G	77.2	Confident	86.9	Confident	80 Å²	80	47.5 Å²	47.5	83%	0.825	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-14.6	178.7	0	0	0	0	0	115.5
83	T	80.4	Confident	87.1	Confident	61 Å²	61	44.3 Å²	44.3	37%	0.374	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-13.9	173.6	53.1	0	0	0	0	114.1	S81 T351	S81-T83 PolarHBondContact O-N 3.34Å; S81-T83 PolarHBondContact OG-OG1 3.29Å; T83-T351 PolarHBondContact OG1-OG1 2.92Å
84	L	84	Confident	87.4	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.3	3.9	-169.8	-71.9	173.9	0	0	0	114.9	L78 S81 S86 Y87 L347 T351 L356	L78-L84 HydrophobicContact CD2-CB 4.25Å; L78-L84 HydrophobicContact CD2-CD1 3.7Å; L78-L84 CarbonylContact O-C 3.48Å; S81-L84 PolarHBondContact O-N 3.48Å; L84-S86 PolarHBondContact O-N 3.39Å; L84-S86 VanDerWaalsContact O-N 3.13Å; L84-Y87 HydrophobicContact CD2-CD2 3.67Å; L84-Y87 HydrophobicContact CD2-CE2 4.12Å; L84-Y87 HydrophobicContact CD2-CG 4.03Å; L84-Y87 PolarHBondContact O-N 2.83Å; L84-L347 HydrophobicContact CD1-CB 4.32Å; L84-L347 HydrophobicContact CD1-CD2 3.97Å; L84-L347 HydrophobicContact CD1-CG 3.76Å; L84-T351 HydrophobicContact CD1-CG2 4.04Å; L84-T351 WeakPolarHBondContact CD1-OG1 3.06Å; L84-T351 HydrophobicContact CD2-CG2 4.15Å; L84-T351 HydrophobicContact CG-CG2 4.31Å; L84-L356 HydrophobicContact CD2-CD2 4.32Å
85	S	83.4	Confident	87.6	Confident	55 Å²	55	49.8 Å²	49.8	39%	0.385	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-32.7	178.9	58.6	0	0	0	0	114	K47 S81 Y87	K47-S85 WeakPolarHBondContact CE-O 3.42Å; K47-S85 PolarHBondContact NZ-O 3.13Å; S81-S85 PolarHBondContact O-N 3.33Å; S85-Y87 VanDerWaalsContact C-N 3.31Å; S85-Y87 PolarHBondContact O-N 3.26Å
86	S	84.6	Confident	87.7	Confident	65 Å²	65	48 Å²	48	46%	0.455	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	1	176.7	57.3	0	0	0	0	115	K47 S48 L84	K47-S86 CarbonylContact C-O 3.55Å; K47-S86 VanDerWaalsContact CA-O 3.24Å; K47-S86 WeakPolarHBondContact CA-O 3.36Å; K47-S86 WeakPolarHBondContact CB-O 3.31Å; S48-S86 PolarHBondContact N-O 3.44Å; L84-S86 PolarHBondContact O-N 3.39Å; L84-S86 VanDerWaalsContact O-N 3.13Å
87	Y	86.7	Confident	87.9	Confident	71 Å²	71	47.3 Å²	47.3	28%	0.278	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	160.6	-179.8	-67.7	-97.9	0	0	0	112.5	S48 I50 L84 S85	S48-Y87 CarbonylContact O-C 3.56Å; S48-Y87 WeakPolarHBondContact O-CA 3.37Å; I50-Y87 HydrophobicContact CD1-CD1 3.7Å; I50-Y87 HydrophobicContact CD1-CG 3.92Å; I50-Y87 HydrophobicContact CG1-CD1 3.73Å; I50-Y87 HydrophobicContact CG1-CG 4.39Å; L84-Y87 HydrophobicContact CD2-CD2 3.67Å; L84-Y87 HydrophobicContact CD2-CE2 4.12Å; L84-Y87 HydrophobicContact CD2-CG 4.03Å; L84-Y87 PolarHBondContact O-N 2.83Å; S85-Y87 VanDerWaalsContact C-N 3.31Å; S85-Y87 PolarHBondContact O-N 3.26Å
88	Q	90.2	Very high	87.9	Confident	69 Å²	69	49.3 Å²	49.3	32%	0.322	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	139	169.7	67	-175.9	36.5	0	0	111.1	K47 S48 V49 I50 N75	K47-Q88 HydrophobicContact CB-CB 4.29Å; K47-Q88 HydrophobicContact CB-CG 4.1Å; K47-Q88 HydrophobicContact CD-CB 4.31Å; S48-Q88 PolarHBondContact O-N 2.93Å; V49-Q88 CarbonylContact C-O 3.58Å; V49-Q88 WeakPolarHBondContact CA-O 3.42Å; V49-Q88 HydrophobicContact CG2-CG 4.16Å; I50-Q88 PolarHBondContact N-O 3.21Å; N75-Q88 WeakPolarHBondContact OD1-CA 3.34Å
89	L	91.6	Very high	87.8	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.016	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	138.4	166.2	-68	164	0	0	0	110	I50 I52 V71 A74 N75 L78 I117	I50-L89 HydrophobicContact CB-CD2 4.11Å; I50-L89 HydrophobicContact CG2-CD2 3.93Å; I50-L89 CarbonylContact O-C 2.99Å; I50-L89 VanDerWaalsContact O-CA 3.29Å; I50-L89 WeakPolarHBondContact O-CA 3.38Å; I52-L89 HydrophobicContact CG2-CD2 3.95Å; V71-L89 HydrophobicContact CG1-CB 4.02Å; V71-L89 VanDerWaalsContact CG1-O 3.28Å; V71-L89 WeakPolarHBondContact CG1-O 3.39Å; A74-L89 HydrophobicContact CB-CD1 3.8Å; N75-L89 PolarHBondContact ND2-O 3.4Å; N75-L89 PolarHBondContact OD1-N 3.26Å; L78-L89 HydrophobicContact CD1-CD1 3.68Å; L78-L89 HydrophobicContact CD1-CG 3.67Å; L78-L89 HydrophobicContact CG-CD1 4.5Å; L89-I117 HydrophobicContact CD2-CD1 3.92Å
90	E	92.6	Very high	88.1	Confident	75 Å²	75	56.2 Å²	56.2	35%	0.35	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	130.7	175.9	-169.4	178.4	125.8	0	0	110.3	V49 I50 Y51 I52	V49-E90 HydrophobicContact CG1-CB 3.54Å; V49-E90 HydrophobicContact CG1-CG 4.37Å; V49-E90 WeakPolarHBondContact CG1-OE2 3.45Å; I50-E90 PolarHBondContact O-N 3.31Å; Y51-E90 WeakPolarHBondContact CA-O 3.33Å; Y51-E90 HydrophobicContact CD1-CB 4.1Å; Y51-E90 HydrophobicContact CE1-CB 4.15Å; Y51-E90 HydrophobicContact CE1-CG 4.27Å; Y51-E90 WeakPolarHBondContact CE1-OE1 3.2Å; I52-E90 PolarHBondContact N-O 2.81Å; I52-E90 VanDerWaalsContact N-O 3.07Å
91	P	93.7	Very high	88.5	Confident	40 Å²	40	51.1 Å²	51.1	26%	0.26	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	131.3	-175.7	32.6	-30.8	0	0	0	112.1	I52 I54 V71 I93	I52-P91 HydrophobicContact CG1-CB 4.32Å; I54-P91 HydrophobicContact CD1-CB 3.59Å; V71-P91 HydrophobicContact CG2-CB 4.34Å; V71-P91 HydrophobicContact CG2-CG 4.48Å; P91-I93 HydrophobicContact CB-CD1 4.46Å; P91-I93 HydrophobicContact CB-CG1 4.12Å
92	I	94.2	Very high	89.1	Confident	12 Å²	12	57.5 Å²	57.5	6%	0.062	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	91	166.5	-54.3	165.3	0	0	0	107.6	Y51 I52 I54 I111 R114 I116	Y51-I92 HydrophobicContact CD1-CD1 3.73Å; Y51-I92 HydrophobicContact CD1-CG1 3.83Å; Y51-I92 HydrophobicContact CG-CD1 3.71Å; Y51-I92 HydrophobicContact CG-CG1 4.3Å; I52-I92 PolarHBondContact O-N 2.9Å; I54-I92 PolarHBondContact N-O 2.97Å; I92-I111 HydrophobicContact CB-CG2 4.15Å; I92-I111 HydrophobicContact CD1-CG2 4.09Å; I92-I111 HydrophobicContact CG2-CG1 4.05Å; I92-I111 HydrophobicContact CG2-CG2 4.1Å; I92-R114 HydrophobicContact CD1-CB 3.99Å; I92-R114 HydrophobicContact CD1-CG 4.42Å; I92-I116 HydrophobicContact CD1-CG2 3.96Å
93	I	93	Very high	89.8	Confident	28 Å²	28	55.5 Å²	55.5	14%	0.144	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	135.7	178.2	-52.7	-179.9	0	0	0	109.4	I54 L56 E64 F67 P91 F95	I54-I93 HydrophobicContact CB-CG1 4.2Å; I54-I93 HydrophobicContact CD1-CG1 3.93Å; I54-I93 HydrophobicContact CG2-CG1 4.41Å; I54-I93 HydrophobicContact CG2-CG2 4.47Å; I54-I93 CarbonylContact O-C 3.58Å; I54-I93 WeakPolarHBondContact O-CA 3.21Å; L56-I93 HydrophobicContact CD1-CG2 3.83Å; L56-I93 HydrophobicContact CG-CG2 4.31Å; E64-I93 HydrophobicContact CG-CD1 3.94Å; F67-I93 HydrophobicContact CB-CD1 4.33Å; P91-I93 HydrophobicContact CB-CD1 4.46Å; P91-I93 HydrophobicContact CB-CG1 4.12Å; I93-F95 HydrophobicContact CG2-CE1 4.37Å; I93-F95 HydrophobicContact CG2-CE2 4.06Å; I93-F95 HydrophobicContact CG2-CZ 3.85Å
94	Q	93.5	Very high	90.4	Very high	67 Å²	67	52.6 Å²	52.6	31%	0.313	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	136.5	169.8	-67.9	-67.3	-83.1	0	0	110.2	I54 I55 L56 Q107 I111	I54-Q94 PolarHBondContact O-N 3.03Å; I55-Q94 WeakPolarHBondContact CA-O 3.48Å; L56-Q94 PolarHBondContact N-O 3.19Å; Q94-Q107 HydrophobicContact CB-CB 4.4Å; Q94-I111 HydrophobicContact CB-CD1 4.26Å; Q94-I111 HydrophobicContact CG-CD1 3.77Å; Q94-I111 HydrophobicContact CG-CG1 4.07Å
95	F	92.7	Very high	90.8	Very high	54 Å²	54	54.4 Å²	54.4	24%	0.237	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	141.5	175.4	-61.6	-75.9	0	0	0	110.9	L56 R61 E64 I93	L56-F95 HydrophobicContact CB-CD1 3.87Å; L56-F95 HydrophobicContact CB-CE1 3.88Å; L56-F95 HydrophobicContact CD1-CE1 3.73Å; L56-F95 HydrophobicContact CD1-CZ 4.26Å; L56-F95 HydrophobicContact CG-CE1 4.37Å; L56-F95 WeakPolarHBondContact O-CA 3.19Å; R61-F95 HydrophobicContact CB-CE1 4.14Å; R61-F95 HydrophobicContact CG-CE1 3.88Å; R61-F95 HydrophobicContact CG-CZ 4Å; E64-F95 HydrophobicContact CB-CZ 4.27Å; E64-F95 HydrophobicContact CG-CZ 4.28Å; E64-F95 WeakPolarHBondContact OE1-CE2 3Å; E64-F95 WeakPolarHBondContact OE1-CZ 3.49Å; I93-F95 HydrophobicContact CG2-CE1 4.37Å; I93-F95 HydrophobicContact CG2-CE2 4.06Å; I93-F95 HydrophobicContact CG2-CZ 3.85Å
96	V	92.8	Very high	91.2	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	150.3	-178.3	-59.3	0	0	0	0	112.7	I55 L56 T57 D58 K98 V103 A104 Q107 L127	I55-V96 HydrophobicContact CG2-CG1 4.1Å; I55-V96 HydrophobicContact CG2-CG2 3.61Å; L56-V96 PolarHBondContact O-N 2.03Å; T57-V96 VanDerWaalsContact CA-O 3.26Å; T57-V96 WeakPolarHBondContact CA-O 2.98Å; D58-V96 PolarHBondContact N-O 2.99Å; D58-V96 VanDerWaalsContact OD2-C 3.25Å; V96-K98 PolarHBondContact O-N 3.33Å; V96-V103 HydrophobicContact CB-CG1 4.24Å; V96-V103 HydrophobicContact CG1-CG1 3.98Å; V96-A104 HydrophobicContact CG2-CB 4.12Å; V96-Q107 HydrophobicContact CG1-CB 4.31Å; V96-Q107 HydrophobicContact CG1-CG 3.84Å; V96-L127 HydrophobicContact CG2-CD1 3.8Å
97	P	92.4	Very high	91.7	Very high	58 Å²	58	54.2 Å²	54.2	38%	0.377	27%	0.272	S	S	.	.			trans	-64.8	133.1	174.4	-22.1	33.5	0	0	0	111.7	D58 D99 N100	D58-P97 VanDerWaalsContact OD2-CA 3.32Å; D58-P97 WeakPolarHBondContact OD2-CA 3.48Å; P97-D99 PolarHBondContact O-N 3.1Å; P97-N100 HydrophobicContact CB-CB 3.94Å; P97-N100 HydrophobicContact CG-CB 4.34Å; P97-N100 PolarHBondContact O-N 3.13Å
98	K	85	Confident	91.9	Very high	71 Å²	71	50.9 Å²	50.9	31%	0.309	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-30.8	-171.8	-179.4	166.5	169	178.9	0	116.7	T57 E59 V96 S124 L127	T57-K98 HydrophobicContact CG2-CB 4.11Å; T57-K98 HydrophobicContact CG2-CG 4.28Å; E59-K98 VanDerWaalsContact CD-CD 3.5Å; E59-K98 HydrophobicContact CG-CD 4.5Å; E59-K98 WeakPolarHBondContact OE1-CD 3.45Å; E59-K98 IonicContact OE1-NZ 2.64Å; E59-K98 PolarHBondContact OE1-NZ 2.96Å; E59-K98 IonicContact OE2-NZ 2.72Å; E59-K98 PolarHBondContact OE2-NZ 2.95Å; V96-K98 PolarHBondContact O-N 3.33Å; K98-S124 WeakPolarHBondContact O-CB 3.29Å; K98-S124 PolarHBondContact O-OG 3.37Å; K98-L127 WeakPolarHBondContact O-CD1 3.5Å; K98-L127 VanDerWaalsContact O-CG 3.26Å; K98-L127 WeakPolarHBondContact O-CG 3.47Å
99	D	85.6	Confident	92.1	Very high	136 Å²	136	48.9 Å²	48.9	73%	0.727	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-6.4	-178.9	-54.6	-56.8	0	0	0	113.3	P97 V101	P97-D99 PolarHBondContact O-N 3.1Å; D99-V101 PolarHBondContact O-N 3.35Å; D99-V101 VanDerWaalsContact O-N 3.13Å
100	N	91.6	Very high	92.1	Very high	64 Å²	64	53.4 Å²	53.4	34%	0.342	27%	0.272	S	S	.	.			trans	-91.7	77.5	-172.1	-162.5	-30.5	0	0	0	112.6	P97 F102 V103 A104	P97-N100 HydrophobicContact CB-CB 3.94Å; P97-N100 HydrophobicContact CG-CB 4.34Å; P97-N100 PolarHBondContact O-N 3.13Å; N100-F102 PolarHBondContact O-N 3.17Å; N100-F102 PolarHBondContact OD1-N 2.99Å; N100-V103 HydrophobicContact CB-CB 4.22Å; N100-V103 HydrophobicContact CB-CG2 4.45Å; N100-V103 WeakPolarHBondContact ND2-CG2 3.48Å; N100-V103 PolarHBondContact O-N 3.18Å; N100-V103 VanDerWaalsContact O-N 3.16Å; N100-V103 WeakPolarHBondContact OD1-CG2 3.32Å; N100-V103 PolarHBondContact OD1-N 3.03Å; N100-A104 PolarHBondContact O-N 3.17Å
101	V	92.2	Very high	92.1	Very high	55 Å²	55	50 Å²	50	33%	0.333	26%	0.256	S	S	.	.	H	α-helix	trans	-52.9	-36.3	176.1	177.7	0	0	0	0	112.7	D99 T105 L127 A130	D99-V101 PolarHBondContact O-N 3.35Å; D99-V101 VanDerWaalsContact O-N 3.13Å; V101-T105 HydrophobicContact CG1-CG2 4.47Å; V101-T105 WeakPolarHBondContact O-CG2 3.38Å; V101-T105 PolarHBondContact O-N 3.18Å; V101-T105 PolarHBondContact O-OG1 3.28Å; V101-L127 HydrophobicContact CB-CD2 4.37Å; V101-L127 HydrophobicContact CG2-CD2 3.9Å; V101-A130 HydrophobicContact CG1-CB 3.5Å; V101-A130 VanDerWaalsContact CG1-CB 3.5Å
102	F	92.8	Very high	91.9	Very high	142 Å²	142	48.2 Å²	48.2	62%	0.623	24%	0.244	S	C	*	.	H	α-helix	trans	-66.3	-46.8	178.7	179.1	-98.8	0	0	0	111.9	N100 T105 Q106	N100-F102 PolarHBondContact O-N 3.17Å; N100-F102 PolarHBondContact OD1-N 2.99Å; F102-T105 PolarHBondContact O-N 3.06Å; F102-T105 PolarHBondContact O-OG1 3.04Å; F102-T105 VanDerWaalsContact O-OG1 3.06Å; F102-Q106 WeakPolarHBondContact O-CB 3.46Å; F102-Q106 PolarHBondContact O-N 3.36Å
103	V	93	Very high	91.7	Very high	38 Å²	38	51 Å²	51	23%	0.23	26%	0.259	C	S	.	.	H	α-helix	trans	-65.2	-41.6	176	171.4	0	0	0	0	111	V96 N100 T105 Q106 Q107	V96-V103 HydrophobicContact CB-CG1 4.24Å; V96-V103 HydrophobicContact CG1-CG1 3.98Å; N100-V103 HydrophobicContact CB-CB 4.22Å; N100-V103 HydrophobicContact CB-CG2 4.45Å; N100-V103 WeakPolarHBondContact ND2-CG2 3.48Å; N100-V103 PolarHBondContact O-N 3.18Å; N100-V103 VanDerWaalsContact O-N 3.16Å; N100-V103 WeakPolarHBondContact OD1-CG2 3.32Å; N100-V103 PolarHBondContact OD1-N 3.03Å; V103-T105 PolarHBondContact O-N 2.75Å; V103-Q106 PolarHBondContact O-N 2.84Å; V103-Q107 HydrophobicContact CG1-CG 4.19Å; V103-Q107 VanDerWaalsContact O-CG 3.3Å; V103-Q107 WeakPolarHBondContact O-CG 3.28Å; V103-Q107 PolarHBondContact O-N 2.9Å
104	A	92.5	Very high	91.5	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.6	-50	175.8	0	0	0	0	0	112.6	V96 N100 Q107 A108 L127	V96-A104 HydrophobicContact CG2-CB 4.12Å; N100-A104 PolarHBondContact O-N 3.17Å; A104-Q107 PolarHBondContact O-N 2.98Å; A104-A108 WeakPolarHBondContact O-CB 3.45Å; A104-A108 PolarHBondContact O-N 2.8Å; A104-L127 HydrophobicContact CB-CB 4.42Å; A104-L127 HydrophobicContact CB-CD1 4.4Å; A104-L127 HydrophobicContact CB-CD2 3.9Å; A104-L127 HydrophobicContact CB-CG 4.47Å
105	T	92.4	Very high	91.2	Very high	39 Å²	39	53.6 Å²	53.6	24%	0.239	27%	0.265	C	S	.	.	H	α-helix	trans	-66.5	-37.6	177	53.3	0	0	0	0	112.7	V101 F102 V103 A108 C109 A130	V101-T105 HydrophobicContact CG1-CG2 4.47Å; V101-T105 WeakPolarHBondContact O-CG2 3.38Å; V101-T105 PolarHBondContact O-N 3.18Å; V101-T105 PolarHBondContact O-OG1 3.28Å; F102-T105 PolarHBondContact O-N 3.06Å; F102-T105 PolarHBondContact O-OG1 3.04Å; F102-T105 VanDerWaalsContact O-OG1 3.06Å; V103-T105 PolarHBondContact O-N 2.75Å; T105-A108 PolarHBondContact O-N 3.03Å; T105-C109 PolarHBondContact O-N 3.3Å; T105-C109 PolarHBondContact O-SG 2.9Å; T105-A130 HydrophobicContact CG2-CB 3.93Å
106	Q	93.3	Very high	91.2	Very high	85 Å²	85	51 Å²	51	40%	0.397	25%	0.254	S	S	.	.	H	α-helix	trans	-64	-42.8	175.8	-164.4	-158.6	70.5	0	0	112.3	F102 V103 C109 K110	F102-Q106 WeakPolarHBondContact O-CB 3.46Å; F102-Q106 PolarHBondContact O-N 3.36Å; V103-Q106 PolarHBondContact O-N 2.84Å; Q106-C109 PolarHBondContact O-N 2.9Å; Q106-K110 PolarHBondContact O-N 3.07Å
107	Q	93.4	Very high	91.2	Very high	32 Å²	32	51 Å²	51	15%	0.15	25%	0.254	C	S	.	.	H	α-helix	trans	-66.2	-42.2	175.8	-63.5	-69.1	48.5	0	0	110.8	Q94 V96 V103 A104 C109 K110 I111	Q94-Q107 HydrophobicContact CB-CB 4.4Å; V96-Q107 HydrophobicContact CG1-CB 4.31Å; V96-Q107 HydrophobicContact CG1-CG 3.84Å; V103-Q107 HydrophobicContact CG1-CG 4.19Å; V103-Q107 VanDerWaalsContact O-CG 3.3Å; V103-Q107 WeakPolarHBondContact O-CG 3.28Å; V103-Q107 PolarHBondContact O-N 2.9Å; A104-Q107 PolarHBondContact O-N 2.98Å; Q107-C109 VanDerWaalsContact C-N 3.29Å; Q107-C109 PolarHBondContact O-N 2.98Å; Q107-K110 PolarHBondContact O-N 2.93Å; Q107-K110 VanDerWaalsContact O-N 3.09Å; Q107-I111 WeakPolarHBondContact O-CG1 3.41Å; Q107-I111 PolarHBondContact O-N 3.4Å
108	A	92.6	Very high	91.3	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-55.7	-42.1	175.1	0	0	0	0	0	112.8	I55 A104 T105 K110 I111 L112 L131 L134	I55-A108 HydrophobicContact CD1-CB 3.6Å; A104-A108 WeakPolarHBondContact O-CB 3.45Å; A104-A108 PolarHBondContact O-N 2.8Å; T105-A108 PolarHBondContact O-N 3.03Å; A108-K110 PolarHBondContact O-N 2.9Å; A108-I111 PolarHBondContact O-N 2.84Å; A108-L112 VanDerWaalsContact O-CG 3.32Å; A108-L112 WeakPolarHBondContact O-CG 3.04Å; A108-L112 PolarHBondContact O-N 3.47Å; A108-L131 HydrophobicContact CB-CD2 3.5Å; A108-L131 VanDerWaalsContact CB-CD2 3.5Å; A108-L134 HydrophobicContact CB-CD2 3.54Å
109	C	92.3	Very high	91.7	Very high	26 Å²	26	45 Å²	45	18%	0.176	22%	0.222	C	C	.	.	H	α-helix	trans	-58.9	-45.8	174.5	-66	0	0	0	0	112.8	T105 Q106 Q107 I111 L112 D113 C363	T105-C109 PolarHBondContact O-N 3.3Å; T105-C109 PolarHBondContact O-SG 2.9Å; Q106-C109 PolarHBondContact O-N 2.9Å; Q107-C109 VanDerWaalsContact C-N 3.29Å; Q107-C109 PolarHBondContact O-N 2.98Å; C109-I111 VanDerWaalsContact C-N 3.26Å; C109-I111 PolarHBondContact O-N 3.44Å; C109-L112 WeakPolarHBondContact O-CB 3.42Å; C109-L112 PolarHBondContact O-N 2.97Å; C109-D113 PolarHBondContact O-N 2.72Å; C109-C363 WeakPolarHBondContact CA-SG 3.46Å; C109-C363 HydrophobicContact CB-CB 3.77Å; C109-C363 WeakPolarHBondContact CB-SG 3.47Å; C109-C363 WeakPolarHBondContact SG-CB 3.46Å; C109-C363 CovalentContact SG-SG 2.03Å; C109-C363 PolarHBondContact SG-SG 2.95Å
110	K	92.2	Very high	92.1	Very high	98 Å²	98	38.6 Å²	38.6	43%	0.426	19%	0.188	S	C	.	.	H	α-helix	trans	-64.2	-29.2	176.8	-61.6	171	-159.1	160.2	0	113.2	Q106 Q107 A108	Q106-K110 PolarHBondContact O-N 3.07Å; Q107-K110 PolarHBondContact O-N 2.93Å; Q107-K110 VanDerWaalsContact O-N 3.09Å; A108-K110 PolarHBondContact O-N 2.9Å
111	I	92.4	Very high	92	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-76.2	-40.6	174.8	-56.8	165.9	0	0	0	110.3	I55 I92 Q94 Q107 A108 C109 D113 R114 I116	I55-I111 HydrophobicContact CD1-CD1 4.14Å; I55-I111 HydrophobicContact CG1-CD1 3.85Å; I92-I111 HydrophobicContact CB-CG2 4.15Å; I92-I111 HydrophobicContact CD1-CG2 4.09Å; I92-I111 HydrophobicContact CG2-CG1 4.05Å; I92-I111 HydrophobicContact CG2-CG2 4.1Å; Q94-I111 HydrophobicContact CB-CD1 4.26Å; Q94-I111 HydrophobicContact CG-CD1 3.77Å; Q94-I111 HydrophobicContact CG-CG1 4.07Å; Q107-I111 WeakPolarHBondContact O-CG1 3.41Å; Q107-I111 PolarHBondContact O-N 3.4Å; A108-I111 PolarHBondContact O-N 2.84Å; C109-I111 VanDerWaalsContact C-N 3.26Å; C109-I111 PolarHBondContact O-N 3.44Å; I111-D113 VanDerWaalsContact C-N 3.29Å; I111-D113 PolarHBondContact O-N 2.78Å; I111-R114 WeakPolarHBondContact O-CB 3.48Å; I111-R114 PolarHBondContact O-N 2.69Å; I111-I116 HydrophobicContact CG2-CD1 3.9Å; I111-I116 HydrophobicContact CG2-CG1 4.41Å; I111-I116 HydrophobicContact CG2-CG2 3.54Å
112	L	90.8	Very high	91.9	Very high	3 Å²	3	33 Å²	33	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-58	-38.7	176.6	-74.8	167	0	0	0	112.5	A108 C109 R114 G115 I116 L134 F138 L140 L361	A108-L112 VanDerWaalsContact O-CG 3.32Å; A108-L112 WeakPolarHBondContact O-CG 3.04Å; A108-L112 PolarHBondContact O-N 3.47Å; C109-L112 WeakPolarHBondContact O-CB 3.42Å; C109-L112 PolarHBondContact O-N 2.97Å; L112-R114 PolarHBondContact O-N 3.45Å; L112-R114 VanDerWaalsContact O-N 3.13Å; L112-G115 PolarHBondContact O-N 3.18Å; L112-I116 HydrophobicContact CD2-CD1 4.11Å; L112-I116 HydrophobicContact CD2-CG1 4.17Å; L112-L134 HydrophobicContact CD1-CD2 3.99Å; L112-L134 HydrophobicContact CD1-CG 4.21Å; L112-F138 HydrophobicContact CD1-CD2 3.95Å; L112-F138 HydrophobicContact CD1-CE2 4.03Å; L112-L140 HydrophobicContact CD2-CD2 3.83Å; L112-L361 CarbonylContact C-O 3.51Å; L112-L361 HydrophobicContact CB-CB 4.17Å; L112-L361 VanDerWaalsContact CB-O 3.28Å; L112-L361 WeakPolarHBondContact CB-O 3.42Å; L112-L361 HydrophobicContact CD2-CB 4.19Å; L112-L361 HydrophobicContact CD2-CD1 4.07Å; L112-L361 PolarHBondContact O-N 2.99Å; L112-L361 VanDerWaalsContact O-N 3.13Å
113	D	88.7	Confident	91.5	Very high	70 Å²	70	28.5 Å²	28.5	37%	0.374	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.5	177	-71.7	-50	0	0	0	113.2	C109 I111 K360 L361 S362	C109-D113 PolarHBondContact O-N 2.72Å; I111-D113 VanDerWaalsContact C-N 3.29Å; I111-D113 PolarHBondContact O-N 2.78Å; D113-K360 VanDerWaalsContact O-CD 3.26Å; D113-K360 WeakPolarHBondContact O-CD 3.26Å; D113-K360 WeakPolarHBondContact O-CG 3.22Å; D113-L361 WeakPolarHBondContact CA-O 3.18Å; D113-L361 PolarHBondContact N-O 2.81Å; D113-L361 VanDerWaalsContact N-O 3.1Å; D113-S362 WeakPolarHBondContact OD1-CA 3.45Å; D113-S362 WeakPolarHBondContact OD1-CB 3.37Å; D113-S362 PolarHBondContact OD1-OG 3.01Å
114	R	88.9	Confident	91.2	Very high	145 Å²	145	27.4 Å²	27.4	55%	0.547	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-18.4	174	-66.1	177.9	169.9	-150.8	3.5	113.4	I92 I111 L112	I92-R114 HydrophobicContact CD1-CB 3.99Å; I92-R114 HydrophobicContact CD1-CG 4.42Å; I111-R114 WeakPolarHBondContact O-CB 3.48Å; I111-R114 PolarHBondContact O-N 2.69Å; L112-R114 PolarHBondContact O-N 3.45Å; L112-R114 VanDerWaalsContact O-N 3.13Å
115	G	87.2	Confident	90.8	Very high	4 Å²	4	29 Å²	29	4%	0.041	15%	0.146	C	C	.	.			trans	88.2	56	177.4	0	0	0	0	0	114.2	L112 Q359	L112-G115 PolarHBondContact O-N 3.18Å; G115-Q359 WeakPolarHBondContact CA-O 3.24Å
116	I	92.8	Very high	90.6	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	16%	0.158	C	C	.	.			trans	-74	152.2	177.3	54	168.5	0	0	0	113.5	Y51 I92 I111 L112 L119 L140	Y51-I116 CarbonylContact O-C 3.5Å; Y51-I116 VanDerWaalsContact O-CA 3.26Å; Y51-I116 WeakPolarHBondContact O-CA 3.38Å; I92-I116 HydrophobicContact CD1-CG2 3.96Å; I111-I116 HydrophobicContact CG2-CD1 3.9Å; I111-I116 HydrophobicContact CG2-CG1 4.41Å; I111-I116 HydrophobicContact CG2-CG2 3.54Å; L112-I116 HydrophobicContact CD2-CD1 4.11Å; L112-I116 HydrophobicContact CD2-CG1 4.17Å; I116-L119 HydrophobicContact CD1-CB 4.18Å; I116-L119 HydrophobicContact CD1-CD1 4.38Å; I116-L140 HydrophobicContact CD1-CD2 3.6Å; I116-L140 HydrophobicContact CG1-CD1 4.45Å; I116-L140 HydrophobicContact CG1-CD2 4Å; I116-L140 WeakPolarHBondContact O-CD1 3.45Å
117	I	92.7	Very high	90.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.139	C	C	.	.	S	Bend	trans	-96.1	-15.7	175.5	65.4	156	0	0	0	114.6	I50 Y51 I52 L89 P141 L343 L347 L356 W370 L376	I50-I117 HydrophobicContact CG2-CB 4.34Å; I50-I117 HydrophobicContact CG2-CD1 3.71Å; I50-I117 HydrophobicContact CG2-CG1 3.81Å; I50-I117 HydrophobicContact CG2-CG2 3.6Å; Y51-I117 PolarHBondContact O-N 2.71Å; I52-I117 HydrophobicContact CG2-CD1 4.41Å; I52-I117 HydrophobicContact CG2-CG1 3.93Å; L89-I117 HydrophobicContact CD2-CD1 3.92Å; I117-P141 WeakPolarHBondContact O-CD 3.47Å; I117-L343 HydrophobicContact CD1-CD1 4.4Å; I117-L343 HydrophobicContact CD1-CD2 4.44Å; I117-L347 HydrophobicContact CD1-CD1 4.04Å; I117-L347 HydrophobicContact CD1-CD2 3.99Å; I117-L356 HydrophobicContact CG2-CD1 4.28Å; I117-W370 HydrophobicContact CB-CH2 3.71Å; I117-W370 HydrophobicContact CB-CZ2 4.49Å; I117-W370 HydrophobicContact CB-CZ3 4.26Å; I117-W370 HydrophobicContact CG2-CH2 3.77Å; I117-W370 HydrophobicContact CG2-CZ2 4.08Å; I117-W370 WeakPolarHBondContact O-CZ3 3.39Å; I117-L376 HydrophobicContact CB-CD2 4.39Å; I117-L376 HydrophobicContact CD1-CD2 4.39Å
118	A	93.9	Very high	90.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.132	C	C	.	.			trans	-156.7	152.8	179.3	0	0	0	0	0	110.1	G53 P141 L343	G53-A118 PolarHBondContact N-O 2.87Å; A118-P141 CarbonylContact C-O 3.52Å; A118-P141 WeakPolarHBondContact CA-O 3.45Å; A118-P141 HydrophobicContact CB-CB 4.26Å; A118-L343 HydrophobicContact CB-CD1 4.23Å; A118-L343 HydrophobicContact CB-CD2 3.96Å
119	L	94.9	Very high	90	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	125.1	174.9	178	64.8	0	0	0	110.8	G53 I55 I116 L131 L140 P141 Y142 V143	G53-L119 CarbonylContact O-C 3.6Å; G53-L119 WeakPolarHBondContact O-CA 3.44Å; I55-L119 HydrophobicContact CD1-CD1 4.13Å; I55-L119 HydrophobicContact CG1-CD1 4.32Å; I116-L119 HydrophobicContact CD1-CB 4.18Å; I116-L119 HydrophobicContact CD1-CD1 4.38Å; L119-L131 HydrophobicContact CD2-CB 4.35Å; L119-L140 HydrophobicContact CB-CD2 3.65Å; L119-P141 PolarHBondContact N-O 2.82Å; L119-Y142 HydrophobicContact CB-CD2 4.09Å; L119-Y142 HydrophobicContact CD2-CD2 4.04Å; L119-Y142 HydrophobicContact CD2-CE2 3.97Å; L119-Y142 HydrophobicContact CG-CD2 4Å; L119-Y142 HydrophobicContact CG-CE2 3.94Å; L119-Y142 WeakPolarHBondContact O-CA 3.22Å; L119-Y142 VanDerWaalsContact O-CD2 3.3Å; L119-Y142 WeakPolarHBondContact O-CD2 3.19Å; L119-V143 PolarHBondContact O-N 2.81Å
120	Y	94.5	Very high	90	Very high	1 Å²	1	27.5 Å²	27.5	0%	0.004	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	136.7	175	-76.8	-94.4	0	0	0	111.5	I52 G53 I54 I55 F67 V143 S339 L340 L343	I52-Y120 HydrophobicContact CD1-CE2 4.22Å; G53-Y120 PolarHBondContact O-N 3.02Å; I54-Y120 HydrophobicContact CG1-CD2 3.95Å; I54-Y120 HydrophobicContact CG1-CG 4.16Å; I55-Y120 PolarHBondContact N-O 3.36Å; F67-Y120 AromaticContact CE1-CD1 3.53Å; F67-Y120 HydrophobicContact CE1-CD1 3.53Å; F67-Y120 HydrophobicContact CE1-CD2 4.32Å; F67-Y120 AromaticContact CE1-CE1 3.99Å; F67-Y120 HydrophobicContact CE1-CE1 3.99Å; F67-Y120 AromaticContact CE1-CG 3.72Å; F67-Y120 HydrophobicContact CE1-CG 3.72Å; F67-Y120 HydrophobicContact CZ-CD1 4.01Å; F67-Y120 HydrophobicContact CZ-CG 4.29Å; Y120-V143 HydrophobicContact CD1-CB 3.61Å; Y120-V143 HydrophobicContact CD1-CG1 3.72Å; Y120-V143 HydrophobicContact CD1-CG2 4.41Å; Y120-V143 HydrophobicContact CE1-CB 3.53Å; Y120-V143 HydrophobicContact CE1-CG1 3.28Å; Y120-V143 HydrophobicContact CE1-CG2 4.04Å; Y120-V143 HydrophobicContact CE2-CB 4.49Å; Y120-V143 HydrophobicContact CE2-CG2 4.29Å; Y120-V143 HydrophobicContact CG-CB 4.15Å; Y120-S339 VanDerWaalsContact CE1-OG 3.24Å; Y120-S339 WeakPolarHBondContact CE1-OG 3.39Å; Y120-S339 PolarHBondContact OH-O 3.35Å; Y120-S339 PolarHBondContact OH-OG 2.93Å; Y120-L340 HydrophobicContact CE2-CD2 4.01Å; Y120-L340 WeakPolarHBondContact OH-CD2 3.07Å; Y120-L343 HydrophobicContact CE2-CD2 4.43Å
121	G	88.5	Confident	90	Very high	2 Å²	2	22.8 Å²	22.8	2%	0.021	13%	0.125	C	C	.	.	P	Polyproline II helix	trans	-90.8	149.3	-179.2	0	0	0	0	0	114.8	I55 Y142 V143	I55-G121 CarbonylContact O-C 3.58Å; G121-Y142 WeakPolarHBondContact CA-OH 3.38Å; G121-V143 PolarHBondContact N-O 2.9Å
122	P	90.1	Very high	89.9	Confident	1 Å²	1	23 Å²	23	1%	0.006	13%	0.126	C	C	.	.	P	Polyproline II helix	trans	-72.1	170.9	171.3	32.4	-36.4	0	0	0	111.2	I55 T57 S124 L127 L131 H146	I55-P122 VanDerWaalsContact O-CA 3.28Å; I55-P122 WeakPolarHBondContact O-CA 3.36Å; I55-P122 WeakPolarHBondContact O-CB 3.37Å; I55-P122 WeakPolarHBondContact O-CD 3.26Å; T57-P122 HydrophobicContact CG2-CB 3.93Å; P122-S124 VanDerWaalsContact C-N 3.26Å; P122-S124 PolarHBondContact O-N 2.91Å; P122-L127 HydrophobicContact CB-CD1 4.44Å; P122-L127 HydrophobicContact CG-CB 3.6Å; P122-L127 HydrophobicContact CG-CD1 3.96Å; P122-L127 HydrophobicContact CG-CG 4.43Å; P122-L131 VanDerWaalsContact CD-CD1 3.5Å; P122-L131 HydrophobicContact CG-CD1 4.12Å; P122-H146 PolarHBondContact O-CE1 2.84Å; P122-H146 PolarHBondContact O-ND1 2.9Å
123	S	84.7	Confident	89.8	Confident	47 Å²	47	26.8 Å²	26.8	33%	0.329	15%	0.153	S	C	.	.	S	Bend	trans	-69.4	-19	177	64.1	0	0	0	0	114.6	D60 T125	D60-S123 WeakPolarHBondContact OD1-CB 3.49Å; D60-S123 PolarHBondContact OD1-OG 3.1Å; D60-S123 PolarHBondContact OD2-N 2.9Å; D60-S123 PolarHBondContact OD2-OG 3.43Å; S123-T125 PolarHBondContact O-N 2.65Å
124	S	87.2	Confident	89.9	Confident	15 Å²	15	24.4 Å²	24.4	11%	0.105	14%	0.14	C	C	.	.			trans	-74.4	112.4	-179.1	178.3	0	0	0	0	112.2	K98 P122 S126 L127 S128	K98-S124 WeakPolarHBondContact O-CB 3.29Å; K98-S124 PolarHBondContact O-OG 3.37Å; P122-S124 VanDerWaalsContact C-N 3.26Å; P122-S124 PolarHBondContact O-N 2.91Å; S124-S126 PolarHBondContact O-N 3.43Å; S124-S126 VanDerWaalsContact O-N 3.15Å; S124-L127 PolarHBondContact O-N 3.07Å; S124-L127 VanDerWaalsContact O-N 3.09Å; S124-S128 PolarHBondContact O-N 2.99Å
125	T	84.4	Confident	90	Very high	32 Å²	32	17.6 Å²	17.6	20%	0.196	12%	0.115	C	C	.	.	H	α-helix	trans	-46.1	-43.1	175.6	-53.7	0	0	0	0	112.9	S123 Q129	S123-T125 PolarHBondContact O-N 2.65Å; T125-Q129 VanDerWaalsContact O-CG 3.25Å; T125-Q129 WeakPolarHBondContact O-CG 3.37Å; T125-Q129 PolarHBondContact O-N 3.4Å; T125-Q129 PolarHBondContact O-NE2 3.47Å
126	S	86.5	Confident	90.1	Very high	68 Å²	68	19.7 Å²	19.7	48%	0.476	13%	0.125	S	C	.	.	H	α-helix	trans	-70	-41.7	-178.5	-61.7	0	0	0	0	112.9	S124	S124-S126 PolarHBondContact O-N 3.43Å; S124-S126 VanDerWaalsContact O-N 3.15Å
127	L	90.6	Very high	90	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-69	-43.5	176.3	-57.7	-174.2	0	0	0	110.8	T57 V96 K98 V101 A104 P122 S124 Q129 A130 L131	T57-L127 HydrophobicContact CG2-CD1 4.11Å; V96-L127 HydrophobicContact CG2-CD1 3.8Å; K98-L127 WeakPolarHBondContact O-CD1 3.5Å; K98-L127 VanDerWaalsContact O-CG 3.26Å; K98-L127 WeakPolarHBondContact O-CG 3.47Å; V101-L127 HydrophobicContact CB-CD2 4.37Å; V101-L127 HydrophobicContact CG2-CD2 3.9Å; A104-L127 HydrophobicContact CB-CB 4.42Å; A104-L127 HydrophobicContact CB-CD1 4.4Å; A104-L127 HydrophobicContact CB-CD2 3.9Å; A104-L127 HydrophobicContact CB-CG 4.47Å; P122-L127 HydrophobicContact CB-CD1 4.44Å; P122-L127 HydrophobicContact CG-CB 3.6Å; P122-L127 HydrophobicContact CG-CD1 3.96Å; P122-L127 HydrophobicContact CG-CG 4.43Å; S124-L127 PolarHBondContact O-N 3.07Å; S124-L127 VanDerWaalsContact O-N 3.09Å; L127-Q129 VanDerWaalsContact C-N 3.35Å; L127-Q129 PolarHBondContact O-N 3.03Å; L127-A130 PolarHBondContact O-N 3.24Å; L127-L131 WeakPolarHBondContact O-CG 3.49Å; L127-L131 PolarHBondContact O-N 2.93Å
128	S	89.3	Confident	89.9	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.007	15%	0.145	C	C	.	.	H	α-helix	trans	-61.3	-42.7	-177.3	-174.9	0	0	0	0	112	S124 A130 L131 L132 Y142 E144 H146	S124-S128 PolarHBondContact O-N 2.99Å; S128-A130 VanDerWaalsContact C-N 3.31Å; S128-A130 PolarHBondContact O-N 2.86Å; S128-L131 PolarHBondContact O-N 3Å; S128-L132 WeakPolarHBondContact O-CB 3.49Å; S128-L132 PolarHBondContact O-N 3.33Å; S128-Y142 WeakPolarHBondContact CA-OH 3.34Å; S128-Y142 PolarHBondContact O-OH 2.93Å; S128-Y142 WeakPolarHBondContact OG-CE1 3.42Å; S128-Y142 PolarHBondContact OG-OH 2.93Å; S128-E144 PolarHBondContact OG-OE1 3.23Å; S128-H146 VanDerWaalsContact CB-CE1 3.49Å; S128-H146 WeakPolarHBondContact CB-CE1 3.36Å; S128-H146 PolarHBondContact OG-CE1 3.09Å
129	Q	88.3	Confident	89.7	Confident	60 Å²	60	24.9 Å²	24.9	28%	0.28	15%	0.145	S	C	.	.	H	α-helix	trans	-58.1	-39.3	175.6	-71.7	178.6	52	0	0	113.7	T125 L127 S133 R152	T125-Q129 VanDerWaalsContact O-CG 3.25Å; T125-Q129 WeakPolarHBondContact O-CG 3.37Å; T125-Q129 PolarHBondContact O-N 3.4Å; T125-Q129 PolarHBondContact O-NE2 3.47Å; L127-Q129 VanDerWaalsContact C-N 3.35Å; L127-Q129 PolarHBondContact O-N 3.03Å; Q129-S133 WeakPolarHBondContact O-CB 3.39Å; Q129-S133 PolarHBondContact O-N 3.25Å; Q129-R152 VanDerWaalsContact CD-NH2 3.26Å; Q129-R152 VanDerWaalsContact OE1-CZ 3.24Å
130	A	90.7	Very high	89.5	Confident	23 Å²	23	24.8 Å²	24.8	19%	0.19	14%	0.144	C	C	.	.	H	α-helix	trans	-71	-40.9	178.6	0	0	0	0	0	111.9	V101 T105 L127 S128 S133 L134	V101-A130 HydrophobicContact CG1-CB 3.5Å; V101-A130 VanDerWaalsContact CG1-CB 3.5Å; T105-A130 HydrophobicContact CG2-CB 3.93Å; L127-A130 PolarHBondContact O-N 3.24Å; S128-A130 VanDerWaalsContact C-N 3.31Å; S128-A130 PolarHBondContact O-N 2.86Å; A130-S133 WeakPolarHBondContact O-CB 3.33Å; A130-S133 PolarHBondContact O-N 3.46Å; A130-L134 PolarHBondContact O-N 3.21Å
131	L	92.4	Very high	89.5	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-69.2	-38.6	176.8	-65.8	174.8	0	0	0	112.3	I55 A108 L119 P122 L127 S128 L134 A135 Y142	I55-L131 HydrophobicContact CB-CD1 4.1Å; I55-L131 HydrophobicContact CD1-CD1 3.96Å; I55-L131 HydrophobicContact CD1-CD2 3.72Å; I55-L131 HydrophobicContact CG2-CD1 4.04Å; A108-L131 HydrophobicContact CB-CD2 3.5Å; A108-L131 VanDerWaalsContact CB-CD2 3.5Å; L119-L131 HydrophobicContact CD2-CB 4.35Å; P122-L131 VanDerWaalsContact CD-CD1 3.5Å; P122-L131 HydrophobicContact CG-CD1 4.12Å; L127-L131 WeakPolarHBondContact O-CG 3.49Å; L127-L131 PolarHBondContact O-N 2.93Å; S128-L131 PolarHBondContact O-N 3Å; L131-L134 WeakPolarHBondContact O-CB 3.38Å; L131-L134 PolarHBondContact O-N 3.04Å; L131-A135 WeakPolarHBondContact O-CB 3.38Å; L131-A135 PolarHBondContact O-N 3.3Å; L131-Y142 HydrophobicContact CB-CE2 3.71Å; L131-Y142 WeakPolarHBondContact CB-OH 3.46Å
132	L	91	Very high	89.8	Confident	9 Å²	9	24.8 Å²	24.8	5%	0.047	14%	0.144	C	C	.	.	H	α-helix	trans	-59.7	-44.5	169.7	172.4	61.5	0	0	0	111.1	S128 L134 A135 N136 Y142 T154 A157	S128-L132 WeakPolarHBondContact O-CB 3.49Å; S128-L132 PolarHBondContact O-N 3.33Å; L132-L134 VanDerWaalsContact C-N 3.32Å; L132-L134 PolarHBondContact O-N 3.42Å; L132-A135 PolarHBondContact O-N 3Å; L132-N136 WeakPolarHBondContact CD1-ND2 3.46Å; L132-N136 PolarHBondContact O-N 3.31Å; L132-N136 PolarHBondContact O-ND2 2.89Å; L132-Y142 HydrophobicContact CB-CD1 3.86Å; L132-Y142 HydrophobicContact CB-CE1 3.72Å; L132-Y142 HydrophobicContact CB-CG 4.46Å; L132-Y142 HydrophobicContact CD1-CD1 3.67Å; L132-Y142 HydrophobicContact CD1-CE1 4.36Å; L132-Y142 HydrophobicContact CD1-CG 4.17Å; L132-Y142 HydrophobicContact CG-CD1 4.32Å; L132-T154 HydrophobicContact CD1-CG2 4.05Å; L132-T154 HydrophobicContact CD2-CG2 3.91Å; L132-A157 HydrophobicContact CD1-CB 3.71Å
133	S	89.4	Confident	90	Very high	81 Å²	81	25.1 Å²	25.1	57%	0.566	15%	0.146	S	C	*	.	H	α-helix	trans	-61	-41.8	175.2	-169.8	0	0	0	0	111.6	Q129 A130 R137	Q129-S133 WeakPolarHBondContact O-CB 3.39Å; Q129-S133 PolarHBondContact O-N 3.25Å; A130-S133 WeakPolarHBondContact O-CB 3.33Å; A130-S133 PolarHBondContact O-N 3.46Å; S133-R137 PolarHBondContact O-N 2.77Å; S133-R137 VanDerWaalsContact O-N 3.13Å
134	L	90.4	Very high	90.3	Very high	21 Å²	21	23 Å²	23	11%	0.11	13%	0.131	C	C	.	.	H	α-helix	trans	-66.1	-42.7	176.7	-168.3	68.7	0	0	0	112.1	A108 L112 A130 L131 L132 R137 F138	A108-L134 HydrophobicContact CB-CD2 3.54Å; L112-L134 HydrophobicContact CD1-CD2 3.99Å; L112-L134 HydrophobicContact CD1-CG 4.21Å; A130-L134 PolarHBondContact O-N 3.21Å; L131-L134 WeakPolarHBondContact O-CB 3.38Å; L131-L134 PolarHBondContact O-N 3.04Å; L132-L134 VanDerWaalsContact C-N 3.32Å; L132-L134 PolarHBondContact O-N 3.42Å; L134-R137 WeakPolarHBondContact O-CB 3.34Å; L134-R137 PolarHBondContact O-N 3.36Å; L134-F138 HydrophobicContact CD1-CD2 4.46Å; L134-F138 HydrophobicContact CD1-CE2 3.86Å; L134-F138 HydrophobicContact CG-CD2 4.49Å; L134-F138 HydrophobicContact CG-CE2 4.32Å; L134-F138 VanDerWaalsContact O-CD2 3.31Å; L134-F138 WeakPolarHBondContact O-CD2 3.27Å; L134-F138 PolarHBondContact O-N 2.82Å
135	A	91	Very high	90.3	Very high	2 Å²	2	22.7 Å²	22.7	2%	0.017	13%	0.128	C	C	.	.	H	α-helix	trans	-64.2	-44.9	178.2	0	0	0	0	0	112	L131 L132 R137 F138 G139 L140 Y142	L131-A135 WeakPolarHBondContact O-CB 3.38Å; L131-A135 PolarHBondContact O-N 3.3Å; L132-A135 PolarHBondContact O-N 3Å; A135-R137 VanDerWaalsContact C-N 3.31Å; A135-R137 PolarHBondContact O-N 2.77Å; A135-F138 PolarHBondContact O-N 3.21Å; A135-G139 PolarHBondContact O-N 3.06Å; A135-L140 HydrophobicContact CB-CB 4.4Å; A135-L140 PolarHBondContact O-N 3.36Å; A135-Y142 HydrophobicContact CB-CD2 3.86Å; A135-Y142 HydrophobicContact CB-CG 4.12Å
136	N	89.6	Confident	90.5	Very high	48 Å²	48	21.9 Å²	21.9	26%	0.257	12%	0.122	S	C	.	.	H	α-helix	trans	-60.7	-37.8	173.8	-73.7	-71.5	0	0	0	111.9	L132 F138 G139 Y156	L132-N136 WeakPolarHBondContact CD1-ND2 3.46Å; L132-N136 PolarHBondContact O-N 3.31Å; L132-N136 PolarHBondContact O-ND2 2.89Å; N136-F138 PolarHBondContact O-N 3.09Å; N136-G139 PolarHBondContact O-N 3.49Å; N136-Y156 WeakPolarHBondContact OD1-CD2 3.48Å
137	R	89.3	Confident	90.3	Very high	107 Å²	107	20 Å²	20	40%	0.404	11%	0.105	S	C	.	.	H	α-helix	trans	-58.9	-31.4	176.7	170.7	175.8	166.1	-167.4	-10.7	113.1	S133 L134 A135 C363 R365 P367	S133-R137 PolarHBondContact O-N 2.77Å; S133-R137 VanDerWaalsContact O-N 3.13Å; L134-R137 WeakPolarHBondContact O-CB 3.34Å; L134-R137 PolarHBondContact O-N 3.36Å; A135-R137 VanDerWaalsContact C-N 3.31Å; A135-R137 PolarHBondContact O-N 2.77Å; R137-C363 PolarHBondContact NH2-O 2.87Å; R137-R365 PolarHBondContact NH2-O 2.74Å; R137-P367 HydrophobicContact CG-CB 3.88Å; R137-P367 HydrophobicContact CG-CG 4.19Å; R137-P367 WeakPolarHBondContact O-CB 3.36Å
138	F	90.1	Very high	89.5	Confident	3 Å²	3	21.4 Å²	21.4	1%	0.013	12%	0.115	C	C	.	.	H	α-helix	trans	-104.7	0.8	178.6	-64.2	-69.2	0	0	0	114.2	L112 L134 A135 N136 L140 L361 P367 W370	L112-F138 HydrophobicContact CD1-CD2 3.95Å; L112-F138 HydrophobicContact CD1-CE2 4.03Å; L134-F138 HydrophobicContact CD1-CD2 4.46Å; L134-F138 HydrophobicContact CD1-CE2 3.86Å; L134-F138 HydrophobicContact CG-CD2 4.49Å; L134-F138 HydrophobicContact CG-CE2 4.32Å; L134-F138 VanDerWaalsContact O-CD2 3.31Å; L134-F138 WeakPolarHBondContact O-CD2 3.27Å; L134-F138 PolarHBondContact O-N 2.82Å; A135-F138 PolarHBondContact O-N 3.21Å; N136-F138 PolarHBondContact O-N 3.09Å; F138-L140 PolarHBondContact O-N 3.32Å; F138-L361 HydrophobicContact CB-CD1 4.08Å; F138-L361 HydrophobicContact CB-CD2 4.46Å; F138-L361 HydrophobicContact CD1-CB 4.45Å; F138-L361 HydrophobicContact CD1-CD2 4.12Å; F138-P367 HydrophobicContact CD1-CB 4.07Å; F138-P367 HydrophobicContact CE1-CB 3.91Å; F138-W370 PolarHBondContact O-N 2.95Å
139	G	89.7	Confident	88.5	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	26.5	-175.7	0	0	0	0	0	113.8	A135 N136 Y156 G373	A135-G139 PolarHBondContact O-N 3.06Å; N136-G139 PolarHBondContact O-N 3.49Å; G139-Y156 WeakPolarHBondContact O-CD1 3.44Å; G139-Y156 WeakPolarHBondContact O-CE1 3.23Å; G139-G373 WeakPolarHBondContact O-CA 3.25Å
140	L	92	Very high	87.6	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.			trans	-85.2	133.7	-179.1	-172.9	75.2	0	0	0	110.5	L112 I116 L119 A135 F138 Y142 Y156 W370	L112-L140 HydrophobicContact CD2-CD2 3.83Å; I116-L140 HydrophobicContact CD1-CD2 3.6Å; I116-L140 HydrophobicContact CG1-CD1 4.45Å; I116-L140 HydrophobicContact CG1-CD2 4Å; I116-L140 WeakPolarHBondContact O-CD1 3.45Å; L119-L140 HydrophobicContact CB-CD2 3.65Å; A135-L140 HydrophobicContact CB-CB 4.4Å; A135-L140 PolarHBondContact O-N 3.36Å; F138-L140 PolarHBondContact O-N 3.32Å; L140-Y142 PolarHBondContact O-N 3.41Å; L140-Y156 WeakPolarHBondContact O-CB 3.38Å; L140-W370 HydrophobicContact CD1-CE3 4.1Å; L140-W370 HydrophobicContact CD1-CZ3 4.35Å
141	P	94.1	Very high	86.4	Confident	3 Å²	3	25.7 Å²	25.7	2%	0.019	14%	0.14	C	C	.	.			trans	-52.2	125.1	168.6	-28.1	36.5	0	0	0	112.5	I117 A118 L119 Y156 W370 L376 I377	I117-P141 WeakPolarHBondContact O-CD 3.47Å; A118-P141 CarbonylContact C-O 3.52Å; A118-P141 WeakPolarHBondContact CA-O 3.45Å; A118-P141 HydrophobicContact CB-CB 4.26Å; L119-P141 PolarHBondContact N-O 2.82Å; P141-Y156 CarbonylContact C-O 3.51Å; P141-Y156 WeakPolarHBondContact CA-O 3.24Å; P141-W370 HydrophobicContact CG-CZ3 4.36Å; P141-L376 HydrophobicContact CG-CB 4.23Å; P141-L376 HydrophobicContact CG-CD2 4.16Å; P141-L376 HydrophobicContact CG-CG 4.19Å; P141-I377 HydrophobicContact CB-CB 4.46Å; P141-I377 HydrophobicContact CB-CD1 4.23Å; P141-I377 HydrophobicContact CG-CB 4.37Å
142	Y	94.3	Very high	85.4	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	136.9	178	-168.4	-107.6	0	0	0	110.6	L119 G121 S128 L131 L132 A135 L140 E144 Y156 A157 I158	L119-Y142 HydrophobicContact CB-CD2 4.09Å; L119-Y142 HydrophobicContact CD2-CD2 4.04Å; L119-Y142 HydrophobicContact CD2-CE2 3.97Å; L119-Y142 HydrophobicContact CG-CD2 4Å; L119-Y142 HydrophobicContact CG-CE2 3.94Å; L119-Y142 WeakPolarHBondContact O-CA 3.22Å; L119-Y142 VanDerWaalsContact O-CD2 3.3Å; L119-Y142 WeakPolarHBondContact O-CD2 3.19Å; G121-Y142 WeakPolarHBondContact CA-OH 3.38Å; S128-Y142 WeakPolarHBondContact CA-OH 3.34Å; S128-Y142 PolarHBondContact O-OH 2.93Å; S128-Y142 WeakPolarHBondContact OG-CE1 3.42Å; S128-Y142 PolarHBondContact OG-OH 2.93Å; L131-Y142 HydrophobicContact CB-CE2 3.71Å; L131-Y142 WeakPolarHBondContact CB-OH 3.46Å; L132-Y142 HydrophobicContact CB-CD1 3.86Å; L132-Y142 HydrophobicContact CB-CE1 3.72Å; L132-Y142 HydrophobicContact CB-CG 4.46Å; L132-Y142 HydrophobicContact CD1-CD1 3.67Å; L132-Y142 HydrophobicContact CD1-CE1 4.36Å; L132-Y142 HydrophobicContact CD1-CG 4.17Å; L132-Y142 HydrophobicContact CG-CD1 4.32Å; A135-Y142 HydrophobicContact CB-CD2 3.86Å; A135-Y142 HydrophobicContact CB-CG 4.12Å; L140-Y142 PolarHBondContact O-N 3.41Å; Y142-E144 HydrophobicContact CD1-CG 4.03Å; Y142-E144 HydrophobicContact CE1-CG 3.56Å; Y142-Y156 PolarHBondContact N-O 3.02Å; Y142-A157 CarbonylContact O-C 3.47Å; Y142-A157 VanDerWaalsContact O-CA 3.27Å; Y142-A157 WeakPolarHBondContact O-CA 3.28Å; Y142-I158 PolarHBondContact O-N 3.38Å
143	V	93.7	Very high	84.6	Confident	8 Å²	8	38 Å²	38	5%	0.048	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	119.3	-172.2	-170	0	0	0	0	110.8	L119 Y120 G121 I158 L160	L119-V143 PolarHBondContact O-N 2.81Å; Y120-V143 HydrophobicContact CD1-CB 3.61Å; Y120-V143 HydrophobicContact CD1-CG1 3.72Å; Y120-V143 HydrophobicContact CD1-CG2 4.41Å; Y120-V143 HydrophobicContact CE1-CB 3.53Å; Y120-V143 HydrophobicContact CE1-CG1 3.28Å; Y120-V143 HydrophobicContact CE1-CG2 4.04Å; Y120-V143 HydrophobicContact CE2-CB 4.49Å; Y120-V143 HydrophobicContact CE2-CG2 4.29Å; Y120-V143 HydrophobicContact CG-CB 4.15Å; G121-V143 PolarHBondContact N-O 2.9Å; V143-I158 HydrophobicContact CB-CG2 4.33Å; V143-I158 HydrophobicContact CG1-CG2 4.07Å; V143-I158 HydrophobicContact CG2-CG2 4Å; V143-L160 HydrophobicContact CG1-CD2 3.5Å; V143-L160 VanDerWaalsContact CG1-CD2 3.5Å
144	E	91	Very high	84.2	Confident	3 Å²	3	34.6 Å²	34.6	1%	0.014	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	117	176.5	-70.3	-178.3	-164	0	0	111.1	S128 Y142 S148 I158 H159 L160	S128-E144 PolarHBondContact OG-OE1 3.23Å; Y142-E144 HydrophobicContact CD1-CG 4.03Å; Y142-E144 HydrophobicContact CE1-CG 3.56Å; E144-S148 WeakPolarHBondContact OE2-CB 3.27Å; E144-S148 PolarHBondContact OE2-OG 2.82Å; E144-I158 PolarHBondContact N-O 3.33Å; E144-H159 VanDerWaalsContact CD-CE1 3.49Å; E144-H159 IonicContact OE1-CE1 2.62Å; E144-H159 IonicContact OE1-ND1 3.65Å; E144-H159 IonicContact OE2-CE1 2.75Å; E144-H159 PolarHBondContact OE2-CE1 3.25Å; E144-H159 IonicContact OE2-ND1 3.15Å; E144-H159 PolarHBondContact OE2-ND1 3.23Å; E144-L160 PolarHBondContact O-N 3.47Å
145	T	88.9	Confident	84	Confident	8 Å²	8	37 Å²	37	5%	0.049	18%	0.182	C	C	.	.			trans	-98.7	-2.1	175	51.1	0	0	0	0	113.4	H161 Q332 I336	T145-H161 PolarHBondContact O-CD2 3.25Å; T145-H161 VanDerWaalsContact O-CD2 3.22Å; T145-H161 PolarHBondContact O-NE2 2.94Å; T145-Q332 PolarHBondContact O-NE2 3.09Å; T145-Q332 PolarHBondContact O-OE1 2.84Å; T145-I336 HydrophobicContact CG2-CG1 3.89Å
146	H	87.2	Confident	84	Confident	14 Å²	14	38.4 Å²	38.4	7%	0.065	19%	0.188	C	C	.	.	S	Bend	trans	-103.6	169.8	173.8	69.8	-85.6	0	0	0	111.7	P122 S128 S148 H161	P122-H146 PolarHBondContact O-CE1 2.84Å; P122-H146 PolarHBondContact O-ND1 2.9Å; S128-H146 VanDerWaalsContact CB-CE1 3.49Å; S128-H146 WeakPolarHBondContact CB-CE1 3.36Å; S128-H146 PolarHBondContact OG-CE1 3.09Å; H146-S148 PolarHBondContact O-N 3.18Å; H146-H161 VanDerWaalsContact C-CD2 3.44Å
147	W	83.6	Confident	84.1	Confident	29 Å²	29	36.1 Å²	36.1	11%	0.11	18%	0.175	C	C	.	.			trans	-74	105.9	178.3	-94.3	83.2	0	0	0	111.3	M149 H161 P162 I164 Y167 K196 W268	W147-M149 HydrophobicContact CB-CE 3.98Å; W147-M149 HydrophobicContact CB-SD 4.46Å; W147-M149 PolarHBondContact O-N 3.28Å; W147-H161 AromaticContact CD1-CD2 3.39Å; W147-H161 AromaticContact CD1-CE1 3.5Å; W147-H161 VanDerWaalsContact CD1-CE1 3.5Å; W147-H161 AromaticContact CD1-CG 3.42Å; W147-H161 VanDerWaalsContact CD1-CG 3.42Å; W147-H161 AromaticContact CD1-ND1 3.5Å; W147-H161 AromaticContact CD1-NE2 3.42Å; W147-H161 HydrophobicContact CD2-CB 4.24Å; W147-H161 AromaticContact CE2-CG 3.92Å; W147-H161 AromaticContact CE2-ND1 3.88Å; W147-H161 HydrophobicContact CG-CB 4.3Å; W147-H161 HydrophobicContact CZ2-CB 4.29Å; W147-H161 AromaticContact NE1-CD2 3.75Å; W147-H161 AromaticContact NE1-CE1 3.34Å; W147-H161 PolarHBondContact NE1-CE1 3.37Å; W147-H161 VanDerWaalsContact NE1-CE1 3.34Å; W147-H161 AromaticContact NE1-CG 3.27Å; W147-H161 VanDerWaalsContact NE1-CG 3.27Å; W147-H161 AromaticContact NE1-ND1 3.01Å; W147-H161 PolarHBondContact NE1-ND1 3.09Å; W147-H161 AromaticContact NE1-NE2 3.76Å; W147-P162 HydrophobicContact CH2-CB 3.9Å; W147-P162 WeakPolarHBondContact CH2-O 3.46Å; W147-P162 HydrophobicContact CZ2-CB 3.99Å; W147-P162 HydrophobicContact CZ2-CG 4.27Å; W147-P162 WeakPolarHBondContact CZ3-O 3.49Å; W147-I164 HydrophobicContact CE3-CG1 4.16Å; W147-I164 HydrophobicContact CZ3-CG1 3.76Å; W147-Y167 HydrophobicContact CH2-CD1 4.27Å; W147-Y167 HydrophobicContact CH2-CD2 4.47Å; W147-Y167 AromaticContact CH2-CG 3.93Å; W147-Y167 HydrophobicContact CH2-CG 3.93Å; W147-K196 HydrophobicContact CE3-CG 4.44Å; W147-W268 AromaticContact CZ2-CZ2 3.77Å; W147-W268 HydrophobicContact CZ2-CZ2 3.77Å; W147-W268 AromaticContact NE1-NE1 3.4Å
148	S	73.1	Confident	84.2	Confident	30 Å²	30	31.2 Å²	31.2	21%	0.21	16%	0.157	C	C	.	.			trans	-71.6	97.1	174.7	-144.1	0	0	0	0	110.3	E144 H146 I150	E144-S148 WeakPolarHBondContact OE2-CB 3.27Å; E144-S148 PolarHBondContact OE2-OG 2.82Å; H146-S148 PolarHBondContact O-N 3.18Å; S148-I150 PolarHBondContact O-N 2.75Å; S148-I150 VanDerWaalsContact O-N 3.11Å
149	M	68.9	Low	84.2	Confident	31 Å²	31	31.6 Å²	31.6	15%	0.153	16%	0.159	C	C	.	.			trans	-68.6	-7.2	-174.1	-64.5	-60.3	-177.3	0	0	114.4	W147 E192 L195	W147-M149 HydrophobicContact CB-CE 3.98Å; W147-M149 HydrophobicContact CB-SD 4.46Å; W147-M149 PolarHBondContact O-N 3.28Å; M149-E192 HydrophobicContact CG-CB 4.4Å; M149-L195 HydrophobicContact CB-CD1 4.14Å; M149-L195 WeakPolarHBondContact O-CD1 3.3Å
150	I	69.5	Low	84.3	Confident	70 Å²	70	31.6 Å²	31.6	36%	0.359	16%	0.159	S	C	.	.	S	Bend	trans	-121.8	110	-177.1	-50.7	175	0	0	0	108.9	S148 R152	S148-I150 PolarHBondContact O-N 2.75Å; S148-I150 VanDerWaalsContact O-N 3.11Å; I150-R152 HydrophobicContact CB-CG 4.44Å; I150-R152 HydrophobicContact CG2-CG 3.97Å; I150-R152 WeakPolarHBondContact O-CG 3.36Å; I150-R152 PolarHBondContact O-N 3.48Å
151	S	65.3	Low	84.2	Confident	72 Å²	72	32.1 Å²	32.1	50%	0.503	16%	0.161	S	C	.	.			trans	-60.6	108	174.3	-173.1	0	0	0	0	110.1
152	R	71.1	Confident	84.1	Confident	90 Å²	90	32.2 Å²	32.2	34%	0.34	16%	0.162	S	C	.	.			trans	-122.2	133.6	-177.6	-72.7	179.6	-177.6	-160.9	0.1	110.2	Q129 I150 T154	Q129-R152 VanDerWaalsContact CD-NH2 3.26Å; Q129-R152 VanDerWaalsContact OE1-CZ 3.24Å; I150-R152 HydrophobicContact CB-CG 4.44Å; I150-R152 HydrophobicContact CG2-CG 3.97Å; I150-R152 WeakPolarHBondContact O-CG 3.36Å; I150-R152 PolarHBondContact O-N 3.48Å; R152-T154 HydrophobicContact CB-CG2 4.13Å; R152-T154 PolarHBondContact O-N 3.5Å
153	K	74.4	Confident	83.9	Confident	178 Å²	178	32.8 Å²	32.8	77%	0.774	17%	0.166	S	C	*	.			trans	-78.6	72.6	175.8	-67.6	-178.5	-179.3	169.3	0	110
154	T	80.2	Confident	83.6	Confident	9 Å²	9	33.6 Å²	33.6	6%	0.055	17%	0.17	C	C	.	.			trans	-73.7	161.8	177.8	48	0	0	0	0	111.4	L132 R152 A157 H159 H400	L132-T154 HydrophobicContact CD1-CG2 4.05Å; L132-T154 HydrophobicContact CD2-CG2 3.91Å; R152-T154 HydrophobicContact CB-CG2 4.13Å; R152-T154 PolarHBondContact O-N 3.5Å; T154-A157 HydrophobicContact CG2-CB 3.9Å; T154-H159 PolarHBondContact OG1-NE2 3.06Å; T154-H400 WeakPolarHBondContact O-CA 3.36Å; T154-H400 PolarHBondContact O-ND1 3.21Å; T154-H400 PolarHBondContact OG1-O 3.26Å; T154-H400 VanDerWaalsContact OG1-O 3.06Å
155	T	86	Confident	83.5	Confident	72 Å²	72	39.3 Å²	39.3	44%	0.442	20%	0.197	S	C	.	.	S	Bend	trans	-115.8	-52.5	174.5	-56.6	0	0	0	0	110.5	L374 K381	T155-L374 HydrophobicContact CG2-CD1 4.01Å; T155-K381 PolarHBondContact O-NZ 3.3Å
156	Y	91.1	Very high	83.5	Confident	32 Å²	32	39.3 Å²	39.3	13%	0.125	20%	0.197	C	C	.	.	S	Bend	trans	-91.3	2.9	-176.6	-65.3	-86.9	0	0	0	114.5	N136 G139 L140 P141 Y142 L374 I377	N136-Y156 WeakPolarHBondContact OD1-CD2 3.48Å; G139-Y156 WeakPolarHBondContact O-CD1 3.44Å; G139-Y156 WeakPolarHBondContact O-CE1 3.23Å; L140-Y156 WeakPolarHBondContact O-CB 3.38Å; P141-Y156 CarbonylContact C-O 3.51Å; P141-Y156 WeakPolarHBondContact CA-O 3.24Å; Y142-Y156 PolarHBondContact N-O 3.02Å; Y156-L374 HydrophobicContact CE1-CB 3.77Å; Y156-L374 HydrophobicContact CE1-CD1 4.09Å; Y156-I377 HydrophobicContact CD1-CG2 4.26Å; Y156-I377 WeakPolarHBondContact O-CD1 3.4Å
157	A	91.6	Very high	83.7	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	159.7	179.9	0	0	0	0	0	113.5	L132 Y142 T154 K381	L132-A157 HydrophobicContact CD1-CB 3.71Å; Y142-A157 CarbonylContact O-C 3.47Å; Y142-A157 VanDerWaalsContact O-CA 3.27Å; Y142-A157 WeakPolarHBondContact O-CA 3.28Å; T154-A157 HydrophobicContact CG2-CB 3.9Å; A157-K381 WeakPolarHBondContact O-CE 3.43Å; A157-K381 PolarHBondContact O-NZ 2.89Å
158	I	91.6	Very high	84.1	Confident	4 Å²	4	37.3 Å²	37.3	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	136.1	163.4	-169.8	169.3	0	0	0	109.4	Y142 V143 E144 L160 I377 V380 K381 F397	Y142-I158 PolarHBondContact O-N 3.38Å; V143-I158 HydrophobicContact CB-CG2 4.33Å; V143-I158 HydrophobicContact CG1-CG2 4.07Å; V143-I158 HydrophobicContact CG2-CG2 4Å; E144-I158 PolarHBondContact N-O 3.33Å; I158-L160 HydrophobicContact CG2-CD2 4.23Å; I158-I377 HydrophobicContact CB-CD1 4.03Å; I158-I377 HydrophobicContact CG2-CD1 4.07Å; I158-V380 HydrophobicContact CD1-CG1 3.65Å; I158-K381 HydrophobicContact CD1-CG 4.46Å; I158-F397 HydrophobicContact CD1-CD1 3.82Å; I158-F397 HydrophobicContact CD1-CD2 3.83Å; I158-F397 HydrophobicContact CD1-CE1 3.76Å; I158-F397 HydrophobicContact CD1-CE2 3.78Å; I158-F397 HydrophobicContact CD1-CG 3.86Å; I158-F397 HydrophobicContact CD1-CZ 3.76Å; I158-F397 HydrophobicContact CG1-CD1 3.61Å; I158-F397 HydrophobicContact CG1-CE1 3.64Å; I158-F397 HydrophobicContact CG1-CG 4.09Å; I158-F397 HydrophobicContact CG1-CZ 4.14Å
159	H	91	Very high	84.9	Confident	10 Å²	10	38.1 Å²	38.1	5%	0.046	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	115.3	-174.7	-51.9	-97.5	0	0	0	108.2	E144 T154 G401 L402	E144-H159 VanDerWaalsContact CD-CE1 3.49Å; E144-H159 IonicContact OE1-CE1 2.62Å; E144-H159 IonicContact OE1-ND1 3.65Å; E144-H159 IonicContact OE2-CE1 2.75Å; E144-H159 PolarHBondContact OE2-CE1 3.25Å; E144-H159 IonicContact OE2-ND1 3.15Å; E144-H159 PolarHBondContact OE2-ND1 3.23Å; T154-H159 PolarHBondContact OG1-NE2 3.06Å; H159-G401 PolarHBondContact N-O 2.95Å; H159-L402 HydrophobicContact CB-CD2 4.36Å
160	L	91.8	Very high	85.9	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-27.2	-168.2	-82.6	-64	0	0	0	113.5	V143 E144 I158 L335 L342 F397 R403	V143-L160 HydrophobicContact CG1-CD2 3.5Å; V143-L160 VanDerWaalsContact CG1-CD2 3.5Å; E144-L160 PolarHBondContact O-N 3.47Å; I158-L160 HydrophobicContact CG2-CD2 4.23Å; L160-L335 HydrophobicContact CB-CB 4.23Å; L160-L335 HydrophobicContact CB-CD2 4.12Å; L160-L342 HydrophobicContact CD1-CD1 3.83Å; L160-F397 HydrophobicContact CD1-CZ 4.22Å; L160-R403 WeakPolarHBondContact O-CD 3.1Å; L160-R403 PolarHBondContact O-NH1 2.86Å
161	H	90.8	Very high	87	Confident	11 Å²	11	33.3 Å²	33.3	5%	0.051	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	152.1	168	-85.7	-67.4	0	0	0	111.2	T145 H146 W147 W268 Q332 L335 R403	T145-H161 PolarHBondContact O-CD2 3.25Å; T145-H161 VanDerWaalsContact O-CD2 3.22Å; T145-H161 PolarHBondContact O-NE2 2.94Å; H146-H161 VanDerWaalsContact C-CD2 3.44Å; W147-H161 AromaticContact CD1-CD2 3.39Å; W147-H161 AromaticContact CD1-CE1 3.5Å; W147-H161 VanDerWaalsContact CD1-CE1 3.5Å; W147-H161 AromaticContact CD1-CG 3.42Å; W147-H161 VanDerWaalsContact CD1-CG 3.42Å; W147-H161 AromaticContact CD1-ND1 3.5Å; W147-H161 AromaticContact CD1-NE2 3.42Å; W147-H161 HydrophobicContact CD2-CB 4.24Å; W147-H161 AromaticContact CE2-CG 3.92Å; W147-H161 AromaticContact CE2-ND1 3.88Å; W147-H161 HydrophobicContact CG-CB 4.3Å; W147-H161 HydrophobicContact CZ2-CB 4.29Å; W147-H161 AromaticContact NE1-CD2 3.75Å; W147-H161 AromaticContact NE1-CE1 3.34Å; W147-H161 PolarHBondContact NE1-CE1 3.37Å; W147-H161 VanDerWaalsContact NE1-CE1 3.34Å; W147-H161 AromaticContact NE1-CG 3.27Å; W147-H161 VanDerWaalsContact NE1-CG 3.27Å; W147-H161 AromaticContact NE1-ND1 3.01Å; W147-H161 PolarHBondContact NE1-ND1 3.09Å; W147-H161 AromaticContact NE1-NE2 3.76Å; H161-W268 AromaticContact CE1-CD1 3.98Å; H161-W268 AromaticContact CE1-NE1 3.84Å; H161-Q332 PolarHBondContact NE2-NE2 2.85Å; H161-L335 WeakPolarHBondContact CE1-CD1 3.22Å; H161-L335 WeakPolarHBondContact ND1-CD1 3.25Å; H161-L335 WeakPolarHBondContact NE2-CD1 3.44Å; H161-R403 WeakPolarHBondContact O-CB 3.35Å
162	P	91.1	Very high	88.2	Confident	5 Å²	5	32.5 Å²	32.5	3%	0.032	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-45.4	147.2	169.3	-33.3	39	0	0	0	114.5	W147 I291 F406	W147-P162 HydrophobicContact CH2-CB 3.9Å; W147-P162 WeakPolarHBondContact CH2-O 3.46Å; W147-P162 HydrophobicContact CZ2-CB 3.99Å; W147-P162 HydrophobicContact CZ2-CG 4.27Å; W147-P162 WeakPolarHBondContact CZ3-O 3.49Å; P162-I291 HydrophobicContact CG-CD1 3.98Å; P162-I291 HydrophobicContact CG-CG2 4.27Å; P162-F406 HydrophobicContact CB-CD1 3.83Å; P162-F406 HydrophobicContact CB-CD2 4.31Å; P162-F406 HydrophobicContact CB-CE1 3.55Å; P162-F406 HydrophobicContact CB-CE2 4.02Å; P162-F406 HydrophobicContact CB-CG 4.23Å; P162-F406 HydrophobicContact CB-CZ 3.65Å; P162-F406 HydrophobicContact CG-CD1 3.88Å; P162-F406 HydrophobicContact CG-CD2 3.84Å; P162-F406 HydrophobicContact CG-CE1 4.06Å; P162-F406 HydrophobicContact CG-CE2 3.98Å; P162-F406 HydrophobicContact CG-CG 3.8Å; P162-F406 HydrophobicContact CG-CZ 4.11Å
163	S	89.5	Confident	89	Confident	12 Å²	12	28.8 Å²	28.8	8%	0.084	14%	0.139	C	C	.	.			trans	-65.9	146	167.6	91.4	0	0	0	0	110.9	E165 S166 Y167 R403	S163-E165 VanDerWaalsContact C-N 3.26Å; S163-E165 PolarHBondContact O-N 3.29Å; S163-S166 PolarHBondContact O-N 3.02Å; S163-S166 VanDerWaalsContact OG-CB 3.32Å; S163-S166 WeakPolarHBondContact OG-CB 3.28Å; S163-S166 PolarHBondContact OG-N 2.9Å; S163-S166 PolarHBondContact OG-OG 3.11Å; S163-Y167 WeakPolarHBondContact O-CB 3.4Å; S163-Y167 PolarHBondContact O-N 3.41Å; S163-R403 PolarHBondContact N-O 3.17Å
164	I	89	Confident	89.8	Confident	25 Å²	25	20.5 Å²	20.5	13%	0.128	10%	0.103	C	C	.	.	H	α-helix	trans	-55.2	-43.1	176.3	-69.3	173.1	0	0	0	111.3	W147 G168 L195	W147-I164 HydrophobicContact CE3-CG1 4.16Å; W147-I164 HydrophobicContact CZ3-CG1 3.76Å; I164-G168 PolarHBondContact O-N 3.45Å; I164-L195 HydrophobicContact CD1-CB 4.46Å; I164-L195 WeakPolarHBondContact CG2-O 3.28Å
165	E	87.6	Confident	90.2	Very high	123 Å²	123	20.1 Å²	20.1	58%	0.575	10%	0.1	S	C	*	.	H	α-helix	trans	-65.2	-45.9	-178.5	-64.9	168.2	-147.6	0	0	111.3	S163 L169	S163-E165 VanDerWaalsContact C-N 3.26Å; S163-E165 PolarHBondContact O-N 3.29Å; E165-L169 WeakPolarHBondContact O-CB 3.29Å; E165-L169 PolarHBondContact O-N 3.12Å; E165-L169 VanDerWaalsContact O-N 3.07Å
166	S	89.5	Confident	90.2	Very high	8 Å²	8	18.5 Å²	18.5	6%	0.056	9%	0.091	C	C	.	.	H	α-helix	trans	-69	-42.1	178.1	-52.9	0	0	0	0	112.4	S163 L169 G170 W424	S163-S166 PolarHBondContact O-N 3.02Å; S163-S166 VanDerWaalsContact OG-CB 3.32Å; S163-S166 WeakPolarHBondContact OG-CB 3.28Å; S163-S166 PolarHBondContact OG-N 2.9Å; S163-S166 PolarHBondContact OG-OG 3.11Å; S166-L169 PolarHBondContact O-N 3.36Å; S166-G170 PolarHBondContact O-N 3.33Å; S166-G170 VanDerWaalsContact O-N 3.08Å; S166-W424 VanDerWaalsContact O-CH2 3.24Å; S166-W424 WeakPolarHBondContact O-CH2 3.38Å
167	Y	91.8	Very high	89.8	Confident	1 Å²	1	22.1 Å²	22.1	0%	0.004	11%	0.109	C	C	.	.	H	α-helix	trans	-64.8	-47.5	177.2	170.9	-98.8	0	0	0	111.7	W147 S163 L169 G170 L171 K196 F197 T266 W268 L408	W147-Y167 HydrophobicContact CH2-CD1 4.27Å; W147-Y167 HydrophobicContact CH2-CD2 4.47Å; W147-Y167 AromaticContact CH2-CG 3.93Å; W147-Y167 HydrophobicContact CH2-CG 3.93Å; S163-Y167 WeakPolarHBondContact O-CB 3.4Å; S163-Y167 PolarHBondContact O-N 3.41Å; Y167-L169 VanDerWaalsContact C-N 3.29Å; Y167-L169 PolarHBondContact O-N 3.01Å; Y167-G170 PolarHBondContact O-N 3.02Å; Y167-L171 HydrophobicContact CE1-CD2 4.03Å; Y167-L171 WeakPolarHBondContact O-CB 3.36Å; Y167-L171 PolarHBondContact O-N 2.91Å; Y167-K196 HydrophobicContact CD1-CB 4.24Å; Y167-K196 HydrophobicContact CE1-CB 4.02Å; Y167-F197 HydrophobicContact CE1-CE1 4.04Å; Y167-T266 WeakPolarHBondContact OH-CB 3.21Å; Y167-T266 WeakPolarHBondContact OH-CG2 3.21Å; Y167-W268 AromaticContact CD2-CH2 3.72Å; Y167-W268 HydrophobicContact CD2-CH2 3.72Å; Y167-W268 HydrophobicContact CD2-CZ2 4.15Å; Y167-W268 AromaticContact CE2-CH2 3.44Å; Y167-W268 HydrophobicContact CE2-CH2 3.44Å; Y167-W268 VanDerWaalsContact CE2-CH2 3.44Å; Y167-W268 AromaticContact CE2-CZ2 3.88Å; Y167-W268 HydrophobicContact CE2-CZ2 3.88Å; Y167-W268 HydrophobicContact CE2-CZ3 4.41Å; Y167-L408 HydrophobicContact CD2-CD1 4.05Å; Y167-L408 HydrophobicContact CE2-CD1 4.1Å
168	G	90.7	Very high	89.4	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.8	-35.8	178.5	0	0	0	0	0	112.7	I164 Y172	I164-G168 PolarHBondContact O-N 3.45Å; G168-Y172 WeakPolarHBondContact O-CB 3.49Å; G168-Y172 PolarHBondContact O-N 3.46Å
169	L	90.7	Very high	89.2	Confident	47 Å²	47	25.6 Å²	25.6	25%	0.246	13%	0.128	C	C	.	.	H	α-helix	trans	-66.4	-48.6	173.2	-179.6	62.3	0	0	0	112.3	E165 S166 Y167 L171 Y172 E173 T199 W424	E165-L169 WeakPolarHBondContact O-CB 3.29Å; E165-L169 PolarHBondContact O-N 3.12Å; E165-L169 VanDerWaalsContact O-N 3.07Å; S166-L169 PolarHBondContact O-N 3.36Å; Y167-L169 VanDerWaalsContact C-N 3.29Å; Y167-L169 PolarHBondContact O-N 3.01Å; L169-L171 PolarHBondContact O-N 3.19Å; L169-Y172 PolarHBondContact O-N 3.31Å; L169-E173 HydrophobicContact CD1-CG 4.39Å; L169-E173 PolarHBondContact O-N 2.62Å; L169-T199 HydrophobicContact CB-CG2 4.48Å; L169-W424 HydrophobicContact CB-CZ2 4.44Å; L169-W424 HydrophobicContact CD2-CZ2 4.17Å; L169-W424 HydrophobicContact CG-CZ2 4.1Å
170	G	90.3	Very high	89	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.3	-39.3	179.8	0	0	0	0	0	113.4	S166 Y167 Y174	S166-G170 PolarHBondContact O-N 3.33Å; S166-G170 VanDerWaalsContact O-N 3.08Å; Y167-G170 PolarHBondContact O-N 3.02Å; G170-Y174 WeakPolarHBondContact O-CB 3.47Å; G170-Y174 PolarHBondContact O-N 3.45Å
171	L	92	Very high	88.8	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-65.3	-41.6	172.9	-179.2	61.7	0	0	0	112	Y167 L169 Y174 L175 F197 L200 L236 I289	Y167-L171 HydrophobicContact CE1-CD2 4.03Å; Y167-L171 WeakPolarHBondContact O-CB 3.36Å; Y167-L171 PolarHBondContact O-N 2.91Å; L169-L171 PolarHBondContact O-N 3.19Å; L171-Y174 PolarHBondContact O-N 2.9Å; L171-L175 HydrophobicContact CD1-CD1 3.83Å; L171-L175 HydrophobicContact CD1-CG 4.05Å; L171-L175 HydrophobicContact CG-CD1 3.9Å; L171-L175 HydrophobicContact CG-CG 4.46Å; L171-L175 WeakPolarHBondContact O-CB 3.5Å; L171-L175 VanDerWaalsContact O-CG 3.28Å; L171-L175 WeakPolarHBondContact O-CG 3.47Å; L171-L175 PolarHBondContact O-N 3.29Å; L171-F197 HydrophobicContact CD2-CD1 3.55Å; L171-F197 HydrophobicContact CD2-CE1 3.5Å; L171-L200 HydrophobicContact CD2-CD2 4.18Å; L171-L200 HydrophobicContact CG-CD2 4.41Å; L171-L236 HydrophobicContact CD1-CD1 4.28Å; L171-L236 HydrophobicContact CD2-CD2 4.29Å; L171-I289 HydrophobicContact CD1-CD1 3.57Å
172	Y	91	Very high	88.6	Confident	54 Å²	54	40.2 Å²	40.2	21%	0.212	19%	0.191	C	C	.	.	H	α-helix	trans	-61.6	-47.6	175.3	170.9	-98	0	0	0	112.2	G168 L169 Y174 L175 T176 L200 N203	G168-Y172 WeakPolarHBondContact O-CB 3.49Å; G168-Y172 PolarHBondContact O-N 3.46Å; L169-Y172 PolarHBondContact O-N 3.31Å; Y172-Y174 PolarHBondContact O-N 3.25Å; Y172-L175 PolarHBondContact O-N 3.17Å; Y172-T176 HydrophobicContact CD2-CG2 3.96Å; Y172-T176 HydrophobicContact CE2-CG2 3.6Å; Y172-T176 WeakPolarHBondContact O-CB 3.46Å; Y172-T176 WeakPolarHBondContact O-CG2 3.49Å; Y172-T176 PolarHBondContact O-N 3.22Å; Y172-T176 PolarHBondContact O-OG1 2.9Å; Y172-L200 HydrophobicContact CD2-CD1 4Å; Y172-N203 HydrophobicContact CD2-CB 4Å; Y172-N203 HydrophobicContact CE2-CB 3.56Å; Y172-N203 WeakPolarHBondContact CE2-O 3.49Å; Y172-N203 PolarHBondContact OH-O 2.93Å
173	E	88.6	Confident	88.5	Confident	13 Å²	13	45.8 Å²	45.8	6%	0.061	21%	0.211	C	C	.	.	H	α-helix	trans	-62.8	-41	176.9	-71.4	-175.2	-175.3	0	0	111.8	L169 Q177 W424 R429	L169-E173 HydrophobicContact CD1-CG 4.39Å; L169-E173 PolarHBondContact O-N 2.62Å; E173-Q177 WeakPolarHBondContact O-CB 3.25Å; E173-Q177 WeakPolarHBondContact O-CG 3.45Å; E173-Q177 PolarHBondContact O-N 3.06Å; E173-W424 PolarHBondContact OE2-NE1 3.02Å; E173-R429 IonicContact OE1-CZ 2.74Å; E173-R429 IonicContact OE1-NH1 3.96Å; E173-R429 PolarHBondContact OE1-NH1 3.12Å; E173-R429 WeakPolarHBondContact OE2-CD 3.49Å
174	Y	89.5	Confident	88.6	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.016	21%	0.207	C	C	.	.	I	π-helix	trans	-60.5	-52.4	175.7	173.2	-134.3	0	0	0	112.5	G170 L171 Y172 T176 V178 E179 I264 I289 T410 M430	G170-Y174 WeakPolarHBondContact O-CB 3.47Å; G170-Y174 PolarHBondContact O-N 3.45Å; L171-Y174 PolarHBondContact O-N 2.9Å; Y172-Y174 PolarHBondContact O-N 3.25Å; Y174-T176 PolarHBondContact O-N 3.29Å; Y174-V178 HydrophobicContact CD2-CB 3.78Å; Y174-V178 HydrophobicContact CD2-CG1 4.27Å; Y174-V178 HydrophobicContact CD2-CG2 3.91Å; Y174-V178 HydrophobicContact CE2-CB 4.02Å; Y174-V178 HydrophobicContact CE2-CG1 4.08Å; Y174-V178 VanDerWaalsContact O-CB 3.28Å; Y174-V178 WeakPolarHBondContact O-CB 3.3Å; Y174-V178 PolarHBondContact O-N 2.92Å; Y174-V178 VanDerWaalsContact O-N 3.09Å; Y174-E179 HydrophobicContact CD2-CG 4.37Å; Y174-E179 HydrophobicContact CE1-CG 4.37Å; Y174-E179 HydrophobicContact CE2-CG 3.69Å; Y174-E179 WeakPolarHBondContact CE2-OE1 3.33Å; Y174-E179 PolarHBondContact O-N 2.94Å; Y174-E179 PolarHBondContact OH-OE1 3.48Å; Y174-I264 HydrophobicContact CE1-CD1 4.04Å; Y174-I264 HydrophobicContact CE1-CG2 4.31Å; Y174-I289 HydrophobicContact CD1-CD1 4.33Å; Y174-I289 HydrophobicContact CE1-CD1 4.39Å; Y174-T410 HydrophobicContact CD1-CG2 3.73Å; Y174-T410 HydrophobicContact CD2-CG2 3.86Å; Y174-T410 HydrophobicContact CE1-CG2 3.63Å; Y174-T410 HydrophobicContact CE2-CG2 3.82Å; Y174-T410 HydrophobicContact CG-CG2 3.86Å; Y174-M430 HydrophobicContact CD2-CE 3.97Å; Y174-M430 HydrophobicContact CD2-SD 4.23Å
175	L	90.4	Very high	88.9	Confident	0 Å²	0	44 Å²	44	0%	0	20%	0.201	C	C	.	.	I	π-helix	trans	-67.4	-34.7	-176.5	-66.7	173.1	0	0	0	113.1	L171 Y172 K180 W181 M184 L200 L236 I264	L171-L175 HydrophobicContact CD1-CD1 3.83Å; L171-L175 HydrophobicContact CD1-CG 4.05Å; L171-L175 HydrophobicContact CG-CD1 3.9Å; L171-L175 HydrophobicContact CG-CG 4.46Å; L171-L175 WeakPolarHBondContact O-CB 3.5Å; L171-L175 VanDerWaalsContact O-CG 3.28Å; L171-L175 WeakPolarHBondContact O-CG 3.47Å; L171-L175 PolarHBondContact O-N 3.29Å; Y172-L175 PolarHBondContact O-N 3.17Å; L175-K180 PolarHBondContact O-N 3.04Å; L175-W181 HydrophobicContact CD2-CD2 4.3Å; L175-W181 HydrophobicContact CD2-CE3 3.83Å; L175-W181 HydrophobicContact CD2-CZ3 3.97Å; L175-W181 PolarHBondContact O-N 3.45Å; L175-W181 VanDerWaalsContact O-N 3.16Å; L175-M184 HydrophobicContact CD1-SD 4.29Å; L175-L200 HydrophobicContact CD1-CD1 3.92Å; L175-L200 HydrophobicContact CD1-CD2 3.66Å; L175-L200 HydrophobicContact CD1-CG 4.46Å; L175-L236 HydrophobicContact CD1-CD2 4.05Å; L175-I264 HydrophobicContact CD2-CD1 3.55Å
176	T	85.2	Confident	89.2	Confident	39 Å²	39	38.2 Å²	38.2	24%	0.239	17%	0.174	C	C	.	.	I	π-helix	trans	-86.4	-42.2	-178.2	56.5	0	0	0	0	113.5	Y172 Y174 K180	Y172-T176 HydrophobicContact CD2-CG2 3.96Å; Y172-T176 HydrophobicContact CE2-CG2 3.6Å; Y172-T176 WeakPolarHBondContact O-CB 3.46Å; Y172-T176 WeakPolarHBondContact O-CG2 3.49Å; Y172-T176 PolarHBondContact O-N 3.22Å; Y172-T176 PolarHBondContact O-OG1 2.9Å; Y174-T176 PolarHBondContact O-N 3.29Å; T176-K180 WeakPolarHBondContact O-CA 3.4Å
177	Q	82.9	Confident	89.4	Confident	108 Å²	108	37.8 Å²	37.8	51%	0.505	17%	0.171	S	C	.	.	I	π-helix	trans	-88.6	-35.9	-173.7	-55.2	-179.2	16.8	0	0	112.7	E173 K180	E173-Q177 WeakPolarHBondContact O-CB 3.25Å; E173-Q177 WeakPolarHBondContact O-CG 3.45Å; E173-Q177 PolarHBondContact O-N 3.06Å; Q177-K180 WeakPolarHBondContact O-CE 3.43Å
178	V	83.6	Confident	89.5	Confident	45 Å²	45	39.8 Å²	39.8	27%	0.273	18%	0.179	S	C	.	.	I	π-helix	trans	-97.7	-60	-173.2	-168.5	0	0	0	0	111.2	Y174 M430 V432	Y174-V178 HydrophobicContact CD2-CB 3.78Å; Y174-V178 HydrophobicContact CD2-CG1 4.27Å; Y174-V178 HydrophobicContact CD2-CG2 3.91Å; Y174-V178 HydrophobicContact CE2-CB 4.02Å; Y174-V178 HydrophobicContact CE2-CG1 4.08Å; Y174-V178 VanDerWaalsContact O-CB 3.28Å; Y174-V178 WeakPolarHBondContact O-CB 3.3Å; Y174-V178 PolarHBondContact O-N 2.92Å; Y174-V178 VanDerWaalsContact O-N 3.09Å; V178-M430 HydrophobicContact CG2-CE 4.15Å; V178-M430 HydrophobicContact CG2-CG 3.46Å; V178-M430 VanDerWaalsContact CG2-CG 3.46Å; V178-M430 HydrophobicContact CG2-SD 4.18Å; V178-V432 HydrophobicContact CB-CG2 4.2Å; V178-V432 HydrophobicContact CG1-CG1 4.33Å; V178-V432 HydrophobicContact CG1-CG2 3.71Å; V178-V432 HydrophobicContact CG2-CG2 3.42Å; V178-V432 VanDerWaalsContact CG2-CG2 3.42Å
179	E	87.1	Confident	89.4	Confident	32 Å²	32	41.2 Å²	41.2	15%	0.15	19%	0.186	C	C	.	.	S	Bend	trans	-78.4	-23.5	-178.7	-58	-67.2	145.6	0	0	112.4	Y174 W181 I264 K287	Y174-E179 HydrophobicContact CD2-CG 4.37Å; Y174-E179 HydrophobicContact CE1-CG 4.37Å; Y174-E179 HydrophobicContact CE2-CG 3.69Å; Y174-E179 WeakPolarHBondContact CE2-OE1 3.33Å; Y174-E179 PolarHBondContact O-N 2.94Å; Y174-E179 PolarHBondContact OH-OE1 3.48Å; E179-W181 VanDerWaalsContact C-N 3.27Å; E179-W181 HydrophobicContact CB-CD2 4.46Å; E179-W181 HydrophobicContact CB-CG 4.18Å; E179-W181 PolarHBondContact O-N 2.89Å; E179-I264 HydrophobicContact CG-CD1 4Å; E179-K287 IonicContact OE1-NZ 2.74Å; E179-K287 PolarHBondContact OE1-NZ 3.47Å; E179-K287 IonicContact OE2-NZ 2.62Å; E179-K287 PolarHBondContact OE2-NZ 2.98Å
180	K	86.4	Confident	89.2	Confident	154 Å²	154	45 Å²	45	67%	0.67	20%	0.201	S	C	*	.			trans	56.5	37	175.6	-58.4	178.7	-176.9	-179.8	0	113.6	L175 T176 Q177 K182	L175-K180 PolarHBondContact O-N 3.04Å; T176-K180 WeakPolarHBondContact O-CA 3.4Å; Q177-K180 WeakPolarHBondContact O-CE 3.43Å; K180-K182 PolarHBondContact O-N 3Å
181	W	88.4	Confident	89	Confident	12 Å²	12	49.4 Å²	49.4	5%	0.045	23%	0.229	C	C	.	.			trans	-69.2	122.9	-178.3	-73	4	0	0	0	111.6	L175 E179 M184 F204 N234 L236 T262 I264	L175-W181 HydrophobicContact CD2-CD2 4.3Å; L175-W181 HydrophobicContact CD2-CE3 3.83Å; L175-W181 HydrophobicContact CD2-CZ3 3.97Å; L175-W181 PolarHBondContact O-N 3.45Å; L175-W181 VanDerWaalsContact O-N 3.16Å; E179-W181 VanDerWaalsContact C-N 3.27Å; E179-W181 HydrophobicContact CB-CD2 4.46Å; E179-W181 HydrophobicContact CB-CG 4.18Å; E179-W181 PolarHBondContact O-N 2.89Å; W181-M184 HydrophobicContact CD2-CB 4.43Å; W181-M184 HydrophobicContact CE3-CB 3.56Å; W181-M184 HydrophobicContact CE3-CG 4.28Å; W181-M184 HydrophobicContact CE3-SD 3.75Å; W181-M184 HydrophobicContact CZ3-CB 3.98Å; W181-M184 HydrophobicContact CZ3-SD 4.31Å; W181-F204 HydrophobicContact CB-CZ 4.49Å; W181-F204 WeakPolarHBondContact O-CE2 3.38Å; W181-F204 VanDerWaalsContact O-CZ 3.24Å; W181-F204 WeakPolarHBondContact O-CZ 3.34Å; W181-N234 HydrophobicContact CD2-CB 3.69Å; W181-N234 VanDerWaalsContact CE2-CG 3.48Å; W181-N234 HydrophobicContact CE3-CB 3.88Å; W181-N234 HydrophobicContact CG-CB 4.28Å; W181-N234 HydrophobicContact CH2-CB 3.86Å; W181-N234 HydrophobicContact CZ2-CB 3.69Å; W181-N234 HydrophobicContact CZ3-CB 3.96Å; W181-N234 PolarHBondContact NE1-OD1 3.32Å; W181-L236 HydrophobicContact CZ3-CB 4.36Å; W181-T262 HydrophobicContact CZ2-CG2 3.77Å; W181-I264 HydrophobicContact CH2-CB 4.22Å; W181-I264 HydrophobicContact CH2-CD1 3.41Å; W181-I264 VanDerWaalsContact CH2-CD1 3.41Å; W181-I264 HydrophobicContact CH2-CG1 3.68Å; W181-I264 HydrophobicContact CZ2-CD1 3.47Å; W181-I264 VanDerWaalsContact CZ2-CD1 3.47Å; W181-I264 HydrophobicContact CZ2-CG1 3.92Å; W181-I264 HydrophobicContact CZ3-CD1 4.05Å
182	K	86	Confident	88.6	Confident	163 Å²	163	54.2 Å²	54.2	71%	0.709	25%	0.252	S	S	*	.	S	Bend	trans	-102.6	-12.1	170.1	-62.8	-169	176.4	-170.2	0	113.9	K180 G206 I207	K180-K182 PolarHBondContact O-N 3Å; K182-G206 CarbonylContact O-C 3.46Å; K182-G206 VanDerWaalsContact O-CA 3.24Å; K182-G206 WeakPolarHBondContact O-CA 3.38Å; K182-I207 PolarHBondContact O-N 2.69Å
183	R	89.2	Confident	88.3	Confident	121 Å²	121	52 Å²	52	46%	0.457	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	129.7	175.7	-58.3	-169.4	-179.3	-144.7	0.6	108.1	I207 N234	R183-I207 WeakPolarHBondContact CA-O 3.49Å; R183-I207 HydrophobicContact CG-CB 4.17Å; R183-I207 HydrophobicContact CG-CD1 4.43Å; R183-I207 HydrophobicContact CG-CG1 4.45Å; R183-N234 WeakPolarHBondContact O-CB 3.16Å; R183-N234 PolarHBondContact O-ND2 3.15Å
184	M	92.1	Very high	88.3	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	157.3	177.5	68.5	-175.3	177.2	0	0	112	L175 W181 L200 F204 I207 L208 K209 N234	L175-M184 HydrophobicContact CD1-SD 4.29Å; W181-M184 HydrophobicContact CD2-CB 4.43Å; W181-M184 HydrophobicContact CE3-CB 3.56Å; W181-M184 HydrophobicContact CE3-CG 4.28Å; W181-M184 HydrophobicContact CE3-SD 3.75Å; W181-M184 HydrophobicContact CZ3-CB 3.98Å; W181-M184 HydrophobicContact CZ3-SD 4.31Å; M184-L200 HydrophobicContact CE-CD1 3.96Å; M184-L200 HydrophobicContact CE-CD2 3.9Å; M184-L200 HydrophobicContact CE-CG 3.94Å; M184-F204 HydrophobicContact CE-CB 4.47Å; M184-F204 HydrophobicContact CE-CD1 3.87Å; M184-F204 HydrophobicContact CE-CD2 3.52Å; M184-F204 HydrophobicContact CE-CE1 3.85Å; M184-F204 HydrophobicContact CE-CE2 3.52Å; M184-F204 HydrophobicContact CE-CG 3.7Å; M184-F204 HydrophobicContact CE-CZ 3.68Å; M184-F204 HydrophobicContact CG-CE1 4.1Å; M184-F204 HydrophobicContact CG-CE2 4.48Å; M184-F204 HydrophobicContact CG-CZ 3.85Å; M184-F204 HydrophobicContact SD-CD2 4.4Å; M184-F204 HydrophobicContact SD-CE1 4.38Å; M184-F204 HydrophobicContact SD-CE2 3.8Å; M184-F204 HydrophobicContact SD-CZ 3.78Å; M184-I207 PolarHBondContact N-O 3.1Å; M184-L208 HydrophobicContact CE-CD1 3.77Å; M184-L208 HydrophobicContact CE-CD2 4.24Å; M184-L208 HydrophobicContact CE-CG 4.41Å; M184-L208 HydrophobicContact CG-CD1 3.87Å; M184-L208 WeakPolarHBondContact O-CA 3.4Å; M184-K209 PolarHBondContact O-N 2.61Å; M184-N234 WeakPolarHBondContact CA-O 3.34Å; M184-N234 HydrophobicContact CB-CB 4.21Å
185	T	93.8	Very high	88.1	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	122.1	169.8	-57.6	0	0	0	0	109.8	I187 K209 K211 L227 N234 F235 L236	T185-I187 HydrophobicContact CG2-CG1 4.12Å; T185-K209 CarbonylContact C-O 3.59Å; T185-K209 WeakPolarHBondContact CA-O 3.37Å; T185-K209 HydrophobicContact CG2-CB 4.12Å; T185-K211 HydrophobicContact CG2-CB 4.43Å; T185-K211 HydrophobicContact CG2-CG 4.03Å; T185-L227 HydrophobicContact CG2-CD2 4.08Å; T185-N234 PolarHBondContact N-O 3Å; T185-F235 HydrophobicContact CG2-CD1 4.36Å; T185-F235 HydrophobicContact CG2-CE1 4.44Å; T185-F235 WeakPolarHBondContact O-CA 3.13Å; T185-L236 PolarHBondContact O-N 2.9Å
186	L	94.2	Very high	88	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	119.2	168.3	170.6	59	0	0	0	109.4	L194 F197 L208 K209 I210 K211 L236	L186-L194 HydrophobicContact CD2-CD2 3.96Å; L186-F197 HydrophobicContact CD1-CD2 4.07Å; L186-F197 HydrophobicContact CD1-CE2 4.05Å; L186-F197 HydrophobicContact CD1-CG 4.44Å; L186-F197 HydrophobicContact CD1-CZ 4.39Å; L186-F197 HydrophobicContact CD2-CB 4.13Å; L186-F197 HydrophobicContact CD2-CD2 3.95Å; L186-F197 HydrophobicContact CD2-CG 4.09Å; L186-L208 HydrophobicContact CB-CD1 3.84Å; L186-K209 PolarHBondContact N-O 2.9Å; L186-I210 CarbonylContact O-C 3.59Å; L186-I210 WeakPolarHBondContact O-CA 3.33Å; L186-K211 PolarHBondContact O-N 2.7Å; L186-L236 CarbonylContact C-O 3.48Å; L186-L236 WeakPolarHBondContact CA-O 3.48Å; L186-L236 HydrophobicContact CD1-CB 4.36Å; L186-L236 HydrophobicContact CD1-CD2 3.99Å; L186-L236 HydrophobicContact CD1-CG 4.03Å
187	I	94	Very high	88.3	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.8	174.9	-54.4	178.3	0	0	0	107.8	T185 K211 W213 M223 L227 F235 L236 V237 D238 F247	T185-I187 HydrophobicContact CG2-CG1 4.12Å; I187-K211 VanDerWaalsContact CA-O 3.3Å; I187-K211 WeakPolarHBondContact CA-O 3.48Å; I187-W213 HydrophobicContact CG2-CB 3.99Å; I187-M223 HydrophobicContact CD1-CE 4.07Å; I187-M223 HydrophobicContact CG2-CE 4.24Å; I187-M223 HydrophobicContact CG2-SD 4.32Å; I187-L227 HydrophobicContact CD1-CD1 3.63Å; I187-L227 HydrophobicContact CG1-CD1 4.41Å; I187-F235 HydrophobicContact CD1-CD1 4.04Å; I187-L236 PolarHBondContact N-O 3.27Å; I187-V237 HydrophobicContact CB-CG1 4.31Å; I187-V237 HydrophobicContact CB-CG2 4.5Å; I187-V237 HydrophobicContact CD1-CG2 4.29Å; I187-V237 HydrophobicContact CG2-CG1 4.47Å; I187-D238 PolarHBondContact O-N 3.29Å; I187-F247 HydrophobicContact CD1-CE2 3.73Å; I187-F247 HydrophobicContact CD1-CZ 3.82Å; I187-F247 HydrophobicContact CG2-CE2 4.49Å
188	Y	92.7	Very high	88.6	Confident	43 Å²	43	54 Å²	54	17%	0.169	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	143.8	-178.6	72.3	-83.7	0	0	0	111.6	K190 P191 L194 I210 K211 S212 W213	Y188-K190 WeakPolarHBondContact CD2-O 3.35Å; Y188-P191 HydrophobicContact CE2-CB 4.27Å; Y188-L194 HydrophobicContact CD1-CD1 4.34Å; Y188-L194 HydrophobicContact CD1-CD2 3.66Å; Y188-L194 HydrophobicContact CD1-CG 4.22Å; Y188-L194 HydrophobicContact CD2-CD1 4.32Å; Y188-L194 HydrophobicContact CD2-CD2 4.31Å; Y188-L194 HydrophobicContact CD2-CG 4.08Å; Y188-L194 HydrophobicContact CE1-CD1 4.09Å; Y188-L194 HydrophobicContact CE1-CD2 4.18Å; Y188-L194 HydrophobicContact CE1-CG 4.48Å; Y188-L194 HydrophobicContact CE2-CD1 4.07Å; Y188-L194 HydrophobicContact CE2-CG 4.35Å; Y188-L194 HydrophobicContact CG-CD1 4.45Å; Y188-L194 HydrophobicContact CG-CD2 3.73Å; Y188-L194 HydrophobicContact CG-CG 4.02Å; Y188-I210 HydrophobicContact CD1-CG2 3.9Å; Y188-I210 HydrophobicContact CE1-CG2 3.69Å; Y188-K211 WeakPolarHBondContact CD1-O 3.05Å; Y188-K211 WeakPolarHBondContact CE1-O 3.49Å; Y188-K211 PolarHBondContact N-O 2.93Å; Y188-S212 CarbonylContact O-C 3.56Å; Y188-S212 WeakPolarHBondContact O-CA 3.49Å; Y188-W213 PolarHBondContact O-N 3.19Å
189	N	89.4	Confident	88.8	Confident	29 Å²	29	53.1 Å²	53.1	16%	0.155	25%	0.252	C	S	.	.	S	Bend	trans	-80.5	-60.4	171.6	177.6	-58.8	0	0	0	111.4	E215 D238 I239 Q243	N189-E215 PolarHBondContact ND2-OE1 2.68Å; N189-D238 PolarHBondContact N-O 3.41Å; N189-I239 HydrophobicContact CB-CG2 4.38Å; N189-Q243 PolarHBondContact ND2-OE1 3.38Å
190	K	85.9	Confident	88.9	Confident	126 Å²	126	51.6 Å²	51.6	55%	0.548	25%	0.245	S	C	.	.	S	Bend	trans	-103.5	135.3	-174.3	-58.8	-172.1	179.2	173.1	0	112.1	Y188 E192 S193	Y188-K190 WeakPolarHBondContact CD2-O 3.35Å; K190-E192 PolarHBondContact O-N 3.15Å; K190-E192 VanDerWaalsContact O-N 3.16Å; K190-S193 PolarHBondContact O-N 2.98Å; K190-S193 PolarHBondContact O-OG 3.01Å; K190-S193 VanDerWaalsContact O-OG 3.08Å
191	P	87.4	Confident	89	Confident	93 Å²	93	47.3 Å²	47.3	60%	0.604	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-61.4	-28.1	-178.3	25.1	-34.6	0	0	0	113.3	Y188 S193 L194	Y188-P191 HydrophobicContact CE2-CB 4.27Å; P191-S193 VanDerWaalsContact C-N 3.26Å; P191-S193 PolarHBondContact O-N 3.28Å; P191-L194 WeakPolarHBondContact O-CB 3.43Å; P191-L194 PolarHBondContact O-N 3.33Å
192	E	83.5	Confident	89	Confident	102 Å²	102	52.8 Å²	52.8	48%	0.477	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-61	-32.1	173.8	-60.5	-174.9	172.5	0	0	112.9	M149 K190 L194 L195	M149-E192 HydrophobicContact CG-CB 4.4Å; K190-E192 PolarHBondContact O-N 3.15Å; K190-E192 VanDerWaalsContact O-N 3.16Å; E192-L194 PolarHBondContact O-N 2.74Å; E192-L195 WeakPolarHBondContact O-CB 3.36Å; E192-L195 WeakPolarHBondContact O-CG 3.24Å; E192-L195 PolarHBondContact O-N 2.64Å
193	S	84.6	Confident	89.1	Confident	6 Å²	6	48.9 Å²	48.9	4%	0.042	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-74.4	-14.5	-176	82.4	0	0	0	0	113.5	K190 P191 L195 K196 F197 D238	K190-S193 PolarHBondContact O-N 2.98Å; K190-S193 PolarHBondContact O-OG 3.01Å; K190-S193 VanDerWaalsContact O-OG 3.08Å; P191-S193 VanDerWaalsContact C-N 3.26Å; P191-S193 PolarHBondContact O-N 3.28Å; S193-L195 PolarHBondContact O-N 2.9Å; S193-L195 VanDerWaalsContact O-N 3.14Å; S193-K196 VanDerWaalsContact O-CB 3.23Å; S193-K196 WeakPolarHBondContact O-CB 3.36Å; S193-K196 WeakPolarHBondContact O-CD 3.42Å; S193-K196 VanDerWaalsContact O-CG 3.25Å; S193-K196 WeakPolarHBondContact O-CG 3.4Å; S193-K196 PolarHBondContact O-N 2.91Å; S193-K196 VanDerWaalsContact O-N 3.07Å; S193-F197 WeakPolarHBondContact O-CD2 3.32Å; S193-D238 WeakPolarHBondContact CB-OD2 3.08Å; S193-D238 PolarHBondContact OG-OD2 3.26Å
194	L	87.3	Confident	88.9	Confident	49 Å²	49	44.2 Å²	44.2	26%	0.257	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-57	-25.6	169.5	-68.2	174.6	0	0	0	112.6	L186 Y188 P191 E192 K196 F197 I210	L186-L194 HydrophobicContact CD2-CD2 3.96Å; Y188-L194 HydrophobicContact CD1-CD1 4.34Å; Y188-L194 HydrophobicContact CD1-CD2 3.66Å; Y188-L194 HydrophobicContact CD1-CG 4.22Å; Y188-L194 HydrophobicContact CD2-CD1 4.32Å; Y188-L194 HydrophobicContact CD2-CD2 4.31Å; Y188-L194 HydrophobicContact CD2-CG 4.08Å; Y188-L194 HydrophobicContact CE1-CD1 4.09Å; Y188-L194 HydrophobicContact CE1-CD2 4.18Å; Y188-L194 HydrophobicContact CE1-CG 4.48Å; Y188-L194 HydrophobicContact CE2-CD1 4.07Å; Y188-L194 HydrophobicContact CE2-CG 4.35Å; Y188-L194 HydrophobicContact CG-CD1 4.45Å; Y188-L194 HydrophobicContact CG-CD2 3.73Å; Y188-L194 HydrophobicContact CG-CG 4.02Å; P191-L194 WeakPolarHBondContact O-CB 3.43Å; P191-L194 PolarHBondContact O-N 3.33Å; E192-L194 PolarHBondContact O-N 2.74Å; L194-K196 VanDerWaalsContact C-N 3.25Å; L194-K196 PolarHBondContact O-N 2.84Å; L194-F197 PolarHBondContact O-N 2.86Å; L194-I210 HydrophobicContact CD2-CG2 4.27Å
195	L	87	Confident	88.4	Confident	76 Å²	76	52.9 Å²	52.9	40%	0.398	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-61.1	-33.2	176.9	-66.6	167.8	0	0	0	112.3	M149 I164 E192 S193 F197 T198	M149-L195 HydrophobicContact CB-CD1 4.14Å; M149-L195 WeakPolarHBondContact O-CD1 3.3Å; I164-L195 HydrophobicContact CD1-CB 4.46Å; I164-L195 WeakPolarHBondContact CG2-O 3.28Å; E192-L195 WeakPolarHBondContact O-CB 3.36Å; E192-L195 WeakPolarHBondContact O-CG 3.24Å; E192-L195 PolarHBondContact O-N 2.64Å; S193-L195 PolarHBondContact O-N 2.9Å; S193-L195 VanDerWaalsContact O-N 3.14Å; L195-F197 PolarHBondContact O-N 2.97Å; L195-F197 VanDerWaalsContact O-N 3.17Å; L195-T198 HydrophobicContact CD2-CG2 4.4Å; L195-T198 WeakPolarHBondContact O-CG2 3.4Å; L195-T198 PolarHBondContact O-N 2.7Å; L195-T198 PolarHBondContact O-OG1 3.37Å
196	K	87.4	Confident	87.9	Confident	28 Å²	28	54.8 Å²	54.8	12%	0.122	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-53.9	-33.1	172.2	-60.7	170.4	179.2	168.4	0	112.7	W147 Y167 S193 L194 D238	W147-K196 HydrophobicContact CE3-CG 4.44Å; Y167-K196 HydrophobicContact CD1-CB 4.24Å; Y167-K196 HydrophobicContact CE1-CB 4.02Å; S193-K196 VanDerWaalsContact O-CB 3.23Å; S193-K196 WeakPolarHBondContact O-CB 3.36Å; S193-K196 WeakPolarHBondContact O-CD 3.42Å; S193-K196 VanDerWaalsContact O-CG 3.25Å; S193-K196 WeakPolarHBondContact O-CG 3.4Å; S193-K196 PolarHBondContact O-N 2.91Å; S193-K196 VanDerWaalsContact O-N 3.07Å; L194-K196 VanDerWaalsContact C-N 3.25Å; L194-K196 PolarHBondContact O-N 2.84Å; K196-D238 IonicContact NZ-OD1 2.68Å; K196-D238 PolarHBondContact NZ-OD1 3.04Å; K196-D238 IonicContact NZ-OD2 2.7Å; K196-D238 PolarHBondContact NZ-OD2 3.3Å
197	F	90.6	Very high	87.6	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-101.2	4.9	-169.4	-54	-64.5	0	0	0	113.4	Y167 L171 L186 S193 L194 L195 T199 L200 V201 L236 D238 T266	Y167-F197 HydrophobicContact CE1-CE1 4.04Å; L171-F197 HydrophobicContact CD2-CD1 3.55Å; L171-F197 HydrophobicContact CD2-CE1 3.5Å; L186-F197 HydrophobicContact CD1-CD2 4.07Å; L186-F197 HydrophobicContact CD1-CE2 4.05Å; L186-F197 HydrophobicContact CD1-CG 4.44Å; L186-F197 HydrophobicContact CD1-CZ 4.39Å; L186-F197 HydrophobicContact CD2-CB 4.13Å; L186-F197 HydrophobicContact CD2-CD2 3.95Å; L186-F197 HydrophobicContact CD2-CG 4.09Å; S193-F197 WeakPolarHBondContact O-CD2 3.32Å; L194-F197 PolarHBondContact O-N 2.86Å; L195-F197 PolarHBondContact O-N 2.97Å; L195-F197 VanDerWaalsContact O-N 3.17Å; F197-T199 VanDerWaalsContact C-N 3.32Å; F197-T199 PolarHBondContact O-N 2.98Å; F197-L200 HydrophobicContact CD1-CD2 4.47Å; F197-L200 CarbonylContact O-C 3.56Å; F197-L200 WeakPolarHBondContact O-CA 3.38Å; F197-L200 WeakPolarHBondContact O-CB 3.09Å; F197-L200 PolarHBondContact O-N 2.86Å; F197-V201 HydrophobicContact CB-CG2 4.41Å; F197-V201 WeakPolarHBondContact O-CG2 3.44Å; F197-V201 PolarHBondContact O-N 2.65Å; F197-L236 HydrophobicContact CD1-CD2 4.34Å; F197-L236 HydrophobicContact CE1-CD2 4.33Å; F197-D238 HydrophobicContact CE2-CB 3.74Å; F197-D238 HydrophobicContact CZ-CB 3.76Å; F197-T266 HydrophobicContact CE1-CG2 4.02Å; F197-T266 HydrophobicContact CZ-CG2 4.09Å
198	T	89.2	Confident	87.4	Confident	53 Å²	53	60.3 Å²	60.3	33%	0.325	32%	0.321	S	S	.	.	H	α-helix	trans	-51.2	-45.9	179.3	44	0	0	0	0	113.6	L195 L200 V201 N202	L195-T198 HydrophobicContact CD2-CG2 4.4Å; L195-T198 WeakPolarHBondContact O-CG2 3.4Å; L195-T198 PolarHBondContact O-N 2.7Å; L195-T198 PolarHBondContact O-OG1 3.37Å; T198-L200 VanDerWaalsContact C-N 3.28Å; T198-L200 PolarHBondContact O-N 3.37Å; T198-V201 PolarHBondContact O-N 3.05Å; T198-N202 WeakPolarHBondContact O-CB 3.21Å; T198-N202 PolarHBondContact O-N 3.39Å; T198-N202 PolarHBondContact O-ND2 3.41Å
199	T	87.9	Confident	87.3	Confident	28 Å²	28	62 Å²	62	17%	0.172	33%	0.329	C	S	.	.	H	α-helix	trans	-64.7	-30.2	176.7	-53	0	0	0	0	112.9	L169 F197 N203	L169-T199 HydrophobicContact CB-CG2 4.48Å; F197-T199 VanDerWaalsContact C-N 3.32Å; F197-T199 PolarHBondContact O-N 2.98Å; T199-N203 WeakPolarHBondContact O-CB 3.23Å; T199-N203 PolarHBondContact O-ND2 3.03Å
200	L	88.9	Confident	87.4	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-76.3	-51.2	176	178.5	61.9	0	0	0	110.6	L171 Y172 L175 M184 F197 T198 N202 N203 F204 L236	L171-L200 HydrophobicContact CD2-CD2 4.18Å; L171-L200 HydrophobicContact CG-CD2 4.41Å; Y172-L200 HydrophobicContact CD2-CD1 4Å; L175-L200 HydrophobicContact CD1-CD1 3.92Å; L175-L200 HydrophobicContact CD1-CD2 3.66Å; L175-L200 HydrophobicContact CD1-CG 4.46Å; M184-L200 HydrophobicContact CE-CD1 3.96Å; M184-L200 HydrophobicContact CE-CD2 3.9Å; M184-L200 HydrophobicContact CE-CG 3.94Å; F197-L200 HydrophobicContact CD1-CD2 4.47Å; F197-L200 CarbonylContact O-C 3.56Å; F197-L200 WeakPolarHBondContact O-CA 3.38Å; F197-L200 WeakPolarHBondContact O-CB 3.09Å; F197-L200 PolarHBondContact O-N 2.86Å; T198-L200 VanDerWaalsContact C-N 3.28Å; T198-L200 PolarHBondContact O-N 3.37Å; L200-N202 VanDerWaalsContact C-N 3.3Å; L200-N202 PolarHBondContact O-N 3.1Å; L200-N203 PolarHBondContact O-N 2.88Å; L200-F204 HydrophobicContact CD1-CD2 4.2Å; L200-F204 VanDerWaalsContact O-CB 3.26Å; L200-F204 WeakPolarHBondContact O-CB 3.39Å; L200-F204 PolarHBondContact O-N 3.46Å; L200-L236 HydrophobicContact CD2-CD2 3.55Å
201	V	88.8	Confident	87.7	Confident	64 Å²	64	61 Å²	61	39%	0.388	33%	0.326	S	S	.	.	H	α-helix	trans	-57.6	-41.1	-179.4	173.9	0	0	0	0	111.7	F197 T198 L208	F197-V201 HydrophobicContact CB-CG2 4.41Å; F197-V201 WeakPolarHBondContact O-CG2 3.44Å; F197-V201 PolarHBondContact O-N 2.65Å; T198-V201 PolarHBondContact O-N 3.05Å; V201-L208 HydrophobicContact CB-CD2 4.44Å; V201-L208 HydrophobicContact CG2-CD2 3.9Å
202	N	88.4	Confident	87.8	Confident	127 Å²	127	59.8 Å²	59.8	68%	0.679	32%	0.32	S	S	*	.	H	α-helix	trans	-74.7	-23.2	-177	-68.9	-10.8	0	0	0	114.2	T198 L200	T198-N202 WeakPolarHBondContact O-CB 3.21Å; T198-N202 PolarHBondContact O-N 3.39Å; T198-N202 PolarHBondContact O-ND2 3.41Å; L200-N202 VanDerWaalsContact C-N 3.3Å; L200-N202 PolarHBondContact O-N 3.1Å
203	N	88.3	Confident	88.2	Confident	80 Å²	80	55.8 Å²	55.8	43%	0.428	30%	0.3	S	S	.	.	H	α-helix	trans	-116.5	-5.2	-169.9	-63.3	-32.5	0	0	0	114.2	Y172 T199 L200 E205	Y172-N203 HydrophobicContact CD2-CB 4Å; Y172-N203 HydrophobicContact CE2-CB 3.56Å; Y172-N203 WeakPolarHBondContact CE2-O 3.49Å; Y172-N203 PolarHBondContact OH-O 2.93Å; T199-N203 WeakPolarHBondContact O-CB 3.23Å; T199-N203 PolarHBondContact O-ND2 3.03Å; L200-N203 PolarHBondContact O-N 2.88Å; N203-E205 PolarHBondContact O-N 2.88Å
204	F	86	Confident	88.2	Confident	23 Å²	23	58.3 Å²	58.3	10%	0.101	31%	0.313	C	S	.	.			trans	-76.1	106.1	-171.9	-174.5	-105.1	0	0	0	113.2	W181 M184 L200 G206 L208	W181-F204 HydrophobicContact CB-CZ 4.49Å; W181-F204 WeakPolarHBondContact O-CE2 3.38Å; W181-F204 VanDerWaalsContact O-CZ 3.24Å; W181-F204 WeakPolarHBondContact O-CZ 3.34Å; M184-F204 HydrophobicContact CE-CB 4.47Å; M184-F204 HydrophobicContact CE-CD1 3.87Å; M184-F204 HydrophobicContact CE-CD2 3.52Å; M184-F204 HydrophobicContact CE-CE1 3.85Å; M184-F204 HydrophobicContact CE-CE2 3.52Å; M184-F204 HydrophobicContact CE-CG 3.7Å; M184-F204 HydrophobicContact CE-CZ 3.68Å; M184-F204 HydrophobicContact CG-CE1 4.1Å; M184-F204 HydrophobicContact CG-CE2 4.48Å; M184-F204 HydrophobicContact CG-CZ 3.85Å; M184-F204 HydrophobicContact SD-CD2 4.4Å; M184-F204 HydrophobicContact SD-CE1 4.38Å; M184-F204 HydrophobicContact SD-CE2 3.8Å; M184-F204 HydrophobicContact SD-CZ 3.78Å; L200-F204 HydrophobicContact CD1-CD2 4.2Å; L200-F204 VanDerWaalsContact O-CB 3.26Å; L200-F204 WeakPolarHBondContact O-CB 3.39Å; L200-F204 PolarHBondContact O-N 3.46Å; F204-G206 PolarHBondContact O-N 2.8Å; F204-L208 HydrophobicContact CD1-CB 4.01Å; F204-L208 HydrophobicContact CE1-CB 4.33Å
205	E	81	Confident	87.8	Confident	183 Å²	183	61.8 Å²	61.8	86%	0.855	33%	0.328	S	S	*	.			trans	-72.4	69	173.4	-63.8	-173	171	0	0	112.5	N203	N203-E205 PolarHBondContact O-N 2.88Å
206	G	83.8	Confident	87.6	Confident	40 Å²	40	63 Å²	63	41%	0.412	34%	0.335	S	S	.	.	S	Bend	trans	-176.1	-171.2	-178.8	0	0	0	0	0	114.5	K182 F204	K182-G206 CarbonylContact O-C 3.46Å; K182-G206 VanDerWaalsContact O-CA 3.24Å; K182-G206 WeakPolarHBondContact O-CA 3.38Å; F204-G206 PolarHBondContact O-N 2.8Å
207	I	87.5	Confident	87.2	Confident	74 Å²	74	64.3 Å²	64.3	38%	0.379	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	110.5	174.1	-56	-179.3	0	0	0	108.9	K182 R183 M184	K182-I207 PolarHBondContact O-N 2.69Å; R183-I207 WeakPolarHBondContact CA-O 3.49Å; R183-I207 HydrophobicContact CG-CB 4.17Å; R183-I207 HydrophobicContact CG-CD1 4.43Å; R183-I207 HydrophobicContact CG-CG1 4.45Å; M184-I207 PolarHBondContact N-O 3.1Å
208	L	89.7	Confident	86.9	Confident	43 Å²	43	68.2 Å²	68.2	23%	0.225	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	113	171.4	172.8	55.3	0	0	0	109.8	M184 L186 V201 F204 I210	M184-L208 HydrophobicContact CE-CD1 3.77Å; M184-L208 HydrophobicContact CE-CD2 4.24Å; M184-L208 HydrophobicContact CE-CG 4.41Å; M184-L208 HydrophobicContact CG-CD1 3.87Å; M184-L208 WeakPolarHBondContact O-CA 3.4Å; L186-L208 HydrophobicContact CB-CD1 3.84Å; V201-L208 HydrophobicContact CB-CD2 4.44Å; V201-L208 HydrophobicContact CG2-CD2 3.9Å; F204-L208 HydrophobicContact CD1-CB 4.01Å; F204-L208 HydrophobicContact CE1-CB 4.33Å; L208-I210 HydrophobicContact CD1-CG1 4.44Å; L208-I210 HydrophobicContact CG-CG1 4.16Å
209	K	90.6	Very high	86.7	Confident	78 Å²	78	66.6 Å²	66.6	34%	0.339	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	144.1	165.6	-74.1	179.9	176.8	175.4	0	109.6	M184 T185 L186 E232	M184-K209 PolarHBondContact O-N 2.61Å; T185-K209 CarbonylContact C-O 3.59Å; T185-K209 WeakPolarHBondContact CA-O 3.37Å; T185-K209 HydrophobicContact CG2-CB 4.12Å; L186-K209 PolarHBondContact N-O 2.9Å; K209-E232 HydrophobicContact CD-CG 4.23Å; K209-E232 WeakPolarHBondContact CE-OE1 3.47Å; K209-E232 IonicContact NZ-OE1 2.64Å; K209-E232 PolarHBondContact NZ-OE1 3.14Å; K209-E232 IonicContact NZ-OE2 2.7Å; K209-E232 PolarHBondContact NZ-OE2 3.37Å
210	I	91.5	Very high	86.6	Confident	79 Å²	79	65.4 Å²	65.4	41%	0.405	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132	177.2	-58.8	179.1	0	0	0	108.8	L186 Y188 L194 L208	L186-I210 CarbonylContact O-C 3.59Å; L186-I210 WeakPolarHBondContact O-CA 3.33Å; Y188-I210 HydrophobicContact CD1-CG2 3.9Å; Y188-I210 HydrophobicContact CE1-CG2 3.69Å; L194-I210 HydrophobicContact CD2-CG2 4.27Å; L208-I210 HydrophobicContact CD1-CG1 4.44Å; L208-I210 HydrophobicContact CG-CG1 4.16Å
211	K	91.5	Very high	86.4	Confident	54 Å²	54	71.9 Å²	71.9	24%	0.235	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	140.2	-179	-69.8	-69.7	179.9	171.1	0	111.3	T185 L186 I187 Y188 M223 E226 L227	T185-K211 HydrophobicContact CG2-CB 4.43Å; T185-K211 HydrophobicContact CG2-CG 4.03Å; L186-K211 PolarHBondContact O-N 2.7Å; I187-K211 VanDerWaalsContact CA-O 3.3Å; I187-K211 WeakPolarHBondContact CA-O 3.48Å; Y188-K211 WeakPolarHBondContact CD1-O 3.05Å; Y188-K211 WeakPolarHBondContact CE1-O 3.49Å; Y188-K211 PolarHBondContact N-O 2.93Å; K211-M223 HydrophobicContact CB-SD 4Å; K211-E226 VanDerWaalsContact CE-OE1 3.29Å; K211-E226 WeakPolarHBondContact CE-OE1 3.34Å; K211-E226 WeakPolarHBondContact CE-OE2 3.33Å; K211-E226 IonicContact NZ-OE1 2.67Å; K211-E226 PolarHBondContact NZ-OE1 2.9Å; K211-E226 IonicContact NZ-OE2 2.77Å; K211-E226 PolarHBondContact NZ-OE2 3.5Å; K211-L227 HydrophobicContact CG-CD2 4.47Å
212	S	91.1	Very high	86.4	Confident	68 Å²	68	72 Å²	72	48%	0.476	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	133.5	170.7	51	0	0	0	0	110.7	Y188 D214	Y188-S212 CarbonylContact O-C 3.56Å; Y188-S212 WeakPolarHBondContact O-CA 3.49Å; S212-D214 PolarHBondContact O-N 3.12Å
213	W	90.4	Very high	86.5	Confident	18 Å²	18	66.6 Å²	66.6	7%	0.068	37%	0.368	C	S	.	.			trans	-77.6	115.8	168	177.5	-112.6	0	0	0	109.7	I187 Y188 A220 M223 M224 I239 Q243 F247	I187-W213 HydrophobicContact CG2-CB 3.99Å; Y188-W213 PolarHBondContact O-N 3.19Å; W213-A220 HydrophobicContact CH2-CB 3.73Å; W213-A220 HydrophobicContact CZ2-CB 4.36Å; W213-A220 HydrophobicContact CZ3-CB 3.85Å; W213-M223 HydrophobicContact CE3-CE 3.59Å; W213-M223 HydrophobicContact CZ3-CE 3.86Å; W213-M224 HydrophobicContact CZ3-CG 4.48Å; W213-I239 HydrophobicContact CB-CG2 3.83Å; W213-I239 HydrophobicContact CD2-CG2 4.43Å; W213-I239 HydrophobicContact CG-CG2 3.75Å; W213-Q243 VanDerWaalsContact CD1-OE1 3.29Å; W213-F247 HydrophobicContact CD2-CD2 4.35Å; W213-F247 AromaticContact CE3-CD2 3.81Å; W213-F247 HydrophobicContact CE3-CD2 3.81Å; W213-F247 HydrophobicContact CE3-CE2 4.28Å; W213-F247 HydrophobicContact CH2-CB 4.08Å; W213-F247 AromaticContact CH2-CD2 3.85Å; W213-F247 HydrophobicContact CH2-CD2 3.85Å; W213-F247 HydrophobicContact CH2-CG 4.41Å; W213-F247 HydrophobicContact CZ2-CB 4.19Å; W213-F247 HydrophobicContact CZ2-CD2 4.37Å; W213-F247 AromaticContact CZ3-CD2 3.54Å; W213-F247 HydrophobicContact CZ3-CD2 3.54Å; W213-F247 HydrophobicContact CZ3-CE2 4.16Å
214	D	85.2	Confident	86.6	Confident	59 Å²	59	62.8 Å²	62.8	32%	0.316	35%	0.348	S	S	.	.			trans	-88.3	128	169.3	-177	5.7	0	0	0	109.2	S212 N216 G219	S212-D214 PolarHBondContact O-N 3.12Å; D214-N216 PolarHBondContact O-N 2.96Å; D214-N216 WeakPolarHBondContact OD1-CB 3.4Å; D214-N216 PolarHBondContact OD1-N 3.1Å; D214-N216 PolarHBondContact OD1-ND2 3.45Å; D214-G219 WeakPolarHBondContact OD2-CA 3.38Å
215	E	78.2	Confident	86.7	Confident	123 Å²	123	63.8 Å²	63.8	58%	0.575	36%	0.361	S	S	*	.	S	Bend	trans	-71.7	-18.8	178.4	-52.6	-169.6	169.3	0	0	111.8	N189 Q243	N189-E215 PolarHBondContact ND2-OE1 2.68Å; E215-Q243 PolarHBondContact OE1-NE2 2.93Å
216	N	84	Confident	87.1	Confident	101 Å²	101	59.4 Å²	59.4	54%	0.54	34%	0.34	S	S	.	.	S	Bend	trans	-72.1	129.9	174.3	-62.1	-79.4	0	0	0	111.1	D214 S218 G219 A220	D214-N216 PolarHBondContact O-N 2.96Å; D214-N216 WeakPolarHBondContact OD1-CB 3.4Å; D214-N216 PolarHBondContact OD1-N 3.1Å; D214-N216 PolarHBondContact OD1-ND2 3.45Å; N216-S218 PolarHBondContact O-N 3.14Å; N216-G219 PolarHBondContact O-N 3.04Å; N216-A220 PolarHBondContact O-N 3.32Å
217	A	78.6	Confident	87.4	Confident	55 Å²	55	57.8 Å²	57.8	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-60	-17.9	-178	0	0	0	0	0	114.8	R221 M250	A217-R221 VanDerWaalsContact O-CB 3.22Å; A217-R221 WeakPolarHBondContact O-CB 3.37Å; A217-R221 PolarHBondContact O-N 2.91Å; A217-M250 HydrophobicContact CB-CE 4.29Å
218	S	84	Confident	87.2	Confident	83 Å²	83	55.1 Å²	55.1	58%	0.58	31%	0.313	S	S	*	.	H	α-helix	trans	-74.5	-52.3	171.2	43.7	0	0	0	0	112.3	N216 R221 A222	N216-S218 PolarHBondContact O-N 3.14Å; S218-R221 PolarHBondContact O-N 3.49Å; S218-A222 WeakPolarHBondContact O-CB 3.13Å; S218-A222 PolarHBondContact O-N 3.18Å
219	G	85.5	Confident	86.9	Confident	19 Å²	19	58 Å²	58	20%	0.196	34%	0.336	C	S	.	.	H	α-helix	trans	-67.2	-41.3	178.3	0	0	0	0	0	112.4	D214 N216 R221 A222 M223	D214-G219 WeakPolarHBondContact OD2-CA 3.38Å; N216-G219 PolarHBondContact O-N 3.04Å; G219-R221 PolarHBondContact O-N 3.21Å; G219-A222 PolarHBondContact O-N 3.05Å; G219-M223 WeakPolarHBondContact O-CB 3.49Å; G219-M223 PolarHBondContact O-N 2.94Å
220	A	84.8	Confident	86.5	Confident	3 Å²	3	54.9 Å²	54.9	3%	0.025	33%	0.327	C	S	.	.	H	α-helix	trans	-54.8	-49.2	171	0	0	0	0	0	111.8	W213 N216 M223 M224	W213-A220 HydrophobicContact CH2-CB 3.73Å; W213-A220 HydrophobicContact CZ2-CB 4.36Å; W213-A220 HydrophobicContact CZ3-CB 3.85Å; N216-A220 PolarHBondContact O-N 3.32Å; A220-M223 PolarHBondContact O-N 3.21Å; A220-M224 WeakPolarHBondContact O-CB 3.38Å; A220-M224 WeakPolarHBondContact O-CG 3.46Å; A220-M224 PolarHBondContact O-N 2.72Å
221	R	86.5	Confident	86	Confident	135 Å²	135	58 Å²	58	51%	0.509	34%	0.344	S	S	.	.	H	α-helix	trans	-63.6	-41.6	177.7	-175.9	-178.8	-65.1	123.2	2.7	112.6	A217 S218 G219 M224 A225	A217-R221 VanDerWaalsContact O-CB 3.22Å; A217-R221 WeakPolarHBondContact O-CB 3.37Å; A217-R221 PolarHBondContact O-N 2.91Å; S218-R221 PolarHBondContact O-N 3.49Å; G219-R221 PolarHBondContact O-N 3.21Å; R221-M224 PolarHBondContact O-N 2.96Å; R221-A225 WeakPolarHBondContact O-CB 3.47Å; R221-A225 PolarHBondContact O-N 2.9Å
222	A	88.2	Confident	85.6	Confident	66 Å²	66	56 Å²	56	55%	0.545	34%	0.335	S	S	.	.	H	α-helix	trans	-63.7	-45.3	177.9	0	0	0	0	0	111.6	S218 G219 A225 E226	S218-A222 WeakPolarHBondContact O-CB 3.13Å; S218-A222 PolarHBondContact O-N 3.18Å; G219-A222 PolarHBondContact O-N 3.05Å; A222-A225 PolarHBondContact O-N 3.32Å; A222-E226 PolarHBondContact O-N 3.42Å
223	M	89.9	Confident	85.5	Confident	14 Å²	14	54.8 Å²	54.8	7%	0.069	32%	0.321	C	S	.	.	H	α-helix	trans	-62.3	-48.7	175.4	-169.8	-164.5	71.4	0	0	111.1	I187 K211 W213 G219 A220 A225 E226 L227 F247	I187-M223 HydrophobicContact CD1-CE 4.07Å; I187-M223 HydrophobicContact CG2-CE 4.24Å; I187-M223 HydrophobicContact CG2-SD 4.32Å; K211-M223 HydrophobicContact CB-SD 4Å; W213-M223 HydrophobicContact CE3-CE 3.59Å; W213-M223 HydrophobicContact CZ3-CE 3.86Å; G219-M223 WeakPolarHBondContact O-CB 3.49Å; G219-M223 PolarHBondContact O-N 2.94Å; A220-M223 PolarHBondContact O-N 3.21Å; M223-A225 VanDerWaalsContact C-N 3.28Å; M223-A225 PolarHBondContact O-N 3.41Å; M223-E226 WeakPolarHBondContact O-CB 3.48Å; M223-E226 PolarHBondContact O-N 2.64Å; M223-E226 VanDerWaalsContact O-N 3.08Å; M223-L227 HydrophobicContact CE-CD1 3.85Å; M223-L227 HydrophobicContact CG-CD1 4.12Å; M223-L227 HydrophobicContact CG-CG 4.29Å; M223-L227 WeakPolarHBondContact O-CG 3.42Å; M223-L227 PolarHBondContact O-N 3.34Å; M223-L227 HydrophobicContact SD-CD1 4.28Å; M223-F247 HydrophobicContact CE-CE2 4.39Å
224	M	90.1	Very high	85.6	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-67.7	-27.3	-177	-63.4	-62.4	-80.8	0	0	112.8	W213 A220 R221 L227 G228 F247 M250 A251 H254 M256	W213-M224 HydrophobicContact CZ3-CG 4.48Å; A220-M224 WeakPolarHBondContact O-CB 3.38Å; A220-M224 WeakPolarHBondContact O-CG 3.46Å; A220-M224 PolarHBondContact O-N 2.72Å; R221-M224 PolarHBondContact O-N 2.96Å; M224-L227 HydrophobicContact SD-CD1 4.24Å; M224-G228 PolarHBondContact O-N 3.45Å; M224-F247 HydrophobicContact CE-CE2 4.3Å; M224-F247 HydrophobicContact CE-CZ 4.16Å; M224-F247 HydrophobicContact SD-CE2 4.03Å; M224-F247 HydrophobicContact SD-CZ 4.33Å; M224-M250 HydrophobicContact CG-CB 4.08Å; M224-A251 VanDerWaalsContact CE-CA 3.47Å; M224-A251 HydrophobicContact CE-CB 3.64Å; M224-H254 HydrophobicContact CB-CB 4.34Å; M224-M256 HydrophobicContact CE-CE 4.48Å; M224-M256 HydrophobicContact CE-SD 3.71Å; M224-M256 HydrophobicContact SD-SD 4.37Å
225	A	88.1	Confident	86	Confident	45 Å²	45	52.8 Å²	52.8	37%	0.372	31%	0.312	S	S	.	.	H	α-helix	trans	-65.7	-42.2	168.6	0	0	0	0	0	112.9	R221 A222 M223 S229	R221-A225 WeakPolarHBondContact O-CB 3.47Å; R221-A225 PolarHBondContact O-N 2.9Å; A222-A225 PolarHBondContact O-N 3.32Å; M223-A225 VanDerWaalsContact C-N 3.28Å; M223-A225 PolarHBondContact O-N 3.41Å; A225-S229 PolarHBondContact O-N 3.09Å; A225-S229 PolarHBondContact O-OG 3.13Å
226	E	89.3	Confident	86.8	Confident	90 Å²	90	46.9 Å²	46.9	42%	0.421	28%	0.284	S	S	.	.	H	α-helix	trans	-64.4	-41.3	174.3	-167.2	-165.3	156.5	0	0	111.6	K211 A222 M223 S229 G230	K211-E226 VanDerWaalsContact CE-OE1 3.29Å; K211-E226 WeakPolarHBondContact CE-OE1 3.34Å; K211-E226 WeakPolarHBondContact CE-OE2 3.33Å; K211-E226 IonicContact NZ-OE1 2.67Å; K211-E226 PolarHBondContact NZ-OE1 2.9Å; K211-E226 IonicContact NZ-OE2 2.77Å; K211-E226 PolarHBondContact NZ-OE2 3.5Å; A222-E226 PolarHBondContact O-N 3.42Å; M223-E226 WeakPolarHBondContact O-CB 3.48Å; M223-E226 PolarHBondContact O-N 2.64Å; M223-E226 VanDerWaalsContact O-N 3.08Å; E226-S229 PolarHBondContact O-OG 3.37Å; E226-G230 PolarHBondContact O-N 3.21Å; E226-G230 VanDerWaalsContact O-N 3.08Å
227	L	90.1	Very high	87.4	Confident	6 Å²	6	42.1 Å²	42.1	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-74.1	-35.5	-179.1	-60.3	-175.2	0	0	0	113	T185 I187 K211 M223 M224 G230 F235 M256	T185-L227 HydrophobicContact CG2-CD2 4.08Å; I187-L227 HydrophobicContact CD1-CD1 3.63Å; I187-L227 HydrophobicContact CG1-CD1 4.41Å; K211-L227 HydrophobicContact CG-CD2 4.47Å; M223-L227 HydrophobicContact CE-CD1 3.85Å; M223-L227 HydrophobicContact CG-CD1 4.12Å; M223-L227 HydrophobicContact CG-CG 4.29Å; M223-L227 WeakPolarHBondContact O-CG 3.42Å; M223-L227 PolarHBondContact O-N 3.34Å; M223-L227 HydrophobicContact SD-CD1 4.28Å; M224-L227 HydrophobicContact SD-CD1 4.24Å; L227-G230 PolarHBondContact O-N 2.95Å; L227-F235 HydrophobicContact CB-CE1 3.95Å; L227-F235 HydrophobicContact CB-CZ 4.14Å; L227-F235 HydrophobicContact CD1-CD1 4.2Å; L227-F235 HydrophobicContact CD1-CE1 3.77Å; L227-F235 HydrophobicContact CD2-CE1 4.09Å; L227-F235 HydrophobicContact CG-CE1 4.13Å; L227-M256 HydrophobicContact CB-CE 3.67Å; L227-M256 HydrophobicContact CB-SD 4.22Å
228	G	84.7	Confident	88.1	Confident	18 Å²	18	40 Å²	40	19%	0.186	24%	0.24	C	C	.	.	H	α-helix	trans	-66.5	-38.7	175.7	0	0	0	0	0	113	M224 G230 K233	M224-G228 PolarHBondContact O-N 3.45Å; G228-G230 VanDerWaalsContact C-N 3.3Å; G228-K233 PolarHBondContact O-NZ 3.11Å
229	S	83	Confident	88.5	Confident	103 Å²	103	36.1 Å²	36.1	72%	0.72	21%	0.213	S	C	*	.	H	α-helix	trans	-78.7	-10.7	173.8	55	0	0	0	0	113.9	A225 E226	A225-S229 PolarHBondContact O-N 3.09Å; A225-S229 PolarHBondContact O-OG 3.13Å; E226-S229 PolarHBondContact O-OG 3.37Å
230	G	81.9	Confident	88.7	Confident	14 Å²	14	36.2 Å²	36.2	14%	0.144	21%	0.21	C	C	.	.	S	Bend	trans	-72.4	155.2	177.7	0	0	0	0	0	114.5	E226 L227 G228 E232 K233	E226-G230 PolarHBondContact O-N 3.21Å; E226-G230 VanDerWaalsContact O-N 3.08Å; L227-G230 PolarHBondContact O-N 2.95Å; G228-G230 VanDerWaalsContact C-N 3.3Å; G230-E232 VanDerWaalsContact C-N 3.26Å; G230-K233 PolarHBondContact O-NZ 3.01Å
231	L	80.3	Confident	88.8	Confident	144 Å²	144	36.9 Å²	36.9	75%	0.754	21%	0.214	S	C	*	.	S	Bend	trans	-74.3	-17.5	171.7	-66.8	173.5	0	0	0	112.4	K233	L231-K233 PolarHBondContact O-N 3.16Å
232	E	83.1	Confident	88.8	Confident	12 Å²	12	39.1 Å²	39.1	6%	0.056	22%	0.223	C	C	.	.			trans	-78.1	117.3	177.8	-62.8	75.4	-165	0	0	110.7	K209 G230 F235	K209-E232 HydrophobicContact CD-CG 4.23Å; K209-E232 WeakPolarHBondContact CE-OE1 3.47Å; K209-E232 IonicContact NZ-OE1 2.64Å; K209-E232 PolarHBondContact NZ-OE1 3.14Å; K209-E232 IonicContact NZ-OE2 2.7Å; K209-E232 PolarHBondContact NZ-OE2 3.37Å; G230-E232 VanDerWaalsContact C-N 3.26Å; E232-F235 WeakPolarHBondContact O-CE2 3.38Å; E232-F235 WeakPolarHBondContact O-CZ 3.28Å
233	K	88.5	Confident	88.9	Confident	43 Å²	43	36.7 Å²	36.7	19%	0.187	20%	0.2	C	C	.	.			trans	-106.2	0.9	174.7	-51	-56.7	-178.7	-164.6	0	113.6	G228 G230 L231 Q260 Y261 T262	G228-K233 PolarHBondContact O-NZ 3.11Å; G230-K233 PolarHBondContact O-NZ 3.01Å; L231-K233 PolarHBondContact O-N 3.16Å; K233-Q260 HydrophobicContact CB-CG 4.42Å; K233-Q260 WeakPolarHBondContact CB-O 3.4Å; K233-Q260 HydrophobicContact CD-CG 4.26Å; K233-Q260 HydrophobicContact CG-CG 4.01Å; K233-Y261 HydrophobicContact CB-CD1 4.49Å; K233-Y261 HydrophobicContact CD-CD1 4.11Å; K233-Y261 HydrophobicContact CD-CE1 3.53Å; K233-Y261 HydrophobicContact CD-CE2 4.29Å; K233-Y261 PolarHBondContact NZ-OH 2.89Å; K233-Y261 WeakPolarHBondContact O-CA 3.26Å; K233-T262 PolarHBondContact O-N 3.4Å
234	N	93.1	Very high	88.9	Confident	33 Å²	33	36 Å²	36	18%	0.176	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.9	-179.8	-64.5	-38.7	0	0	0	110.9	W181 R183 M184 T185	W181-N234 HydrophobicContact CD2-CB 3.69Å; W181-N234 VanDerWaalsContact CE2-CG 3.48Å; W181-N234 HydrophobicContact CE3-CB 3.88Å; W181-N234 HydrophobicContact CG-CB 4.28Å; W181-N234 HydrophobicContact CH2-CB 3.86Å; W181-N234 HydrophobicContact CZ2-CB 3.69Å; W181-N234 HydrophobicContact CZ3-CB 3.96Å; W181-N234 PolarHBondContact NE1-OD1 3.32Å; R183-N234 WeakPolarHBondContact O-CB 3.16Å; R183-N234 PolarHBondContact O-ND2 3.15Å; M184-N234 WeakPolarHBondContact CA-O 3.34Å; M184-N234 HydrophobicContact CB-CB 4.21Å; T185-N234 PolarHBondContact N-O 3Å
235	F	94.9	Very high	88.8	Confident	1 Å²	1	39 Å²	39	0%	0.004	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	125.3	-173.7	-61.7	-81.3	0	0	0	111.3	T185 I187 L227 E232 V237 M256 Y261 T262 F263 I264	T185-F235 HydrophobicContact CG2-CD1 4.36Å; T185-F235 HydrophobicContact CG2-CE1 4.44Å; T185-F235 WeakPolarHBondContact O-CA 3.13Å; I187-F235 HydrophobicContact CD1-CD1 4.04Å; L227-F235 HydrophobicContact CB-CE1 3.95Å; L227-F235 HydrophobicContact CB-CZ 4.14Å; L227-F235 HydrophobicContact CD1-CD1 4.2Å; L227-F235 HydrophobicContact CD1-CE1 3.77Å; L227-F235 HydrophobicContact CD2-CE1 4.09Å; L227-F235 HydrophobicContact CG-CE1 4.13Å; E232-F235 WeakPolarHBondContact O-CE2 3.38Å; E232-F235 WeakPolarHBondContact O-CZ 3.28Å; F235-V237 HydrophobicContact CB-CG2 4.05Å; F235-M256 HydrophobicContact CD2-CE 4.46Å; F235-M256 HydrophobicContact CE1-CE 4.17Å; F235-M256 HydrophobicContact CE2-CE 3.66Å; F235-M256 HydrophobicContact CZ-CE 3.48Å; F235-M256 VanDerWaalsContact CZ-CE 3.48Å; F235-Y261 AromaticContact CE2-CD1 3.91Å; F235-Y261 HydrophobicContact CE2-CD1 3.91Å; F235-Y261 HydrophobicContact CE2-CE1 4.32Å; F235-T262 PolarHBondContact N-O 2.98Å; F235-F263 HydrophobicContact CB-CD1 3.62Å; F235-F263 HydrophobicContact CB-CE1 4.03Å; F235-F263 AromaticContact CD2-CD1 3.96Å; F235-F263 HydrophobicContact CD2-CD1 3.96Å; F235-F263 AromaticContact CD2-CE1 3.6Å; F235-F263 HydrophobicContact CD2-CE1 3.6Å; F235-F263 HydrophobicContact CD2-CZ 4.21Å; F235-F263 HydrophobicContact CE2-CE1 4.33Å; F235-F263 HydrophobicContact CG-CD1 4Å; F235-F263 AromaticContact CG-CE1 3.87Å; F235-F263 HydrophobicContact CG-CE1 3.87Å; F235-F263 WeakPolarHBondContact O-CA 3.35Å; F235-I264 PolarHBondContact O-N 2.95Å
236	L	95	Very high	88.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	121.7	170.4	-179.5	65.5	0	0	0	107.6	L171 L175 W181 T185 L186 I187 F197 L200 I264 T266	L171-L236 HydrophobicContact CD1-CD1 4.28Å; L171-L236 HydrophobicContact CD2-CD2 4.29Å; L175-L236 HydrophobicContact CD1-CD2 4.05Å; W181-L236 HydrophobicContact CZ3-CB 4.36Å; T185-L236 PolarHBondContact O-N 2.9Å; L186-L236 CarbonylContact C-O 3.48Å; L186-L236 WeakPolarHBondContact CA-O 3.48Å; L186-L236 HydrophobicContact CD1-CB 4.36Å; L186-L236 HydrophobicContact CD1-CD2 3.99Å; L186-L236 HydrophobicContact CD1-CG 4.03Å; I187-L236 PolarHBondContact N-O 3.27Å; F197-L236 HydrophobicContact CD1-CD2 4.34Å; F197-L236 HydrophobicContact CE1-CD2 4.33Å; L200-L236 HydrophobicContact CD2-CD2 3.55Å; L236-I264 CarbonylContact C-O 3.29Å; L236-I264 WeakPolarHBondContact CA-O 3.4Å; L236-I264 HydrophobicContact CD1-CB 4.21Å; L236-I264 HydrophobicContact CD1-CG2 3.99Å; L236-T266 HydrophobicContact CD1-CG2 3.61Å; L236-T266 HydrophobicContact CG-CG2 4.35Å
237	V	94.8	Very high	89	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	106.2	-162.8	-169.2	0	0	0	0	111.9	I187 F235 I239 F247 F263 I264 F265 T266	I187-V237 HydrophobicContact CB-CG1 4.31Å; I187-V237 HydrophobicContact CB-CG2 4.5Å; I187-V237 HydrophobicContact CD1-CG2 4.29Å; I187-V237 HydrophobicContact CG2-CG1 4.47Å; F235-V237 HydrophobicContact CB-CG2 4.05Å; V237-I239 HydrophobicContact CG1-CB 4.42Å; V237-I239 HydrophobicContact CG1-CD1 3.83Å; V237-I239 HydrophobicContact CG1-CG1 3.87Å; V237-I239 HydrophobicContact CG1-CG2 3.93Å; V237-F247 HydrophobicContact CG1-CD2 4.37Å; V237-F247 HydrophobicContact CG1-CE1 4.46Å; V237-F247 HydrophobicContact CG1-CE2 4.1Å; V237-F247 HydrophobicContact CG1-CZ 4.15Å; V237-F247 HydrophobicContact CG2-CE1 4.3Å; V237-F247 HydrophobicContact CG2-CZ 3.97Å; V237-F263 HydrophobicContact CG2-CD1 4.46Å; V237-I264 PolarHBondContact N-O 3.25Å; V237-F265 HydrophobicContact CB-CD1 3.62Å; V237-F265 HydrophobicContact CB-CE1 3.87Å; V237-F265 HydrophobicContact CB-CG 4.3Å; V237-F265 HydrophobicContact CG1-CD1 3.74Å; V237-F265 HydrophobicContact CG1-CE1 3.7Å; V237-F265 HydrophobicContact CG2-CD1 4.43Å; V237-F265 HydrophobicContact CG2-CE1 4.32Å; V237-F265 WeakPolarHBondContact O-CA 3.27Å; V237-T266 PolarHBondContact O-N 3.33Å; V237-T266 VanDerWaalsContact O-N 3.13Å; V237-T266 PolarHBondContact O-OG1 2.88Å
238	D	93.6	Very high	89	Confident	10 Å²	10	37.3 Å²	37.3	5%	0.053	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	71.1	177	-160.9	67.6	0	0	0	110.8	I187 N189 S193 K196 F197 T266	I187-D238 PolarHBondContact O-N 3.29Å; N189-D238 PolarHBondContact N-O 3.41Å; S193-D238 WeakPolarHBondContact CB-OD2 3.08Å; S193-D238 PolarHBondContact OG-OD2 3.26Å; K196-D238 IonicContact NZ-OD1 2.68Å; K196-D238 PolarHBondContact NZ-OD1 3.04Å; K196-D238 IonicContact NZ-OD2 2.7Å; K196-D238 PolarHBondContact NZ-OD2 3.3Å; F197-D238 HydrophobicContact CE2-CB 3.74Å; F197-D238 HydrophobicContact CZ-CB 3.76Å; D238-T266 WeakPolarHBondContact CA-OG1 3.36Å; D238-T266 VanDerWaalsContact CB-OG1 3.26Å; D238-T266 WeakPolarHBondContact CB-OG1 3.21Å; D238-T266 PolarHBondContact OD1-OG1 3.26Å
239	I	91.9	Very high	89.2	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.015	21%	0.214	C	C	.	.			trans	-117.9	148.4	171.3	70.4	-175.2	0	0	0	108.9	N189 W213 V237 Q243 V244 F247 F265	N189-I239 HydrophobicContact CB-CG2 4.38Å; W213-I239 HydrophobicContact CB-CG2 3.83Å; W213-I239 HydrophobicContact CD2-CG2 4.43Å; W213-I239 HydrophobicContact CG-CG2 3.75Å; V237-I239 HydrophobicContact CG1-CB 4.42Å; V237-I239 HydrophobicContact CG1-CD1 3.83Å; V237-I239 HydrophobicContact CG1-CG1 3.87Å; V237-I239 HydrophobicContact CG1-CG2 3.93Å; I239-Q243 HydrophobicContact CD1-CB 4.41Å; I239-V244 HydrophobicContact CD1-CG2 4.1Å; I239-V244 HydrophobicContact CG1-CG2 3.87Å; I239-F247 HydrophobicContact CD1-CB 3.45Å; I239-F247 VanDerWaalsContact CD1-CB 3.45Å; I239-F247 HydrophobicContact CD1-CD1 4.49Å; I239-F247 HydrophobicContact CD1-CD2 3.87Å; I239-F247 HydrophobicContact CD1-CG 3.69Å; I239-F265 HydrophobicContact CD1-CE1 4.21Å; I239-F265 HydrophobicContact CG1-CD1 4.5Å
240	P	89.9	Confident	89.5	Confident	21 Å²	21	36.5 Å²	36.5	14%	0.136	19%	0.187	C	C	.	.			trans	-64.7	148.4	180	27.5	-35.6	0	0	0	111.9	W242 Q243 D267	P240-W242 VanDerWaalsContact C-N 3.29Å; P240-W242 HydrophobicContact CB-CD2 3.84Å; P240-W242 HydrophobicContact CB-CE3 3.79Å; P240-W242 HydrophobicContact CB-CH2 3.47Å; P240-W242 VanDerWaalsContact CB-CH2 3.47Å; P240-W242 HydrophobicContact CB-CZ2 3.5Å; P240-W242 VanDerWaalsContact CB-CZ2 3.5Å; P240-W242 HydrophobicContact CB-CZ3 3.61Å; P240-W242 HydrophobicContact CG-CD2 4.21Å; P240-W242 HydrophobicContact CG-CH2 4.12Å; P240-W242 HydrophobicContact CG-CZ2 3.62Å; P240-W242 PolarHBondContact O-N 2.84Å; P240-W242 VanDerWaalsContact O-N 3.11Å; P240-Q243 HydrophobicContact CG-CB 4.35Å; P240-Q243 HydrophobicContact CG-CG 4.01Å; P240-Q243 PolarHBondContact O-N 3.21Å; P240-D267 WeakPolarHBondContact CA-OD2 3.42Å
241	S	88.2	Confident	89.8	Confident	16 Å²	16	35.8 Å²	35.8	11%	0.112	18%	0.18	C	C	.	.	H	α-helix	trans	-45.6	-45.3	-175.6	57	0	0	0	0	114.6	Q243 V244 D267 L273	S241-Q243 PolarHBondContact O-N 3.21Å; S241-Q243 VanDerWaalsContact O-N 3.14Å; S241-V244 WeakPolarHBondContact O-CB 3.19Å; S241-V244 PolarHBondContact O-N 3.03Å; S241-V244 VanDerWaalsContact O-N 3.11Å; S241-D267 PolarHBondContact N-OD2 2.93Å; S241-D267 VanDerWaalsContact N-OD2 3.16Å; S241-L273 VanDerWaalsContact O-CD1 3.26Å; S241-L273 WeakPolarHBondContact O-CD1 3.37Å
242	W	86.5	Confident	90.2	Very high	183 Å²	183	36.6 Å²	36.6	69%	0.693	17%	0.174	S	C	*	.	H	α-helix	trans	-64.6	-16.7	-179.4	63.1	89.5	0	0	0	115	P240	P240-W242 VanDerWaalsContact C-N 3.29Å; P240-W242 HydrophobicContact CB-CD2 3.84Å; P240-W242 HydrophobicContact CB-CE3 3.79Å; P240-W242 HydrophobicContact CB-CH2 3.47Å; P240-W242 VanDerWaalsContact CB-CH2 3.47Å; P240-W242 HydrophobicContact CB-CZ2 3.5Å; P240-W242 VanDerWaalsContact CB-CZ2 3.5Å; P240-W242 HydrophobicContact CB-CZ3 3.61Å; P240-W242 HydrophobicContact CG-CD2 4.21Å; P240-W242 HydrophobicContact CG-CH2 4.12Å; P240-W242 HydrophobicContact CG-CZ2 3.62Å; P240-W242 PolarHBondContact O-N 2.84Å; P240-W242 VanDerWaalsContact O-N 3.11Å
243	Q	89.8	Confident	90.4	Very high	15 Å²	15	40.4 Å²	40.4	7%	0.07	20%	0.199	C	C	.	.	H	α-helix	trans	-92.5	-14.5	175.8	-68.3	177.9	-0.7	0	0	113.5	N189 W213 E215 I239 P240 S241 T245 N246 F247	N189-Q243 PolarHBondContact ND2-OE1 3.38Å; W213-Q243 VanDerWaalsContact CD1-OE1 3.29Å; E215-Q243 PolarHBondContact OE1-NE2 2.93Å; I239-Q243 HydrophobicContact CD1-CB 4.41Å; P240-Q243 HydrophobicContact CG-CB 4.35Å; P240-Q243 HydrophobicContact CG-CG 4.01Å; P240-Q243 PolarHBondContact O-N 3.21Å; S241-Q243 PolarHBondContact O-N 3.21Å; S241-Q243 VanDerWaalsContact O-N 3.14Å; Q243-T245 VanDerWaalsContact C-N 3.31Å; Q243-T245 PolarHBondContact O-N 2.98Å; Q243-N246 PolarHBondContact O-N 3.35Å; Q243-N246 VanDerWaalsContact O-N 3.08Å; Q243-F247 PolarHBondContact O-N 2.97Å
244	V	90.5	Very high	90.4	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.6	-37.7	-174.1	174.3	0	0	0	0	112.3	I239 S241 N246 F247 L248 F265 I270 L273	I239-V244 HydrophobicContact CD1-CG2 4.1Å; I239-V244 HydrophobicContact CG1-CG2 3.87Å; S241-V244 WeakPolarHBondContact O-CB 3.19Å; S241-V244 PolarHBondContact O-N 3.03Å; S241-V244 VanDerWaalsContact O-N 3.11Å; V244-N246 PolarHBondContact O-N 3.42Å; V244-F247 PolarHBondContact O-N 2.95Å; V244-L248 HydrophobicContact CG1-CD1 3.86Å; V244-L248 HydrophobicContact CG1-CG 4.32Å; V244-L248 WeakPolarHBondContact O-CB 3.34Å; V244-L248 WeakPolarHBondContact O-CG 3.33Å; V244-L248 PolarHBondContact O-N 3.07Å; V244-F265 HydrophobicContact CB-CE1 4.46Å; V244-F265 HydrophobicContact CG1-CD1 4.17Å; V244-F265 HydrophobicContact CG1-CE1 3.8Å; V244-F265 HydrophobicContact CG1-CE2 4.39Å; V244-F265 HydrophobicContact CG1-CZ 3.93Å; V244-F265 HydrophobicContact CG2-CD1 3.98Å; V244-F265 HydrophobicContact CG2-CE1 4.13Å; V244-I270 HydrophobicContact CG2-CD1 3.63Å; V244-I270 HydrophobicContact CG2-CG1 3.94Å; V244-L273 HydrophobicContact CB-CD1 4.03Å; V244-L273 HydrophobicContact CG1-CD1 4.38Å
245	T	88.3	Confident	90	Very high	61 Å²	61	45 Å²	45	37%	0.374	22%	0.224	S	C	.	.	H	α-helix	trans	-60.9	-44.4	174.9	-48.9	0	0	0	0	111.6	Q243 L248 V249	Q243-T245 VanDerWaalsContact C-N 3.31Å; Q243-T245 PolarHBondContact O-N 2.98Å; T245-L248 PolarHBondContact O-N 3.38Å; T245-V249 VanDerWaalsContact O-CG2 3.3Å; T245-V249 WeakPolarHBondContact O-CG2 3.15Å; T245-V249 PolarHBondContact O-N 3.49Å
246	N	88.2	Confident	89.7	Confident	103 Å²	103	45 Å²	45	55%	0.551	22%	0.224	S	C	*	.	H	α-helix	trans	-67.7	-39.7	178.4	-69.3	-13.3	0	0	0	111.7	Q243 V244 V249 M250	Q243-N246 PolarHBondContact O-N 3.35Å; Q243-N246 VanDerWaalsContact O-N 3.08Å; V244-N246 PolarHBondContact O-N 3.42Å; N246-V249 PolarHBondContact O-N 2.99Å; N246-M250 WeakPolarHBondContact O-CG 3.37Å; N246-M250 PolarHBondContact O-N 2.89Å
247	F	91.8	Very high	89.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-60	-47.9	174.3	178.5	-84.8	0	0	0	111.9	I187 W213 M223 M224 V237 I239 Q243 V244 M250 A251 F263 F265	I187-F247 HydrophobicContact CD1-CE2 3.73Å; I187-F247 HydrophobicContact CD1-CZ 3.82Å; I187-F247 HydrophobicContact CG2-CE2 4.49Å; W213-F247 HydrophobicContact CD2-CD2 4.35Å; W213-F247 AromaticContact CE3-CD2 3.81Å; W213-F247 HydrophobicContact CE3-CD2 3.81Å; W213-F247 HydrophobicContact CE3-CE2 4.28Å; W213-F247 HydrophobicContact CH2-CB 4.08Å; W213-F247 AromaticContact CH2-CD2 3.85Å; W213-F247 HydrophobicContact CH2-CD2 3.85Å; W213-F247 HydrophobicContact CH2-CG 4.41Å; W213-F247 HydrophobicContact CZ2-CB 4.19Å; W213-F247 HydrophobicContact CZ2-CD2 4.37Å; W213-F247 AromaticContact CZ3-CD2 3.54Å; W213-F247 HydrophobicContact CZ3-CD2 3.54Å; W213-F247 HydrophobicContact CZ3-CE2 4.16Å; M223-F247 HydrophobicContact CE-CE2 4.39Å; M224-F247 HydrophobicContact CE-CE2 4.3Å; M224-F247 HydrophobicContact CE-CZ 4.16Å; M224-F247 HydrophobicContact SD-CE2 4.03Å; M224-F247 HydrophobicContact SD-CZ 4.33Å; V237-F247 HydrophobicContact CG1-CD2 4.37Å; V237-F247 HydrophobicContact CG1-CE1 4.46Å; V237-F247 HydrophobicContact CG1-CE2 4.1Å; V237-F247 HydrophobicContact CG1-CZ 4.15Å; V237-F247 HydrophobicContact CG2-CE1 4.3Å; V237-F247 HydrophobicContact CG2-CZ 3.97Å; I239-F247 HydrophobicContact CD1-CB 3.45Å; I239-F247 VanDerWaalsContact CD1-CB 3.45Å; I239-F247 HydrophobicContact CD1-CD1 4.49Å; I239-F247 HydrophobicContact CD1-CD2 3.87Å; I239-F247 HydrophobicContact CD1-CG 3.69Å; Q243-F247 PolarHBondContact O-N 2.97Å; V244-F247 PolarHBondContact O-N 2.95Å; F247-M250 PolarHBondContact O-N 3.34Å; F247-A251 PolarHBondContact O-N 3.49Å; F247-F263 AromaticContact CE1-CD1 3.7Å; F247-F263 HydrophobicContact CE1-CD1 3.7Å; F247-F263 AromaticContact CE1-CE1 3.8Å; F247-F263 HydrophobicContact CE1-CE1 3.8Å; F247-F263 HydrophobicContact CZ-CD1 4.09Å; F247-F263 HydrophobicContact CZ-CE1 4.02Å; F247-F265 AromaticContact CD1-CE1 3.8Å; F247-F265 HydrophobicContact CD1-CE1 3.8Å; F247-F265 AromaticContact CD1-CZ 3.75Å; F247-F265 HydrophobicContact CD1-CZ 3.75Å; F247-F265 HydrophobicContact CE1-CE1 4.11Å; F247-F265 AromaticContact CE1-CZ 3.94Å; F247-F265 HydrophobicContact CE1-CZ 3.94Å; F247-F265 HydrophobicContact CG-CE1 4.44Å
248	L	90.3	Very high	88.5	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-68.7	-33.3	179.6	-70	172	0	0	0	112.7	V244 T245 A251 Y252 F265 L275 F278 I286	V244-L248 HydrophobicContact CG1-CD1 3.86Å; V244-L248 HydrophobicContact CG1-CG 4.32Å; V244-L248 WeakPolarHBondContact O-CB 3.34Å; V244-L248 WeakPolarHBondContact O-CG 3.33Å; V244-L248 PolarHBondContact O-N 3.07Å; T245-L248 PolarHBondContact O-N 3.38Å; L248-A251 WeakPolarHBondContact O-CB 3.34Å; L248-A251 PolarHBondContact O-N 3.39Å; L248-Y252 PolarHBondContact O-N 3.48Å; L248-F265 HydrophobicContact CD1-CZ 4.46Å; L248-F265 HydrophobicContact CD2-CE2 4.17Å; L248-F265 HydrophobicContact CD2-CZ 3.83Å; L248-F265 HydrophobicContact CG-CZ 4.07Å; L248-L275 HydrophobicContact CD1-CD1 4.14Å; L248-L275 HydrophobicContact CD1-CD2 3.93Å; L248-F278 HydrophobicContact CB-CD1 4.33Å; L248-F278 HydrophobicContact CB-CD2 4.24Å; L248-F278 HydrophobicContact CB-CE1 3.8Å; L248-F278 HydrophobicContact CB-CE2 3.69Å; L248-F278 HydrophobicContact CB-CZ 3.45Å; L248-F278 VanDerWaalsContact CB-CZ 3.45Å; L248-F278 HydrophobicContact CD1-CD2 3.98Å; L248-F278 HydrophobicContact CD1-CE2 4.12Å; L248-F278 HydrophobicContact CD1-CG 4.39Å; L248-I286 HydrophobicContact CD1-CD1 4.08Å; L248-I286 HydrophobicContact CD2-CD1 3.78Å; L248-I286 HydrophobicContact CD2-CG1 4.14Å
249	V	89.2	Confident	88	Confident	69 Å²	69	53.2 Å²	53.2	42%	0.418	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-41.9	170.2	168	0	0	0	0	111.2	T245 N246 Y252 V253 F278	T245-V249 VanDerWaalsContact O-CG2 3.3Å; T245-V249 WeakPolarHBondContact O-CG2 3.15Å; T245-V249 PolarHBondContact O-N 3.49Å; N246-V249 PolarHBondContact O-N 2.99Å; V249-Y252 PolarHBondContact O-N 2.86Å; V249-V253 WeakPolarHBondContact O-CG2 3.49Å; V249-V253 PolarHBondContact O-N 2.96Å; V249-F278 HydrophobicContact CG2-CZ 4.28Å
250	M	89	Confident	87.6	Confident	34 Å²	34	55.7 Å²	55.7	17%	0.167	28%	0.278	C	S	.	.	H	α-helix	trans	-66.5	-36.8	174	-66.6	-67.1	178.6	0	0	111.9	A217 M224 N246 F247 Y252 V253 H254	A217-M250 HydrophobicContact CB-CE 4.29Å; M224-M250 HydrophobicContact CG-CB 4.08Å; N246-M250 WeakPolarHBondContact O-CG 3.37Å; N246-M250 PolarHBondContact O-N 2.89Å; F247-M250 PolarHBondContact O-N 3.34Å; M250-Y252 VanDerWaalsContact C-N 3.34Å; M250-Y252 PolarHBondContact O-N 3.01Å; M250-V253 PolarHBondContact O-N 2.66Å; M250-H254 PolarHBondContact O-CD2 3.48Å; M250-H254 VanDerWaalsContact O-CD2 3.3Å; M250-H254 PolarHBondContact O-N 3Å
251	A	89.7	Confident	87.6	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-43	173.2	0	0	0	0	0	111.9	M224 F247 L248 H254 N255 M256 F263	M224-A251 VanDerWaalsContact CE-CA 3.47Å; M224-A251 HydrophobicContact CE-CB 3.64Å; F247-A251 PolarHBondContact O-N 3.49Å; L248-A251 WeakPolarHBondContact O-CB 3.34Å; L248-A251 PolarHBondContact O-N 3.39Å; A251-H254 CarbonylContact O-C 3.49Å; A251-H254 PolarHBondContact O-N 3.26Å; A251-N255 PolarHBondContact O-N 2.91Å; A251-M256 HydrophobicContact CB-CB 4.16Å; A251-M256 WeakPolarHBondContact O-CB 3.47Å; A251-M256 PolarHBondContact O-N 3.22Å; A251-F263 HydrophobicContact CB-CZ 4.12Å
252	Y	88.3	Confident	87.8	Confident	160 Å²	160	54.6 Å²	54.6	63%	0.627	27%	0.269	S	S	*	.	H	α-helix	trans	-61.8	-46.5	173.5	178.6	-95.4	0	0	0	112.3	L248 V249 M250 H254 N255 T257	L248-Y252 PolarHBondContact O-N 3.48Å; V249-Y252 PolarHBondContact O-N 2.86Å; M250-Y252 VanDerWaalsContact C-N 3.34Å; M250-Y252 PolarHBondContact O-N 3.01Å; Y252-H254 PolarHBondContact O-N 3.08Å; Y252-N255 PolarHBondContact O-N 2.93Å; Y252-T257 HydrophobicContact CD2-CG2 4.21Å
253	V	87.8	Confident	88.1	Confident	93 Å²	93	46 Å²	46	56%	0.564	24%	0.236	S	C	*	.	H	α-helix	trans	-59.7	-32.2	177.5	168.8	0	0	0	0	112.6	V249 M250	V249-V253 WeakPolarHBondContact O-CG2 3.49Å; V249-V253 PolarHBondContact O-N 2.96Å; M250-V253 PolarHBondContact O-N 2.66Å
254	H	87	Confident	88.4	Confident	46 Å²	46	45.2 Å²	45.2	21%	0.213	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	16.1	177.4	-73.4	-86.1	0	0	0	114.2	M224 M250 A251 Y252 M256	M224-H254 HydrophobicContact CB-CB 4.34Å; M250-H254 PolarHBondContact O-CD2 3.48Å; M250-H254 VanDerWaalsContact O-CD2 3.3Å; M250-H254 PolarHBondContact O-N 3Å; A251-H254 CarbonylContact O-C 3.49Å; A251-H254 PolarHBondContact O-N 3.26Å; Y252-H254 PolarHBondContact O-N 3.08Å; H254-M256 HydrophobicContact CB-CG 4.19Å; H254-M256 HydrophobicContact CB-SD 4.33Å; H254-M256 PolarHBondContact O-N 3.24Å
255	N	85.4	Confident	88.5	Confident	127 Å²	127	45.2 Å²	45.2	68%	0.679	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.7	28.5	-179.9	-163.2	32	0	0	0	114.4	A251 Y252 T257	A251-N255 PolarHBondContact O-N 2.91Å; Y252-N255 PolarHBondContact O-N 2.93Å; N255-T257 PolarHBondContact O-N 3.49Å
256	M	87.7	Confident	88.7	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	23.6	177	-58	178.7	69.8	0	0	112.4	M224 L227 F235 A251 H254 Y261 F263	M224-M256 HydrophobicContact CE-CE 4.48Å; M224-M256 HydrophobicContact CE-SD 3.71Å; M224-M256 HydrophobicContact SD-SD 4.37Å; L227-M256 HydrophobicContact CB-CE 3.67Å; L227-M256 HydrophobicContact CB-SD 4.22Å; F235-M256 HydrophobicContact CD2-CE 4.46Å; F235-M256 HydrophobicContact CE1-CE 4.17Å; F235-M256 HydrophobicContact CE2-CE 3.66Å; F235-M256 HydrophobicContact CZ-CE 3.48Å; F235-M256 VanDerWaalsContact CZ-CE 3.48Å; A251-M256 HydrophobicContact CB-CB 4.16Å; A251-M256 WeakPolarHBondContact O-CB 3.47Å; A251-M256 PolarHBondContact O-N 3.22Å; H254-M256 HydrophobicContact CB-CG 4.19Å; H254-M256 HydrophobicContact CB-SD 4.33Å; H254-M256 PolarHBondContact O-N 3.24Å; M256-Y261 HydrophobicContact CB-CD1 3.82Å; M256-Y261 HydrophobicContact CB-CE1 3.74Å; M256-Y261 HydrophobicContact CB-CG 4.3Å; M256-Y261 HydrophobicContact CE-CD1 4.14Å; M256-Y261 HydrophobicContact CE-CE1 3.87Å; M256-Y261 HydrophobicContact CG-CD1 4.36Å; M256-Y261 HydrophobicContact CG-CE1 3.81Å; M256-Y261 VanDerWaalsContact O-CB 3.32Å; M256-Y261 WeakPolarHBondContact O-CB 3.2Å; M256-Y261 VanDerWaalsContact O-CG 3.24Å; M256-F263 HydrophobicContact CB-CZ 4.18Å; M256-F263 HydrophobicContact CE-CZ 4.4Å; M256-F263 WeakPolarHBondContact O-CE2 3.22Å
257	T	84.7	Confident	88.9	Confident	36 Å²	36	39 Å²	39	22%	0.221	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	4.5	-177.7	44.5	0	0	0	0	114	Y252 N255 G283 A284	Y252-T257 HydrophobicContact CD2-CG2 4.21Å; N255-T257 PolarHBondContact O-N 3.49Å; T257-G283 CarbonylContact O-C 3.3Å; T257-G283 VanDerWaalsContact O-CA 3.29Å; T257-G283 WeakPolarHBondContact O-CA 3.49Å; T257-A284 PolarHBondContact O-N 3.24Å
258	G	80.9	Confident	88.7	Confident	24 Å²	24	39.8 Å²	39.8	25%	0.247	20%	0.2	C	C	.	.	S	Bend	trans	-67.3	161	173	0	0	0	0	0	113.6	Q260 Y261 A284	G258-Q260 VanDerWaalsContact C-OE1 3.25Å; G258-Q260 PolarHBondContact O-N 2.89Å; G258-Q260 VanDerWaalsContact O-N 3.16Å; G258-Y261 WeakPolarHBondContact O-CB 3.38Å; G258-Y261 PolarHBondContact O-N 3.4Å; G258-A284 WeakPolarHBondContact O-CA 3.46Å; G258-A284 PolarHBondContact O-N 3.43Å
259	Y	83.2	Confident	88.6	Confident	123 Å²	123	40.7 Å²	40.7	48%	0.482	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.4	-173.1	71.5	-87.8	0	0	0	114.7	Y261	Y259-Y261 VanDerWaalsContact C-N 3.29Å
260	Q	82.6	Confident	88.4	Confident	54 Å²	54	37.4 Å²	37.4	25%	0.252	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-22.1	175.5	69.6	-85.8	61.9	0	0	112.8	K233 G258 E533	K233-Q260 HydrophobicContact CB-CG 4.42Å; K233-Q260 WeakPolarHBondContact CB-O 3.4Å; K233-Q260 HydrophobicContact CD-CG 4.26Å; K233-Q260 HydrophobicContact CG-CG 4.01Å; G258-Q260 VanDerWaalsContact C-OE1 3.25Å; G258-Q260 PolarHBondContact O-N 2.89Å; G258-Q260 VanDerWaalsContact O-N 3.16Å; Q260-E533 PolarHBondContact NE2-OE2 3.34Å
261	Y	90.1	Very high	87.9	Confident	15 Å²	15	36.4 Å²	36.4	6%	0.059	18%	0.182	C	C	.	.			trans	-77.3	134.9	-179.6	-67.6	-90.9	0	0	0	111.5	K233 F235 M256 G258 Y259 F263 A284 R285	K233-Y261 HydrophobicContact CB-CD1 4.49Å; K233-Y261 HydrophobicContact CD-CD1 4.11Å; K233-Y261 HydrophobicContact CD-CE1 3.53Å; K233-Y261 HydrophobicContact CD-CE2 4.29Å; K233-Y261 PolarHBondContact NZ-OH 2.89Å; K233-Y261 WeakPolarHBondContact O-CA 3.26Å; F235-Y261 AromaticContact CE2-CD1 3.91Å; F235-Y261 HydrophobicContact CE2-CD1 3.91Å; F235-Y261 HydrophobicContact CE2-CE1 4.32Å; M256-Y261 HydrophobicContact CB-CD1 3.82Å; M256-Y261 HydrophobicContact CB-CE1 3.74Å; M256-Y261 HydrophobicContact CB-CG 4.3Å; M256-Y261 HydrophobicContact CE-CD1 4.14Å; M256-Y261 HydrophobicContact CE-CE1 3.87Å; M256-Y261 HydrophobicContact CG-CD1 4.36Å; M256-Y261 HydrophobicContact CG-CE1 3.81Å; M256-Y261 VanDerWaalsContact O-CB 3.32Å; M256-Y261 WeakPolarHBondContact O-CB 3.2Å; M256-Y261 VanDerWaalsContact O-CG 3.24Å; G258-Y261 WeakPolarHBondContact O-CB 3.38Å; G258-Y261 PolarHBondContact O-N 3.4Å; Y259-Y261 VanDerWaalsContact C-N 3.29Å; Y261-F263 HydrophobicContact CD1-CZ 4.45Å; Y261-A284 CarbonylContact O-C 3.55Å; Y261-A284 VanDerWaalsContact O-CA 3.29Å; Y261-A284 WeakPolarHBondContact O-CA 3.36Å; Y261-R285 PolarHBondContact O-N 3.3Å
262	T	92.1	Very high	87.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	120.7	176.9	-52.5	0	0	0	0	110	W181 K233 F235 R285 K287	W181-T262 HydrophobicContact CZ2-CG2 3.77Å; K233-T262 PolarHBondContact O-N 3.4Å; F235-T262 PolarHBondContact N-O 2.98Å; T262-R285 WeakPolarHBondContact CA-O 3.2Å; T262-R285 HydrophobicContact CG2-CB 3.99Å; T262-R285 PolarHBondContact OG1-NE 3.45Å; T262-R285 VanDerWaalsContact OG1-NE 3.1Å; T262-R285 PolarHBondContact OG1-NH2 3.1Å; T262-K287 HydrophobicContact CG2-CD 4.41Å
263	F	94	Very high	87	Confident	1 Å²	1	31.6 Å²	31.6	0%	0.004	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	116	-179.6	-59.9	-83	0	0	0	109.3	F235 V237 F247 A251 M256 Y261 F265 A284 R285 K287	F235-F263 HydrophobicContact CB-CD1 3.62Å; F235-F263 HydrophobicContact CB-CE1 4.03Å; F235-F263 AromaticContact CD2-CD1 3.96Å; F235-F263 HydrophobicContact CD2-CD1 3.96Å; F235-F263 AromaticContact CD2-CE1 3.6Å; F235-F263 HydrophobicContact CD2-CE1 3.6Å; F235-F263 HydrophobicContact CD2-CZ 4.21Å; F235-F263 HydrophobicContact CE2-CE1 4.33Å; F235-F263 HydrophobicContact CG-CD1 4Å; F235-F263 AromaticContact CG-CE1 3.87Å; F235-F263 HydrophobicContact CG-CE1 3.87Å; F235-F263 WeakPolarHBondContact O-CA 3.35Å; V237-F263 HydrophobicContact CG2-CD1 4.46Å; F247-F263 AromaticContact CE1-CD1 3.7Å; F247-F263 HydrophobicContact CE1-CD1 3.7Å; F247-F263 AromaticContact CE1-CE1 3.8Å; F247-F263 HydrophobicContact CE1-CE1 3.8Å; F247-F263 HydrophobicContact CZ-CD1 4.09Å; F247-F263 HydrophobicContact CZ-CE1 4.02Å; A251-F263 HydrophobicContact CB-CZ 4.12Å; M256-F263 HydrophobicContact CB-CZ 4.18Å; M256-F263 HydrophobicContact CE-CZ 4.4Å; M256-F263 WeakPolarHBondContact O-CE2 3.22Å; Y261-F263 HydrophobicContact CD1-CZ 4.45Å; F263-F265 HydrophobicContact CB-CD2 4.33Å; F263-F265 HydrophobicContact CB-CE2 3.68Å; F263-F265 HydrophobicContact CB-CZ 4.18Å; F263-A284 HydrophobicContact CD2-CB 4.08Å; F263-A284 HydrophobicContact CE2-CB 3.85Å; F263-R285 PolarHBondContact N-O 2.98Å; F263-K287 PolarHBondContact O-N 3.37Å
264	I	94.4	Very high	86.6	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	110.4	173.2	-60.2	176.6	0	0	0	107.4	Y174 L175 E179 W181 F235 L236 V237 K287 I289	Y174-I264 HydrophobicContact CE1-CD1 4.04Å; Y174-I264 HydrophobicContact CE1-CG2 4.31Å; L175-I264 HydrophobicContact CD2-CD1 3.55Å; E179-I264 HydrophobicContact CG-CD1 4Å; W181-I264 HydrophobicContact CH2-CB 4.22Å; W181-I264 HydrophobicContact CH2-CD1 3.41Å; W181-I264 VanDerWaalsContact CH2-CD1 3.41Å; W181-I264 HydrophobicContact CH2-CG1 3.68Å; W181-I264 HydrophobicContact CZ2-CD1 3.47Å; W181-I264 VanDerWaalsContact CZ2-CD1 3.47Å; W181-I264 HydrophobicContact CZ2-CG1 3.92Å; W181-I264 HydrophobicContact CZ3-CD1 4.05Å; F235-I264 PolarHBondContact O-N 2.95Å; L236-I264 CarbonylContact C-O 3.29Å; L236-I264 WeakPolarHBondContact CA-O 3.4Å; L236-I264 HydrophobicContact CD1-CB 4.21Å; L236-I264 HydrophobicContact CD1-CG2 3.99Å; V237-I264 PolarHBondContact N-O 3.25Å; I264-K287 HydrophobicContact CG1-CB 4.05Å; I264-K287 HydrophobicContact CG1-CD 4.2Å; I264-I289 HydrophobicContact CG2-CD1 3.84Å; I264-I289 HydrophobicContact CG2-CG1 4.07Å
265	F	94.5	Very high	86.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	143.6	176.5	-60.7	-95.4	0	0	0	111.8	V237 I239 V244 F247 L248 F263 I270 I286 K287 A288 I289	V237-F265 HydrophobicContact CB-CD1 3.62Å; V237-F265 HydrophobicContact CB-CE1 3.87Å; V237-F265 HydrophobicContact CB-CG 4.3Å; V237-F265 HydrophobicContact CG1-CD1 3.74Å; V237-F265 HydrophobicContact CG1-CE1 3.7Å; V237-F265 HydrophobicContact CG2-CD1 4.43Å; V237-F265 HydrophobicContact CG2-CE1 4.32Å; V237-F265 WeakPolarHBondContact O-CA 3.27Å; I239-F265 HydrophobicContact CD1-CE1 4.21Å; I239-F265 HydrophobicContact CG1-CD1 4.5Å; V244-F265 HydrophobicContact CB-CE1 4.46Å; V244-F265 HydrophobicContact CG1-CD1 4.17Å; V244-F265 HydrophobicContact CG1-CE1 3.8Å; V244-F265 HydrophobicContact CG1-CE2 4.39Å; V244-F265 HydrophobicContact CG1-CZ 3.93Å; V244-F265 HydrophobicContact CG2-CD1 3.98Å; V244-F265 HydrophobicContact CG2-CE1 4.13Å; F247-F265 AromaticContact CD1-CE1 3.8Å; F247-F265 HydrophobicContact CD1-CE1 3.8Å; F247-F265 AromaticContact CD1-CZ 3.75Å; F247-F265 HydrophobicContact CD1-CZ 3.75Å; F247-F265 HydrophobicContact CE1-CE1 4.11Å; F247-F265 AromaticContact CE1-CZ 3.94Å; F247-F265 HydrophobicContact CE1-CZ 3.94Å; F247-F265 HydrophobicContact CG-CE1 4.44Å; L248-F265 HydrophobicContact CD1-CZ 4.46Å; L248-F265 HydrophobicContact CD2-CE2 4.17Å; L248-F265 HydrophobicContact CD2-CZ 3.83Å; L248-F265 HydrophobicContact CG-CZ 4.07Å; F263-F265 HydrophobicContact CB-CD2 4.33Å; F263-F265 HydrophobicContact CB-CE2 3.68Å; F263-F265 HydrophobicContact CB-CZ 4.18Å; F265-I270 HydrophobicContact CB-CD1 3.19Å; F265-I270 HydrophobicContact CD1-CD1 4.05Å; F265-I270 HydrophobicContact CG-CD1 3.78Å; F265-I286 HydrophobicContact CD2-CG2 4.43Å; F265-I286 HydrophobicContact CE2-CG2 4.15Å; F265-K287 WeakPolarHBondContact CD2-O 3.43Å; F265-K287 PolarHBondContact N-O 3.19Å; F265-A288 WeakPolarHBondContact O-CA 3.48Å; F265-I289 PolarHBondContact O-N 3.16Å; F265-I289 VanDerWaalsContact O-N 3.14Å
266	T	92.5	Very high	86	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.006	14%	0.142	C	C	.	.			trans	-106.2	-4.7	-172.4	48	0	0	0	0	114.9	Y167 F197 L236 V237 D238 I289	Y167-T266 WeakPolarHBondContact OH-CB 3.21Å; Y167-T266 WeakPolarHBondContact OH-CG2 3.21Å; F197-T266 HydrophobicContact CE1-CG2 4.02Å; F197-T266 HydrophobicContact CZ-CG2 4.09Å; L236-T266 HydrophobicContact CD1-CG2 3.61Å; L236-T266 HydrophobicContact CG-CG2 4.35Å; V237-T266 PolarHBondContact O-N 3.33Å; V237-T266 VanDerWaalsContact O-N 3.13Å; V237-T266 PolarHBondContact O-OG1 2.88Å; D238-T266 WeakPolarHBondContact CA-OG1 3.36Å; D238-T266 VanDerWaalsContact CB-OG1 3.26Å; D238-T266 WeakPolarHBondContact CB-OG1 3.21Å; D238-T266 PolarHBondContact OD1-OG1 3.26Å; T266-I289 HydrophobicContact CG2-CD1 4.46Å
267	D	90.7	Very high	85.6	Confident	32 Å²	32	29.8 Å²	29.8	17%	0.171	17%	0.172	C	C	.	.			trans	-79	132.1	173.8	-177	-61.5	0	0	0	111.2	P240 S241 D269 I270	P240-D267 WeakPolarHBondContact CA-OD2 3.42Å; S241-D267 PolarHBondContact N-OD2 2.93Å; S241-D267 VanDerWaalsContact N-OD2 3.16Å; D267-D269 VanDerWaalsContact C-N 3.34Å; D267-D269 PolarHBondContact O-N 3.37Å; D267-D269 PolarHBondContact OD1-N 2.75Å; D267-I270 HydrophobicContact CB-CD1 3.82Å; D267-I270 HydrophobicContact CB-CG1 4.06Å
268	W	88.9	Confident	85.3	Confident	17 Å²	17	29.6 Å²	29.6	6%	0.064	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-67.2	-30	-170.8	-48.5	106.7	0	0	0	114	W147 H161 Y167 I289 I291 I331 L408	W147-W268 AromaticContact CZ2-CZ2 3.77Å; W147-W268 HydrophobicContact CZ2-CZ2 3.77Å; W147-W268 AromaticContact NE1-NE1 3.4Å; H161-W268 AromaticContact CE1-CD1 3.98Å; H161-W268 AromaticContact CE1-NE1 3.84Å; Y167-W268 AromaticContact CD2-CH2 3.72Å; Y167-W268 HydrophobicContact CD2-CH2 3.72Å; Y167-W268 HydrophobicContact CD2-CZ2 4.15Å; Y167-W268 AromaticContact CE2-CH2 3.44Å; Y167-W268 HydrophobicContact CE2-CH2 3.44Å; Y167-W268 VanDerWaalsContact CE2-CH2 3.44Å; Y167-W268 AromaticContact CE2-CZ2 3.88Å; Y167-W268 HydrophobicContact CE2-CZ2 3.88Å; Y167-W268 HydrophobicContact CE2-CZ3 4.41Å; W268-I289 HydrophobicContact CZ3-CG2 4.12Å; W268-I291 HydrophobicContact CD2-CG1 4.21Å; W268-I291 HydrophobicContact CE3-CB 4.45Å; W268-I291 HydrophobicContact CE3-CG1 3.93Å; W268-I291 HydrophobicContact CE3-CG2 4.28Å; W268-I291 HydrophobicContact CH2-CG2 4.04Å; W268-I291 HydrophobicContact CZ3-CB 4.31Å; W268-I291 HydrophobicContact CZ3-CG1 4.16Å; W268-I291 HydrophobicContact CZ3-CG2 3.67Å; W268-I331 HydrophobicContact CB-CB 3.8Å; W268-I331 HydrophobicContact CB-CG1 3.93Å; W268-I331 HydrophobicContact CB-CG2 3.92Å; W268-I331 HydrophobicContact CG-CB 4.37Å; W268-I331 HydrophobicContact CG-CG1 4.03Å; W268-I331 HydrophobicContact CG-CG2 4.32Å; W268-L408 HydrophobicContact CH2-CD1 3.88Å; W268-L408 HydrophobicContact CZ3-CD1 3.83Å
269	D	87.2	Confident	85	Confident	22 Å²	22	31.6 Å²	31.6	12%	0.118	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-91.3	-2.6	-169.9	-76.3	-26.5	0	0	0	113.4	D267 A271 T272 T330 I331	D267-D269 VanDerWaalsContact C-N 3.34Å; D267-D269 PolarHBondContact O-N 3.37Å; D267-D269 PolarHBondContact OD1-N 2.75Å; D269-A271 PolarHBondContact O-N 3.19Å; D269-T272 WeakPolarHBondContact O-CB 3.3Å; D269-T272 WeakPolarHBondContact O-CG2 3.44Å; D269-T272 PolarHBondContact O-N 2.79Å; D269-T272 PolarHBondContact O-OG1 3.04Å; D269-T330 VanDerWaalsContact OD1-CA 3.31Å; D269-T330 WeakPolarHBondContact OD1-CA 3.39Å; D269-I331 PolarHBondContact OD1-N 3.09Å
270	I	85.7	Confident	84.3	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-57.5	-26	176.7	-66.8	175.4	0	0	0	112.1	V244 F265 D267 T272 L273 L275 A288 F418	V244-I270 HydrophobicContact CG2-CD1 3.63Å; V244-I270 HydrophobicContact CG2-CG1 3.94Å; F265-I270 HydrophobicContact CB-CD1 3.19Å; F265-I270 HydrophobicContact CD1-CD1 4.05Å; F265-I270 HydrophobicContact CG-CD1 3.78Å; D267-I270 HydrophobicContact CB-CD1 3.82Å; D267-I270 HydrophobicContact CB-CG1 4.06Å; I270-T272 PolarHBondContact O-N 2.8Å; I270-L273 HydrophobicContact CB-CD1 4.4Å; I270-L273 HydrophobicContact CG1-CD1 4.24Å; I270-L273 HydrophobicContact CG2-CD1 4.39Å; I270-L273 PolarHBondContact O-N 3.46Å; I270-L275 HydrophobicContact CG2-CD1 4.4Å; I270-A288 HydrophobicContact CB-CB 4.29Å; I270-A288 HydrophobicContact CG2-CB 3.99Å; I270-F418 HydrophobicContact CG2-CE2 4.11Å; I270-F418 HydrophobicContact CG2-CZ 3.8Å; I270-F418 WeakPolarHBondContact O-CE2 3.46Å
271	A	77.7	Confident	83.2	Confident	14 Å²	14	34.3 Å²	34.3	12%	0.116	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-63.6	-14.6	173	0	0	0	0	0	114.6	D269 K294 L411	D269-A271 PolarHBondContact O-N 3.19Å; A271-K294 HydrophobicContact CB-CD 4.39Å; A271-K294 PolarHBondContact O-NZ 2.93Å; A271-L411 HydrophobicContact CB-CD1 3.92Å
272	T	78	Confident	81.9	Confident	20 Å²	20	39.2 Å²	39.2	12%	0.123	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-28	178.6	71.9	0	0	0	0	113.3	D269 I270 N326 N328	D269-T272 WeakPolarHBondContact O-CB 3.3Å; D269-T272 WeakPolarHBondContact O-CG2 3.44Å; D269-T272 PolarHBondContact O-N 2.79Å; D269-T272 PolarHBondContact O-OG1 3.04Å; I270-T272 PolarHBondContact O-N 2.8Å; T272-N326 PolarHBondContact O-ND2 2.99Å; T272-N328 HydrophobicContact CG2-CB 4.18Å
273	L	82	Confident	81.2	Confident	39 Å²	39	39.9 Å²	39.9	20%	0.204	23%	0.232	C	C	.	.	S	Bend	trans	-64.7	141.4	-178.9	-55	173.4	0	0	0	111.1	S241 V244 I270 L275	S241-L273 VanDerWaalsContact O-CD1 3.26Å; S241-L273 WeakPolarHBondContact O-CD1 3.37Å; V244-L273 HydrophobicContact CB-CD1 4.03Å; V244-L273 HydrophobicContact CG1-CD1 4.38Å; I270-L273 HydrophobicContact CB-CD1 4.4Å; I270-L273 HydrophobicContact CG1-CD1 4.24Å; I270-L273 HydrophobicContact CG2-CD1 4.39Å; I270-L273 PolarHBondContact O-N 3.46Å; L273-L275 HydrophobicContact CB-CD2 4.32Å; L273-L275 HydrophobicContact CB-CG 4.42Å; L273-L275 PolarHBondContact O-N 2.87Å
274	D	80.3	Confident	80.8	Confident	83 Å²	83	40.7 Å²	40.7	44%	0.444	24%	0.239	S	C	.	.			trans	-84.2	101.4	166.6	-175.6	38.5	0	0	0	111.2	S276 K279	D274-S276 PolarHBondContact O-N 3.23Å; D274-S276 WeakPolarHBondContact OD1-CB 3.46Å; D274-S276 PolarHBondContact OD1-N 2.89Å; D274-S276 VanDerWaalsContact OD1-N 3.14Å; D274-S276 WeakPolarHBondContact OD2-CB 3.48Å; D274-S276 PolarHBondContact OD2-OG 3.14Å; D274-K279 IonicContact OD1-NZ 3.95Å; D274-K279 PolarHBondContact OD1-NZ 3.39Å
275	L	82.3	Confident	80.6	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.016	26%	0.258	C	S	.	.			trans	-90.8	34.5	171.8	-57.4	-177.7	0	0	0	111.9	L248 I270 L273 A277 F278 I286 L413 F418	L248-L275 HydrophobicContact CD1-CD1 4.14Å; L248-L275 HydrophobicContact CD1-CD2 3.93Å; I270-L275 HydrophobicContact CG2-CD1 4.4Å; L273-L275 HydrophobicContact CB-CD2 4.32Å; L273-L275 HydrophobicContact CB-CG 4.42Å; L273-L275 PolarHBondContact O-N 2.87Å; L275-A277 VanDerWaalsContact C-N 3.29Å; L275-A277 PolarHBondContact O-N 2.92Å; L275-F278 HydrophobicContact CB-CD2 4.39Å; L275-F278 HydrophobicContact CD2-CD2 4.5Å; L275-F278 PolarHBondContact O-N 2.8Å; L275-I286 HydrophobicContact CD1-CG2 4.22Å; L275-L413 HydrophobicContact CB-CD2 3.96Å; L275-L413 HydrophobicContact CD1-CD2 4.32Å; L275-F418 HydrophobicContact CD1-CE2 3.9Å; L275-F418 HydrophobicContact CD1-CZ 3.74Å
276	S	77.4	Confident	80.4	Confident	64 Å²	64	46.1 Å²	46.1	45%	0.448	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-50.3	-44.4	-178	47.1	0	0	0	0	113.9	D274 F278 K279	D274-S276 PolarHBondContact O-N 3.23Å; D274-S276 WeakPolarHBondContact OD1-CB 3.46Å; D274-S276 PolarHBondContact OD1-N 2.89Å; D274-S276 VanDerWaalsContact OD1-N 3.14Å; D274-S276 WeakPolarHBondContact OD2-CB 3.48Å; D274-S276 PolarHBondContact OD2-OG 3.14Å; S276-F278 PolarHBondContact O-N 2.82Å; S276-K279 VanDerWaalsContact CA-CE 3.49Å; S276-K279 PolarHBondContact O-N 2.77Å
277	A	77.8	Confident	80.3	Confident	77 Å²	77	46.2 Å²	46.2	64%	0.636	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-59	-17.4	177.7	0	0	0	0	0	114.6	L275	L275-A277 VanDerWaalsContact C-N 3.29Å; L275-A277 PolarHBondContact O-N 2.92Å
278	F	79.6	Confident	80.3	Confident	32 Å²	32	44.8 Å²	44.8	14%	0.14	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-113.3	8.7	-176.7	-53.2	-77.6	0	0	0	113.6	L248 V249 L275 S276 I280 I286 L413	L248-F278 HydrophobicContact CB-CD1 4.33Å; L248-F278 HydrophobicContact CB-CD2 4.24Å; L248-F278 HydrophobicContact CB-CE1 3.8Å; L248-F278 HydrophobicContact CB-CE2 3.69Å; L248-F278 HydrophobicContact CB-CZ 3.45Å; L248-F278 VanDerWaalsContact CB-CZ 3.45Å; L248-F278 HydrophobicContact CD1-CD2 3.98Å; L248-F278 HydrophobicContact CD1-CE2 4.12Å; L248-F278 HydrophobicContact CD1-CG 4.39Å; V249-F278 HydrophobicContact CG2-CZ 4.28Å; L275-F278 HydrophobicContact CB-CD2 4.39Å; L275-F278 HydrophobicContact CD2-CD2 4.5Å; L275-F278 PolarHBondContact O-N 2.8Å; S276-F278 PolarHBondContact O-N 2.82Å; F278-I280 VanDerWaalsContact C-N 3.29Å; F278-I280 PolarHBondContact O-N 2.95Å; F278-I286 HydrophobicContact CB-CD1 3.61Å; F278-I286 HydrophobicContact CG-CD1 4.19Å; F278-L413 HydrophobicContact CB-CD2 4.3Å
279	K	74.4	Confident	80.3	Confident	67 Å²	67	44.1 Å²	44.1	29%	0.291	25%	0.25	S	S	.	.			trans	-80.7	68.9	177.6	-65.6	172.3	-162.1	156	0	111.3	D274 S276 L413	D274-K279 IonicContact OD1-NZ 3.95Å; D274-K279 PolarHBondContact OD1-NZ 3.39Å; S276-K279 VanDerWaalsContact CA-CE 3.49Å; S276-K279 PolarHBondContact O-N 2.77Å; K279-L413 HydrophobicContact CG-CD1 4.09Å; K279-L413 HydrophobicContact CG-CD2 4.4Å; K279-L413 HydrophobicContact CG-CG 4.27Å
280	I	67.5	Low	80.4	Confident	110 Å²	110	43.1 Å²	43.1	56%	0.564	25%	0.245	S	C	*	.			trans	-113.8	129.8	-175	-52.5	175.9	0	0	0	110.3	F278 V282	F278-I280 VanDerWaalsContact C-N 3.29Å; F278-I280 PolarHBondContact O-N 2.95Å; I280-V282 VanDerWaalsContact C-N 3.29Å; I280-V282 PolarHBondContact O-N 3.06Å
281	D	59.6	Low	80.5	Confident	123 Å²	123	43.2 Å²	43.2	66%	0.658	25%	0.246	S	C	*	.	S	Bend	trans	-63.5	-31.8	-179.7	-74.7	-9.1	0	0	0	114	Q415	D281-Q415 WeakPolarHBondContact OD1-CG 3.43Å; D281-Q415 PolarHBondContact OD1-NE2 3.48Å; D281-Q415 PolarHBondContact OD2-NE2 2.92Å
282	V	64.1	Low	80.7	Confident	118 Å²	118	43.8 Å²	43.8	72%	0.715	25%	0.246	S	C	*	.	S	Bend	trans	-124.6	74.1	-177.1	-171	0	0	0	0	108.1	I280	I280-V282 VanDerWaalsContact C-N 3.29Å; I280-V282 PolarHBondContact O-N 3.06Å
283	G	77.4	Confident	80.1	Confident	15 Å²	15	45.8 Å²	45.8	16%	0.155	26%	0.26	C	S	.	.	S	Bend	trans	-158.1	-175.5	179.8	0	0	0	0	0	111.5	T257 R285	T257-G283 CarbonylContact O-C 3.3Å; T257-G283 VanDerWaalsContact O-CA 3.29Å; T257-G283 WeakPolarHBondContact O-CA 3.49Å; G283-R285 PolarHBondContact O-N 3.17Å
284	A	85.4	Confident	79.1	Confident	18 Å²	18	46.5 Å²	46.5	15%	0.149	26%	0.261	C	S	.	.			trans	-57.5	132.8	-178.2	0	0	0	0	0	112.3	T257 G258 Y261 F263 I286	T257-A284 PolarHBondContact O-N 3.24Å; G258-A284 WeakPolarHBondContact O-CA 3.46Å; G258-A284 PolarHBondContact O-N 3.43Å; Y261-A284 CarbonylContact O-C 3.55Å; Y261-A284 VanDerWaalsContact O-CA 3.29Å; Y261-A284 WeakPolarHBondContact O-CA 3.36Å; F263-A284 HydrophobicContact CD2-CB 4.08Å; F263-A284 HydrophobicContact CE2-CB 3.85Å; A284-I286 PolarHBondContact O-N 3.01Å
285	R	88.9	Confident	77.6	Confident	106 Å²	106	47.6 Å²	47.6	40%	0.4	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	97	-178.8	-65.7	-176.1	-58.8	178	2.7	110.2	Y261 T262 F263 G283	Y261-R285 PolarHBondContact O-N 3.3Å; T262-R285 WeakPolarHBondContact CA-O 3.2Å; T262-R285 HydrophobicContact CG2-CB 3.99Å; T262-R285 PolarHBondContact OG1-NE 3.45Å; T262-R285 VanDerWaalsContact OG1-NE 3.1Å; T262-R285 PolarHBondContact OG1-NH2 3.1Å; F263-R285 PolarHBondContact N-O 2.98Å; G283-R285 PolarHBondContact O-N 3.17Å
286	I	90.3	Very high	75.4	Confident	8 Å²	8	49.9 Å²	49.9	4%	0.041	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	121.9	175.1	-67.1	165.8	0	0	0	109.3	L248 F265 L275 F278 A284 L413 F418	L248-I286 HydrophobicContact CD1-CD1 4.08Å; L248-I286 HydrophobicContact CD2-CD1 3.78Å; L248-I286 HydrophobicContact CD2-CG1 4.14Å; F265-I286 HydrophobicContact CD2-CG2 4.43Å; F265-I286 HydrophobicContact CE2-CG2 4.15Å; L275-I286 HydrophobicContact CD1-CG2 4.22Å; F278-I286 HydrophobicContact CB-CD1 3.61Å; F278-I286 HydrophobicContact CG-CD1 4.19Å; A284-I286 PolarHBondContact O-N 3.01Å; I286-L413 HydrophobicContact CB-CB 4.04Å; I286-L413 HydrophobicContact CB-CD2 4.06Å; I286-L413 HydrophobicContact CD1-CD2 4.07Å; I286-L413 HydrophobicContact CG2-CB 4.12Å; I286-L413 HydrophobicContact CG2-CD2 4.04Å; I286-L413 WeakPolarHBondContact O-CB 3.26Å; I286-L413 PolarHBondContact O-N 2.91Å; I286-F418 HydrophobicContact CG2-CE1 4.34Å; I286-F418 HydrophobicContact CG2-CZ 4.29Å
287	K	90.9	Very high	73.4	Confident	3 Å²	3	51.5 Å²	51.5	1%	0.013	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	150.1	-179	-64.7	178.8	177.7	-176.9	0	110	E179 T262 F263 I264 F265 L411 E412	E179-K287 IonicContact OE1-NZ 2.74Å; E179-K287 PolarHBondContact OE1-NZ 3.47Å; E179-K287 IonicContact OE2-NZ 2.62Å; E179-K287 PolarHBondContact OE2-NZ 2.98Å; T262-K287 HydrophobicContact CG2-CD 4.41Å; F263-K287 PolarHBondContact O-N 3.37Å; I264-K287 HydrophobicContact CG1-CB 4.05Å; I264-K287 HydrophobicContact CG1-CD 4.2Å; F265-K287 WeakPolarHBondContact CD2-O 3.43Å; F265-K287 PolarHBondContact N-O 3.19Å; K287-L411 CarbonylContact C-O 3.57Å; K287-L411 WeakPolarHBondContact CA-O 3.44Å; K287-L411 WeakPolarHBondContact CB-O 3.41Å; K287-E412 WeakPolarHBondContact CE-OE1 3.29Å; K287-E412 HydrophobicContact CG-CB 4.26Å; K287-E412 HydrophobicContact CG-CG 4.19Å; K287-E412 IonicContact NZ-OE1 3.33Å
288	A	90.8	Very high	71.1	Confident	2 Å²	2	54.9 Å²	54.9	2%	0.017	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	160.1	177.9	0	0	0	0	0	110.2	F265 I270 L411 F418	F265-A288 WeakPolarHBondContact O-CA 3.48Å; I270-A288 HydrophobicContact CB-CB 4.29Å; I270-A288 HydrophobicContact CG2-CB 3.99Å; A288-L411 HydrophobicContact CB-CB 4.41Å; A288-L411 PolarHBondContact N-O 3.35Å; A288-L411 WeakPolarHBondContact O-CB 3.43Å; A288-L411 PolarHBondContact O-N 3.25Å; A288-F418 HydrophobicContact CB-CD1 4.37Å; A288-F418 HydrophobicContact CB-CE1 3.78Å; A288-F418 HydrophobicContact CB-CZ 4.1Å
289	I	89.8	Confident	68.8	Low	2 Å²	2	57.4 Å²	57.4	1%	0.01	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.8	178.9	-54.6	-178.4	0	0	0	108.6	L171 Y174 I264 F265 T266 W268 L408	L171-I289 HydrophobicContact CD1-CD1 3.57Å; Y174-I289 HydrophobicContact CD1-CD1 4.33Å; Y174-I289 HydrophobicContact CE1-CD1 4.39Å; I264-I289 HydrophobicContact CG2-CD1 3.84Å; I264-I289 HydrophobicContact CG2-CG1 4.07Å; F265-I289 PolarHBondContact O-N 3.16Å; F265-I289 VanDerWaalsContact O-N 3.14Å; T266-I289 HydrophobicContact CG2-CD1 4.46Å; W268-I289 HydrophobicContact CZ3-CG2 4.12Å; I289-L408 HydrophobicContact CG2-CD1 3.38Å; I289-L408 HydrophobicContact CG2-CD2 4.49Å; I289-L408 HydrophobicContact CG2-CG 3.77Å
290	S	88.2	Confident	66.8	Low	2 Å²	2	61.1 Å²	61.1	1%	0.014	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	147.1	-177.5	-158.5	0	0	0	0	112.3	I292 T409	S290-I292 PolarHBondContact OG-N 3.02Å; S290-T409 PolarHBondContact N-O 2.96Å; S290-T409 WeakPolarHBondContact O-CA 3.22Å; S290-T409 WeakPolarHBondContact O-CB 3.47Å; S290-T409 PolarHBondContact O-N 3.43Å
291	I	87.7	Confident	65.1	Low	1 Å²	1	63.3 Å²	63.3	1%	0.005	35%	0.352	C	S	.	.	S	Bend	trans	-105.9	11.6	162.9	55.5	174.7	0	0	0	112	P162 W268 I331 T392 F406 L408	P162-I291 HydrophobicContact CG-CD1 3.98Å; P162-I291 HydrophobicContact CG-CG2 4.27Å; W268-I291 HydrophobicContact CD2-CG1 4.21Å; W268-I291 HydrophobicContact CE3-CB 4.45Å; W268-I291 HydrophobicContact CE3-CG1 3.93Å; W268-I291 HydrophobicContact CE3-CG2 4.28Å; W268-I291 HydrophobicContact CH2-CG2 4.04Å; W268-I291 HydrophobicContact CZ3-CB 4.31Å; W268-I291 HydrophobicContact CZ3-CG1 4.16Å; W268-I291 HydrophobicContact CZ3-CG2 3.67Å; I291-I331 HydrophobicContact CD1-CD1 3.88Å; I291-I331 HydrophobicContact CG1-CD1 3.66Å; I291-T392 WeakPolarHBondContact O-CA 3.39Å; I291-T392 WeakPolarHBondContact O-CB 3.39Å; I291-F406 HydrophobicContact CG2-CB 4.44Å; I291-F406 HydrophobicContact CG2-CD2 3.83Å; I291-F406 HydrophobicContact CG2-CG 4.47Å; I291-L408 HydrophobicContact CG2-CD1 4.25Å
292	I	81.2	Confident	64	Low	26 Å²	26	64.1 Å²	64.1	13%	0.133	35%	0.35	C	S	.	.	S	Bend	trans	-98.6	114.3	167.8	-56	176.9	0	0	0	107	S290 K294 I331	S290-I292 PolarHBondContact OG-N 3.02Å; I292-K294 PolarHBondContact O-N 2.84Å; I292-I331 HydrophobicContact CD1-CB 4.48Å; I292-I331 HydrophobicContact CD1-CD1 4.21Å; I292-I331 HydrophobicContact CG1-CD1 3.95Å
293	P	66.9	Low	62.4	Low	62 Å²	62	64.5 Å²	64.5	40%	0.403	35%	0.353	S	S	.	.			trans	-64.9	103.4	176.7	25.6	-32.7	0	0	0	109.7	V295 L391	P293-V295 PolarHBondContact O-N 3.48Å; P293-L391 WeakPolarHBondContact CD-O 3.39Å
294	K	60.1	Low	60.5	Low	54 Å²	54	68.5 Å²	68.5	24%	0.235	38%	0.376	C	S	.	.			trans	-67.2	121.8	-167	-158.5	173.6	-164	177	0	111.8	A271 I292 T296	A271-K294 HydrophobicContact CB-CD 4.39Å; A271-K294 PolarHBondContact O-NZ 2.93Å; I292-K294 PolarHBondContact O-N 2.84Å; K294-T296 VanDerWaalsContact C-N 3.26Å; K294-T296 VanDerWaalsContact C-OG1 3.31Å; K294-T296 PolarHBondContact O-N 2.98Å; K294-T296 PolarHBondContact O-OG1 3.04Å
295	V	48.9	Very low	58.6	Low	106 Å²	106	72.2 Å²	72.2	64%	0.642	39%	0.39	S	S	*	.			trans	-68.9	78.2	-177.5	-172.9	0	0	0	0	110.8	P293 M308	P293-V295 PolarHBondContact O-N 3.48Å; V295-M308 HydrophobicContact CG2-CE 3.74Å; V295-M308 HydrophobicContact CG2-SD 4.12Å
296	T	37.4	Very low	56.6	Low	51 Å²	51	71.6 Å²	71.6	31%	0.313	40%	0.4	S	S	.	.			trans	-129.9	81.5	-170.2	-5.5	0	0	0	0	111.1	K294 L298	K294-T296 VanDerWaalsContact C-N 3.26Å; K294-T296 VanDerWaalsContact C-OG1 3.31Å; K294-T296 PolarHBondContact O-N 2.98Å; K294-T296 PolarHBondContact O-OG1 3.04Å; T296-L298 VanDerWaalsContact C-N 3.26Å; T296-L298 PolarHBondContact O-N 3.3Å
297	S	34.8	Very low	54.8	Low	98 Å²	98	74.3 Å²	74.3	69%	0.685	41%	0.412	S	S	*	.	S	Bend	trans	51.3	11.6	147.4	58.5	0	0	0	0	121.1	I300	S297-I300 WeakPolarHBondContact O-CG1 3.31Å
298	L	29.5	Very low	52.7	Low	148 Å²	148	76.5 Å²	76.5	78%	0.775	42%	0.423	S	S	*	.	S	Bend	trans	-96.3	-0.4	179.7	-95.1	164.5	0	0	0	115.6	T296	T296-L298 VanDerWaalsContact C-N 3.26Å; T296-L298 PolarHBondContact O-N 3.3Å
299	D	31.5	Very low	50.7	Low	86 Å²	86	81.5 Å²	81.5	46%	0.46	45%	0.449	S	S	.	.			trans	-125.2	51.5	176.6	-138.5	-11.3	0	0	0	110.7	N301 K302	D299-N301 PolarHBondContact O-N 3.21Å; D299-K302 PolarHBondContact O-N 3.41Å; D299-K302 WeakPolarHBondContact OD1-CG 3.41Å; D299-K302 IonicContact OD1-NZ 3.75Å; D299-K302 PolarHBondContact OD1-NZ 3.2Å; D299-K302 WeakPolarHBondContact OD2-CD 3.4Å; D299-K302 IonicContact OD2-NZ 3.16Å; D299-K302 PolarHBondContact OD2-NZ 2.81Å
300	I	31.9	Very low	48.9	Very low	145 Å²	145	84 Å²	84	74%	0.744	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-18.8	-178.7	-66.8	176.2	0	0	0	112.6	S297	S297-I300 WeakPolarHBondContact O-CG1 3.31Å
301	N	32.2	Very low	47.2	Very low	156 Å²	156	84.9 Å²	84.9	83%	0.834	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	16	178.5	-66.6	-13.3	0	0	0	114.1	D299	D299-N301 PolarHBondContact O-N 3.21Å
302	K	35.8	Very low	45.5	Very low	139 Å²	139	90.1 Å²	90.1	60%	0.604	49%	0.488	S	S	*	.	S	Bend	trans	-122.6	145.6	168.3	-67.5	-163.8	-162.3	75.8	0	111.8	D299	D299-K302 PolarHBondContact O-N 3.41Å; D299-K302 WeakPolarHBondContact OD1-CG 3.41Å; D299-K302 IonicContact OD1-NZ 3.75Å; D299-K302 PolarHBondContact OD1-NZ 3.2Å; D299-K302 WeakPolarHBondContact OD2-CD 3.4Å; D299-K302 IonicContact OD2-NZ 3.16Å; D299-K302 PolarHBondContact OD2-NZ 2.81Å
303	T	31.1	Very low	44.1	Very low	126 Å²	126	95.1 Å²	95.1	77%	0.773	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-60.7	144.8	178.9	31.2	0	0	0	0	111.7	Q305	T303-Q305 PolarHBondContact O-N 3.05Å
304	P	36.6	Very low	43.4	Very low	99 Å²	99	93.7 Å²	93.7	64%	0.643	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-59.9	130.9	174.4	26	-33.9	0	0	0	109.7
305	Q	47	Very low	43	Very low	96 Å²	96	93.7 Å²	93.7	45%	0.449	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-62.5	132.8	-178.4	-62.6	-164.5	73.9	0	0	109.8	T303 E307 M308 L309	T303-Q305 PolarHBondContact O-N 3.05Å; Q305-E307 PolarHBondContact O-N 3.25Å; Q305-M308 WeakPolarHBondContact O-CB 3.45Å; Q305-M308 PolarHBondContact O-N 3.33Å; Q305-L309 PolarHBondContact O-N 3.45Å
306	P	45.6	Very low	43.1	Very low	93 Å²	93	95.2 Å²	95.2	60%	0.604	50%	0.502	S	S	*	.	H	α-helix	trans	-63.4	-29.2	-170.1	24.3	-34	0	0	0	112.9	M308 L309 L310	P306-M308 VanDerWaalsContact C-N 3.33Å; P306-M308 PolarHBondContact O-N 3.03Å; P306-L309 WeakPolarHBondContact O-CB 3.37Å; P306-L309 PolarHBondContact O-N 2.85Å; P306-L310 PolarHBondContact O-N 3.32Å
307	E	52.2	Low	43.5	Very low	65 Å²	65	99.1 Å²	99.1	30%	0.304	52%	0.521	S	S	.	.	H	α-helix	trans	-57.6	-43.6	173.2	-62.2	128.3	-154.9	0	0	112.1	Q305 L309 L310 Y311	Q305-E307 PolarHBondContact O-N 3.25Å; E307-L309 VanDerWaalsContact C-N 3.32Å; E307-L309 PolarHBondContact O-N 3.37Å; E307-L310 WeakPolarHBondContact O-CB 3.43Å; E307-L310 PolarHBondContact O-N 3.17Å; E307-Y311 PolarHBondContact O-N 3.14Å
308	M	47.9	Very low	44.1	Very low	50 Å²	50	98 Å²	98	25%	0.246	51%	0.509	C	S	.	.	H	α-helix	trans	-70.6	-30.7	178.4	-163.7	62.8	51.5	0	0	111.9	V295 Q305 P306 K312 L391	V295-M308 HydrophobicContact CG2-CE 3.74Å; V295-M308 HydrophobicContact CG2-SD 4.12Å; Q305-M308 WeakPolarHBondContact O-CB 3.45Å; Q305-M308 PolarHBondContact O-N 3.33Å; P306-M308 VanDerWaalsContact C-N 3.33Å; P306-M308 PolarHBondContact O-N 3.03Å; M308-K312 PolarHBondContact O-N 3.02Å; M308-K312 VanDerWaalsContact O-N 3.17Å; M308-L391 HydrophobicContact CE-CD2 4.13Å
309	L	48.9	Very low	44.3	Very low	107 Å²	107	95.8 Å²	95.8	56%	0.56	51%	0.513	S	S	*	.	H	α-helix	trans	-71.1	-38.5	174.1	-163.7	74.2	0	0	0	111.1	Q305 P306 E307 K313	Q305-L309 PolarHBondContact O-N 3.45Å; P306-L309 WeakPolarHBondContact O-CB 3.37Å; P306-L309 PolarHBondContact O-N 2.85Å; E307-L309 VanDerWaalsContact C-N 3.32Å; E307-L309 PolarHBondContact O-N 3.37Å; L309-K313 VanDerWaalsContact O-CB 3.22Å; L309-K313 WeakPolarHBondContact O-CB 3.37Å; L309-K313 PolarHBondContact O-N 2.93Å
310	L	51.5	Low	44.6	Very low	54 Å²	54	95.3 Å²	95.3	28%	0.283	53%	0.528	S	S	.	.	H	α-helix	trans	-61.9	-49.8	173.6	-173.8	67.5	0	0	0	110.8	E76 P306 E307 K312 K313 T314	E76-L310 WeakPolarHBondContact OE2-CD2 3.24Å; P306-L310 PolarHBondContact O-N 3.32Å; E307-L310 WeakPolarHBondContact O-CB 3.43Å; E307-L310 PolarHBondContact O-N 3.17Å; L310-K312 PolarHBondContact O-N 3.01Å; L310-K313 PolarHBondContact O-N 3.32Å; L310-T314 PolarHBondContact O-N 3.07Å; L310-T314 PolarHBondContact O-OG1 2.77Å; L310-T314 VanDerWaalsContact O-OG1 3.14Å
311	Y	51.9	Low	44.8	Very low	20 Å²	20	91.1 Å²	91.1	8%	0.078	51%	0.512	C	S	.	.	H	α-helix	trans	-55.2	-49.6	177.2	177.2	-107.5	0	0	0	112.4	E307 K313 T314 L315 P329 F333	E307-Y311 PolarHBondContact O-N 3.14Å; Y311-K313 PolarHBondContact O-N 2.65Å; Y311-T314 PolarHBondContact O-N 3.11Å; Y311-L315 HydrophobicContact CD2-CD1 4.36Å; Y311-L315 HydrophobicContact CE1-CD1 4Å; Y311-L315 HydrophobicContact CE2-CD1 3.68Å; Y311-L315 VanDerWaalsContact CZ-CD1 3.46Å; Y311-L315 PolarHBondContact O-N 2.67Å; Y311-L315 WeakPolarHBondContact OH-CD1 3.36Å; Y311-P329 HydrophobicContact CE1-CB 4.12Å; Y311-P329 HydrophobicContact CE1-CG 4.35Å; Y311-P329 HydrophobicContact CE2-CB 4.18Å; Y311-P329 VanDerWaalsContact OH-CA 3.3Å; Y311-P329 WeakPolarHBondContact OH-CA 3.26Å; Y311-F333 HydrophobicContact CD2-CD1 4.39Å; Y311-F333 AromaticContact CD2-CE1 3.5Å; Y311-F333 HydrophobicContact CD2-CE1 3.5Å; Y311-F333 AromaticContact CD2-CZ 3.63Å; Y311-F333 HydrophobicContact CD2-CZ 3.63Å; Y311-F333 AromaticContact CE2-CD1 3.89Å; Y311-F333 HydrophobicContact CE2-CD1 3.89Å; Y311-F333 AromaticContact CE2-CE1 3.39Å; Y311-F333 HydrophobicContact CE2-CE1 3.39Å; Y311-F333 HydrophobicContact CE2-CE2 4.14Å; Y311-F333 HydrophobicContact CE2-CG 4.47Å; Y311-F333 AromaticContact CE2-CZ 3.55Å; Y311-F333 HydrophobicContact CE2-CZ 3.55Å
312	K	53.4	Low	45.1	Very low	112 Å²	112	93.4 Å²	93.4	49%	0.487	51%	0.514	S	S	.	.	H	α-helix	trans	-60.7	-45.2	176.8	-77.5	-167.2	171.8	-166.2	0	112.7	M308 L310 T314 L315 E316	M308-K312 PolarHBondContact O-N 3.02Å; M308-K312 VanDerWaalsContact O-N 3.17Å; L310-K312 PolarHBondContact O-N 3.01Å; K312-T314 VanDerWaalsContact C-N 3.29Å; K312-T314 PolarHBondContact O-N 3.2Å; K312-L315 WeakPolarHBondContact O-CB 3.32Å; K312-L315 PolarHBondContact O-N 3.08Å; K312-L315 VanDerWaalsContact O-N 3.1Å; K312-E316 WeakPolarHBondContact O-CB 3.26Å; K312-E316 VanDerWaalsContact O-CG 3.31Å; K312-E316 WeakPolarHBondContact O-CG 3.43Å; K312-E316 PolarHBondContact O-N 2.65Å
313	K	51.6	Low	45.3	Very low	131 Å²	131	93.4 Å²	93.4	57%	0.57	52%	0.521	S	S	*	.	H	α-helix	trans	-64.2	-33.8	-179.4	-167.6	172.9	-175.3	179.1	0	112.3	L309 L310 Y311 N317	L309-K313 VanDerWaalsContact O-CB 3.22Å; L309-K313 WeakPolarHBondContact O-CB 3.37Å; L309-K313 PolarHBondContact O-N 2.93Å; L310-K313 PolarHBondContact O-N 3.32Å; Y311-K313 PolarHBondContact O-N 2.65Å; K313-N317 VanDerWaalsContact O-CG 3.27Å; K313-N317 PolarHBondContact O-N 3.19Å; K313-N317 PolarHBondContact O-ND2 3.34Å
314	T	51.2	Low	45.9	Very low	31 Å²	31	91.9 Å²	91.9	19%	0.19	51%	0.507	C	S	.	.	H	α-helix	trans	-71	-38.5	172.3	-58.8	0	0	0	0	111.9	N69 L310 Y311 K312 T318	N69-T314 WeakPolarHBondContact OD1-CG2 3.3Å; L310-T314 PolarHBondContact O-N 3.07Å; L310-T314 PolarHBondContact O-OG1 2.77Å; L310-T314 VanDerWaalsContact O-OG1 3.14Å; Y311-T314 PolarHBondContact O-N 3.11Å; K312-T314 VanDerWaalsContact C-N 3.29Å; K312-T314 PolarHBondContact O-N 3.2Å; T314-T318 PolarHBondContact O-N 3.45Å; T314-T318 PolarHBondContact O-OG1 3.19Å
315	L	52.1	Low	46.2	Very low	54 Å²	54	90.5 Å²	90.5	28%	0.283	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-47.1	172.8	-120.8	86.8	0	0	0	112.5	Y311 K312 N317 T318 L324	Y311-L315 HydrophobicContact CD2-CD1 4.36Å; Y311-L315 HydrophobicContact CE1-CD1 4Å; Y311-L315 HydrophobicContact CE2-CD1 3.68Å; Y311-L315 VanDerWaalsContact CZ-CD1 3.46Å; Y311-L315 PolarHBondContact O-N 2.67Å; Y311-L315 WeakPolarHBondContact OH-CD1 3.36Å; K312-L315 WeakPolarHBondContact O-CB 3.32Å; K312-L315 PolarHBondContact O-N 3.08Å; K312-L315 VanDerWaalsContact O-N 3.1Å; L315-N317 VanDerWaalsContact C-N 3.27Å; L315-N317 PolarHBondContact O-N 3.21Å; L315-T318 WeakPolarHBondContact O-CA 3.36Å; L315-T318 PolarHBondContact O-N 3.16Å; L315-L324 HydrophobicContact CD1-CD2 3.98Å; L315-L324 HydrophobicContact CD2-CD2 4.15Å; L315-L324 HydrophobicContact CG-CD2 4.33Å
316	E	50.1	Low	46.4	Very low	139 Å²	139	90.4 Å²	90.4	65%	0.65	50%	0.503	S	S	*	.	H	α-helix	trans	-61.6	-33.8	-178.8	-74.3	165.1	-173.2	0	0	112.1	K312 T318	K312-E316 WeakPolarHBondContact O-CB 3.26Å; K312-E316 VanDerWaalsContact O-CG 3.31Å; K312-E316 WeakPolarHBondContact O-CG 3.43Å; K312-E316 PolarHBondContact O-N 2.65Å; E316-T318 VanDerWaalsContact C-N 3.28Å; E316-T318 PolarHBondContact O-N 3Å
317	N	46.5	Very low	46.8	Very low	133 Å²	133	87.4 Å²	87.4	71%	0.711	49%	0.489	S	S	*	.	H	α-helix	trans	-73.5	-16.1	172.3	-71.3	-32.3	0	0	0	113.7	K313 L315 A319	K313-N317 VanDerWaalsContact O-CG 3.27Å; K313-N317 PolarHBondContact O-N 3.19Å; K313-N317 PolarHBondContact O-ND2 3.34Å; L315-N317 VanDerWaalsContact C-N 3.27Å; L315-N317 PolarHBondContact O-N 3.21Å; N317-A319 PolarHBondContact O-N 2.69Å
318	T	47.5	Very low	47.5	Very low	73 Å²	73	87.3 Å²	87.3	45%	0.448	49%	0.49	S	S	.	.			trans	-102.8	46.4	-174.4	-47.5	0	0	0	0	111.3	T314 L315 E316 G320	T314-T318 PolarHBondContact O-N 3.45Å; T314-T318 PolarHBondContact O-OG1 3.19Å; L315-T318 WeakPolarHBondContact O-CA 3.36Å; L315-T318 PolarHBondContact O-N 3.16Å; E316-T318 VanDerWaalsContact C-N 3.28Å; E316-T318 PolarHBondContact O-N 3Å; T318-G320 PolarHBondContact O-N 2.9Å
319	A	34.1	Very low	48.6	Very low	102 Å²	102	85.4 Å²	85.4	84%	0.843	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	47.3	-170.9	0	0	0	0	0	115.3	N317	N317-A319 PolarHBondContact O-N 2.69Å
320	G	37.6	Very low	50.2	Low	77 Å²	77	83 Å²	83	79%	0.794	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133	-20	-173.6	0	0	0	0	0	117.3	T318	T318-G320 PolarHBondContact O-N 2.9Å
321	S	36.7	Very low	51.9	Low	56 Å²	56	80.7 Å²	80.7	39%	0.392	46%	0.46	S	S	.	.			trans	-107.2	122.4	178.9	47.6	0	0	0	0	111.4	D323	S321-D323 VanDerWaalsContact C-N 3.28Å; S321-D323 PolarHBondContact O-N 3.03Å
322	K	38.5	Very low	53.5	Low	205 Å²	205	82.3 Å²	82.3	89%	0.891	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-12.3	-173.4	-74.8	-177.5	173.5	179	0	114.3
323	D	39.8	Very low	55.1	Low	138 Å²	138	78.2 Å²	78.2	74%	0.738	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-3.1	-157.3	-47.6	-75.5	0	0	0	114.2	S321 S325	S321-D323 VanDerWaalsContact C-N 3.28Å; S321-D323 PolarHBondContact O-N 3.03Å; D323-S325 PolarHBondContact O-N 3.45Å
324	L	43.9	Very low	56.8	Low	94 Å²	94	72 Å²	72	49%	0.492	42%	0.423	S	S	.	.			trans	-80.1	68.5	172	-115.4	74.7	0	0	0	112	L315 N326 G327	L315-L324 HydrophobicContact CD1-CD2 3.98Å; L315-L324 HydrophobicContact CD2-CD2 4.15Å; L315-L324 HydrophobicContact CG-CD2 4.33Å; L324-N326 PolarHBondContact O-N 3.46Å; L324-G327 PolarHBondContact O-N 3.48Å
325	S	42.5	Very low	58.7	Low	71 Å²	71	70.5 Å²	70.5	50%	0.497	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-48.3	131.8	176	-174.7	0	0	0	0	112.6	D323 G327	D323-S325 PolarHBondContact O-N 3.45Å; S325-G327 PolarHBondContact O-N 3.42Å
326	N	50.9	Low	60.5	Low	93 Å²	93	68 Å²	68	50%	0.497	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	58.2	11	174.2	-67.9	-37.8	0	0	0	118	T272 L324 N328	T272-N326 PolarHBondContact O-ND2 2.99Å; L324-N326 PolarHBondContact O-N 3.46Å; N326-N328 PolarHBondContact O-N 3.43Å; N326-N328 PolarHBondContact O-ND2 2.91Å; N326-N328 VanDerWaalsContact O-ND2 3.16Å
327	G	54.8	Low	62.4	Low	30 Å²	30	62.5 Å²	62.5	31%	0.309	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	60.9	16.5	164.4	0	0	0	0	0	116.7	L324 S325	L324-G327 PolarHBondContact O-N 3.48Å; S325-G327 PolarHBondContact O-N 3.42Å
328	N	66.4	Low	64.4	Low	63 Å²	63	56.2 Å²	56.2	34%	0.337	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-94.7	148	173.3	-66.1	-63.3	0	0	0	109.3	T272 N326	T272-N328 HydrophobicContact CG2-CB 4.18Å; N326-N328 PolarHBondContact O-N 3.43Å; N326-N328 PolarHBondContact O-ND2 2.91Å; N326-N328 VanDerWaalsContact O-ND2 3.16Å
329	P	70.3	Confident	66.6	Low	10 Å²	10	53 Å²	53	7%	0.065	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-67.9	139.3	173	30.1	-34.3	0	0	0	110.7	Y311 F333	Y311-P329 HydrophobicContact CE1-CB 4.12Å; Y311-P329 HydrophobicContact CE1-CG 4.35Å; Y311-P329 HydrophobicContact CE2-CB 4.18Å; Y311-P329 VanDerWaalsContact OH-CA 3.3Å; Y311-P329 WeakPolarHBondContact OH-CA 3.26Å; P329-F333 HydrophobicContact CB-CD1 3.81Å; P329-F333 HydrophobicContact CB-CE1 4.46Å
330	T	82.7	Confident	69.4	Low	56 Å²	56	48.1 Å²	48.1	34%	0.344	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-74.6	162	167.8	59.8	0	0	0	0	110.4	D269 Q332 F333 S334	D269-T330 VanDerWaalsContact OD1-CA 3.31Å; D269-T330 WeakPolarHBondContact OD1-CA 3.39Å; T330-Q332 VanDerWaalsContact C-N 3.31Å; T330-Q332 PolarHBondContact O-N 2.87Å; T330-F333 PolarHBondContact O-N 3.35Å; T330-F333 PolarHBondContact OG1-N 2.88Å; T330-S334 WeakPolarHBondContact O-CB 3.23Å; T330-S334 PolarHBondContact O-N 2.85Å; T330-S334 PolarHBondContact O-OG 3.16Å
331	I	87.3	Confident	71.8	Confident	7 Å²	7	45 Å²	45	4%	0.036	25%	0.246	C	C	.	.	H	α-helix	trans	-65.3	-37.1	-179.6	-168.7	56.2	0	0	0	111.7	W268 D269 I291 I292 S334 L335 T392	W268-I331 HydrophobicContact CB-CB 3.8Å; W268-I331 HydrophobicContact CB-CG1 3.93Å; W268-I331 HydrophobicContact CB-CG2 3.92Å; W268-I331 HydrophobicContact CG-CB 4.37Å; W268-I331 HydrophobicContact CG-CG1 4.03Å; W268-I331 HydrophobicContact CG-CG2 4.32Å; D269-I331 PolarHBondContact OD1-N 3.09Å; I291-I331 HydrophobicContact CD1-CD1 3.88Å; I291-I331 HydrophobicContact CG1-CD1 3.66Å; I292-I331 HydrophobicContact CD1-CB 4.48Å; I292-I331 HydrophobicContact CD1-CD1 4.21Å; I292-I331 HydrophobicContact CG1-CD1 3.95Å; I331-S334 PolarHBondContact O-N 3.21Å; I331-L335 HydrophobicContact CD1-CD1 4.09Å; I331-L335 HydrophobicContact CD1-CD2 4.33Å; I331-L335 HydrophobicContact CD1-CG 3.95Å; I331-L335 HydrophobicContact CG1-CD1 3.79Å; I331-L335 HydrophobicContact CG1-CG 4.13Å; I331-L335 WeakPolarHBondContact O-CB 3.5Å; I331-L335 VanDerWaalsContact O-CG 3.27Å; I331-L335 WeakPolarHBondContact O-CG 3.49Å; I331-L335 PolarHBondContact O-N 2.97Å; I331-T392 HydrophobicContact CD1-CG2 3.8Å
332	Q	85.9	Confident	74.4	Confident	54 Å²	54	42.4 Å²	42.4	25%	0.252	23%	0.228	S	C	.	.	H	α-helix	trans	-64.1	-44.1	175.9	-76.7	-60.1	-46.7	0	0	111.4	T145 H161 T330 S334 L335 I336	T145-Q332 PolarHBondContact O-NE2 3.09Å; T145-Q332 PolarHBondContact O-OE1 2.84Å; H161-Q332 PolarHBondContact NE2-NE2 2.85Å; T330-Q332 VanDerWaalsContact C-N 3.31Å; T330-Q332 PolarHBondContact O-N 2.87Å; Q332-S334 VanDerWaalsContact C-N 3.35Å; Q332-S334 PolarHBondContact O-N 2.74Å; Q332-L335 PolarHBondContact O-N 3.47Å; Q332-I336 WeakPolarHBondContact O-CB 3.3Å; Q332-I336 WeakPolarHBondContact O-CD1 3.43Å; Q332-I336 WeakPolarHBondContact O-CG1 3.34Å; Q332-I336 PolarHBondContact O-N 3.47Å
333	F	86.8	Confident	77	Confident	25 Å²	25	32.9 Å²	32.9	11%	0.11	19%	0.186	C	C	.	.	H	α-helix	trans	-57.9	-48.1	171.7	178.7	-84.9	0	0	0	111.5	A66 N69 Y311 P329 T330 L335 I336 Y337 L391	A66-F333 HydrophobicContact CB-CB 4.4Å; A66-F333 HydrophobicContact CB-CD2 3.67Å; A66-F333 HydrophobicContact CB-CE2 4.37Å; A66-F333 HydrophobicContact CB-CG 4.4Å; N69-F333 HydrophobicContact CB-CE2 3.97Å; N69-F333 HydrophobicContact CB-CZ 4.28Å; Y311-F333 HydrophobicContact CD2-CD1 4.39Å; Y311-F333 AromaticContact CD2-CE1 3.5Å; Y311-F333 HydrophobicContact CD2-CE1 3.5Å; Y311-F333 AromaticContact CD2-CZ 3.63Å; Y311-F333 HydrophobicContact CD2-CZ 3.63Å; Y311-F333 AromaticContact CE2-CD1 3.89Å; Y311-F333 HydrophobicContact CE2-CD1 3.89Å; Y311-F333 AromaticContact CE2-CE1 3.39Å; Y311-F333 HydrophobicContact CE2-CE1 3.39Å; Y311-F333 HydrophobicContact CE2-CE2 4.14Å; Y311-F333 HydrophobicContact CE2-CG 4.47Å; Y311-F333 AromaticContact CE2-CZ 3.55Å; Y311-F333 HydrophobicContact CE2-CZ 3.55Å; P329-F333 HydrophobicContact CB-CD1 3.81Å; P329-F333 HydrophobicContact CB-CE1 4.46Å; T330-F333 PolarHBondContact O-N 3.35Å; T330-F333 PolarHBondContact OG1-N 2.88Å; F333-L335 PolarHBondContact O-N 2.79Å; F333-I336 PolarHBondContact O-N 2.91Å; F333-Y337 HydrophobicContact CE1-CD2 4.37Å; F333-Y337 HydrophobicContact CZ-CD2 4.39Å; F333-Y337 WeakPolarHBondContact O-CB 3.36Å; F333-Y337 PolarHBondContact O-N 2.77Å; F333-L391 HydrophobicContact CD1-CD1 4.17Å; F333-L391 HydrophobicContact CE1-CD1 3.86Å
334	S	87.1	Confident	79.5	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.8	-40.5	-176.4	-56	0	0	0	0	112.8	T330 I331 Q332 D338	T330-S334 WeakPolarHBondContact O-CB 3.23Å; T330-S334 PolarHBondContact O-N 2.85Å; T330-S334 PolarHBondContact O-OG 3.16Å; I331-S334 PolarHBondContact O-N 3.21Å; Q332-S334 VanDerWaalsContact C-N 3.35Å; Q332-S334 PolarHBondContact O-N 2.74Å; S334-D338 WeakPolarHBondContact O-CB 3.45Å; S334-D338 PolarHBondContact O-N 3.02Å
335	L	91.1	Very high	81.7	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-75.9	-35.2	179.6	-64.2	172.7	0	0	0	112.7	L160 H161 I331 Q332 F333 S339 T392	L160-L335 HydrophobicContact CB-CB 4.23Å; L160-L335 HydrophobicContact CB-CD2 4.12Å; H161-L335 WeakPolarHBondContact CE1-CD1 3.22Å; H161-L335 WeakPolarHBondContact ND1-CD1 3.25Å; H161-L335 WeakPolarHBondContact NE2-CD1 3.44Å; I331-L335 HydrophobicContact CD1-CD1 4.09Å; I331-L335 HydrophobicContact CD1-CD2 4.33Å; I331-L335 HydrophobicContact CD1-CG 3.95Å; I331-L335 HydrophobicContact CG1-CD1 3.79Å; I331-L335 HydrophobicContact CG1-CG 4.13Å; I331-L335 WeakPolarHBondContact O-CB 3.5Å; I331-L335 VanDerWaalsContact O-CG 3.27Å; I331-L335 WeakPolarHBondContact O-CG 3.49Å; I331-L335 PolarHBondContact O-N 2.97Å; Q332-L335 PolarHBondContact O-N 3.47Å; F333-L335 PolarHBondContact O-N 2.79Å; L335-S339 VanDerWaalsContact O-CB 3.28Å; L335-S339 WeakPolarHBondContact O-CB 3.28Å; L335-S339 PolarHBondContact O-N 3.34Å; L335-S339 PolarHBondContact O-OG 3.36Å; L335-T392 HydrophobicContact CD2-CG2 3.77Å; L335-T392 HydrophobicContact CG-CG2 4.36Å
336	I	90.8	Very high	84	Confident	1 Å²	1	21 Å²	21	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-62.9	-48	171.4	-69.4	164.1	0	0	0	109.6	T63 A66 F67 T145 Q332 F333 S339 L340	T63-I336 HydrophobicContact CG2-CD1 4.28Å; A66-I336 HydrophobicContact CB-CB 4.27Å; A66-I336 HydrophobicContact CB-CD1 3.78Å; A66-I336 HydrophobicContact CB-CG2 4.11Å; F67-I336 HydrophobicContact CB-CG2 4.47Å; F67-I336 HydrophobicContact CD1-CG2 3.66Å; F67-I336 HydrophobicContact CD2-CD1 4.08Å; F67-I336 HydrophobicContact CD2-CG2 4.09Å; F67-I336 HydrophobicContact CE1-CG1 4.36Å; F67-I336 HydrophobicContact CE1-CG2 3.76Å; F67-I336 HydrophobicContact CE2-CD1 3.57Å; F67-I336 HydrophobicContact CE2-CG1 3.95Å; F67-I336 HydrophobicContact CE2-CG2 4.16Å; F67-I336 HydrophobicContact CG-CG2 3.83Å; F67-I336 HydrophobicContact CZ-CD1 3.99Å; F67-I336 HydrophobicContact CZ-CG1 3.83Å; F67-I336 HydrophobicContact CZ-CG2 4.01Å; T145-I336 HydrophobicContact CG2-CG1 3.89Å; Q332-I336 WeakPolarHBondContact O-CB 3.3Å; Q332-I336 WeakPolarHBondContact O-CD1 3.43Å; Q332-I336 WeakPolarHBondContact O-CG1 3.34Å; Q332-I336 PolarHBondContact O-N 3.47Å; F333-I336 PolarHBondContact O-N 2.91Å; I336-S339 PolarHBondContact O-N 2.78Å; I336-S339 PolarHBondContact O-OG 2.7Å; I336-L340 HydrophobicContact CG2-CD1 3.86Å; I336-L340 WeakPolarHBondContact O-CD1 3.33Å; I336-L340 WeakPolarHBondContact O-CG 3.41Å; I336-L340 PolarHBondContact O-N 2.64Å
337	Y	89.3	Confident	85.9	Confident	25 Å²	25	16.5 Å²	16.5	10%	0.098	9%	0.092	C	C	.	.	H	α-helix	trans	-56.4	-55.5	175.3	-175.8	-87.9	0	0	0	111.7	A73 F333 S339 L340 I341 L391	A73-Y337 HydrophobicContact CB-CD2 4.29Å; A73-Y337 HydrophobicContact CB-CE2 3.4Å; A73-Y337 VanDerWaalsContact CB-CE2 3.4Å; F333-Y337 HydrophobicContact CE1-CD2 4.37Å; F333-Y337 HydrophobicContact CZ-CD2 4.39Å; F333-Y337 WeakPolarHBondContact O-CB 3.36Å; F333-Y337 PolarHBondContact O-N 2.77Å; Y337-S339 VanDerWaalsContact C-N 3.26Å; Y337-S339 PolarHBondContact O-N 3.16Å; Y337-L340 PolarHBondContact O-N 2.86Å; Y337-I341 HydrophobicContact CD1-CG1 4.07Å; Y337-I341 HydrophobicContact CE1-CD1 4.32Å; Y337-I341 HydrophobicContact CE1-CG1 3.75Å; Y337-I341 WeakPolarHBondContact O-CG1 3.2Å; Y337-I341 PolarHBondContact O-N 2.62Å; Y337-I341 VanDerWaalsContact O-N 3.11Å; Y337-L391 HydrophobicContact CD1-CD1 3.64Å; Y337-L391 HydrophobicContact CD1-CG 3.78Å; Y337-L391 HydrophobicContact CD2-CD1 4.43Å; Y337-L391 HydrophobicContact CE1-CD1 4.2Å; Y337-L391 HydrophobicContact CE1-CG 4.09Å; Y337-L391 HydrophobicContact CG-CD1 3.78Å; Y337-L391 HydrophobicContact CG-CG 4.43Å
338	D	89.6	Confident	87.5	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-57.5	-38.7	-178.3	-74	2.8	0	0	0	112.1	S334 L340 L342 G390 L391 T392	S334-D338 WeakPolarHBondContact O-CB 3.45Å; S334-D338 PolarHBondContact O-N 3.02Å; D338-L340 VanDerWaalsContact C-N 3.35Å; D338-L340 PolarHBondContact O-N 3.08Å; D338-L342 VanDerWaalsContact O-CB 3.23Å; D338-L342 WeakPolarHBondContact O-CB 3.43Å; D338-L342 WeakPolarHBondContact O-CG 3.31Å; D338-L342 PolarHBondContact O-N 2.96Å; D338-G390 VanDerWaalsContact CG-CA 3.44Å; D338-G390 VanDerWaalsContact OD1-C 3.3Å; D338-G390 WeakPolarHBondContact OD1-CA 3.4Å; D338-G390 WeakPolarHBondContact OD2-CA 3.41Å; D338-L391 PolarHBondContact OD1-N 2.82Å; D338-L391 PolarHBondContact OD2-N 2.77Å; D338-T392 WeakPolarHBondContact OD2-CB 3.26Å; D338-T392 PolarHBondContact OD2-N 3.46Å; D338-T392 PolarHBondContact OD2-OG1 3.43Å
339	S	92.4	Very high	88.6	Confident	5 Å²	5	16.2 Å²	16.2	4%	0.035	9%	0.087	C	C	.	.	H	α-helix	trans	-64.6	-35.2	177.9	74.9	0	0	0	0	114	Y120 L335 I336 Y337 L342 L343	Y120-S339 VanDerWaalsContact CE1-OG 3.24Å; Y120-S339 WeakPolarHBondContact CE1-OG 3.39Å; Y120-S339 PolarHBondContact OH-O 3.35Å; Y120-S339 PolarHBondContact OH-OG 2.93Å; L335-S339 VanDerWaalsContact O-CB 3.28Å; L335-S339 WeakPolarHBondContact O-CB 3.28Å; L335-S339 PolarHBondContact O-N 3.34Å; L335-S339 PolarHBondContact O-OG 3.36Å; I336-S339 PolarHBondContact O-N 2.78Å; I336-S339 PolarHBondContact O-OG 2.7Å; Y337-S339 VanDerWaalsContact C-N 3.26Å; Y337-S339 PolarHBondContact O-N 3.16Å; S339-L342 WeakPolarHBondContact O-CB 3.28Å; S339-L343 WeakPolarHBondContact O-CB 3.42Å; S339-L343 PolarHBondContact O-N 3.21Å
340	L	92.3	Very high	89.6	Confident	0 Å²	0	16 Å²	16	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-80.4	-35.5	-177.2	-71.5	161.4	0	0	0	111	I52 F67 V71 A74 Y120 I336 Y337 D338 L343 A344	I52-L340 HydrophobicContact CD1-CD2 3.53Å; F67-L340 HydrophobicContact CD1-CD1 4.12Å; V71-L340 HydrophobicContact CG2-CD1 4.2Å; V71-L340 HydrophobicContact CG2-CD2 4.03Å; A74-L340 HydrophobicContact CB-CB 4.16Å; A74-L340 WeakPolarHBondContact CB-O 3.48Å; Y120-L340 HydrophobicContact CE2-CD2 4.01Å; Y120-L340 WeakPolarHBondContact OH-CD2 3.07Å; I336-L340 HydrophobicContact CG2-CD1 3.86Å; I336-L340 WeakPolarHBondContact O-CD1 3.33Å; I336-L340 WeakPolarHBondContact O-CG 3.41Å; I336-L340 PolarHBondContact O-N 2.64Å; Y337-L340 PolarHBondContact O-N 2.86Å; D338-L340 VanDerWaalsContact C-N 3.35Å; D338-L340 PolarHBondContact O-N 3.08Å; L340-L343 PolarHBondContact O-N 3.31Å; L340-A344 WeakPolarHBondContact O-CB 3.36Å; L340-A344 PolarHBondContact O-N 3.39Å
341	I	89.4	Confident	89.8	Confident	13 Å²	13	14.3 Å²	14.3	7%	0.067	8%	0.075	C	C	.	.	H	α-helix	trans	-64.9	-45	167.9	-55.5	-59	0	0	0	110.6	A73 V77 Y337 L343 A344 H345 V388	A73-I341 HydrophobicContact CB-CD1 3.83Å; V77-I341 HydrophobicContact CG2-CD1 4.04Å; V77-I341 HydrophobicContact CG2-CG2 4.42Å; Y337-I341 HydrophobicContact CD1-CG1 4.07Å; Y337-I341 HydrophobicContact CE1-CD1 4.32Å; Y337-I341 HydrophobicContact CE1-CG1 3.75Å; Y337-I341 WeakPolarHBondContact O-CG1 3.2Å; Y337-I341 PolarHBondContact O-N 2.62Å; Y337-I341 VanDerWaalsContact O-N 3.11Å; I341-L343 VanDerWaalsContact C-N 3.32Å; I341-L343 PolarHBondContact O-N 3.16Å; I341-A344 PolarHBondContact O-N 2.96Å; I341-H345 PolarHBondContact O-CD2 3.13Å; I341-H345 PolarHBondContact O-N 3.14Å; I341-V388 HydrophobicContact CB-CG1 4.37Å; I341-V388 HydrophobicContact CG2-CG1 3.52Å; I341-V388 HydrophobicContact CG2-CG2 4.47Å
342	L	91.5	Very high	89.8	Confident	1 Å²	1	22.7 Å²	22.7	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-55.9	-45	173.7	-94	166.6	0	0	0	112.2	L160 D338 S339 H345 G346 V380 V383 F395 F397	L160-L342 HydrophobicContact CD1-CD1 3.83Å; D338-L342 VanDerWaalsContact O-CB 3.23Å; D338-L342 WeakPolarHBondContact O-CB 3.43Å; D338-L342 WeakPolarHBondContact O-CG 3.31Å; D338-L342 PolarHBondContact O-N 2.96Å; S339-L342 WeakPolarHBondContact O-CB 3.28Å; L342-H345 PolarHBondContact O-N 2.62Å; L342-G346 PolarHBondContact O-N 3.16Å; L342-V380 HydrophobicContact CB-CG1 4.09Å; L342-V380 HydrophobicContact CD2-CG1 4.3Å; L342-V383 HydrophobicContact CD2-CB 3.74Å; L342-V383 HydrophobicContact CD2-CG1 4.02Å; L342-V383 HydrophobicContact CD2-CG2 3.99Å; L342-F395 HydrophobicContact CD1-CD2 4.47Å; L342-F395 HydrophobicContact CD1-CE1 4.18Å; L342-F395 HydrophobicContact CD1-CE2 4.16Å; L342-F395 HydrophobicContact CD1-CZ 3.97Å; L342-F395 HydrophobicContact CD2-CD2 4.35Å; L342-F395 HydrophobicContact CD2-CE2 3.56Å; L342-F395 HydrophobicContact CD2-CZ 3.76Å; L342-F395 HydrophobicContact CG-CE1 4.34Å; L342-F395 HydrophobicContact CG-CE2 4.02Å; L342-F395 HydrophobicContact CG-CZ 3.74Å; L342-F397 HydrophobicContact CD1-CE2 3.78Å; L342-F397 HydrophobicContact CD1-CZ 3.75Å; L342-F397 HydrophobicContact CD2-CE2 4.2Å
343	L	92.8	Very high	89.7	Confident	5 Å²	5	25.7 Å²	25.7	3%	0.026	13%	0.128	C	C	.	.	H	α-helix	trans	-62.7	-43.3	175.8	-177.2	61.1	0	0	0	111.7	I52 I117 A118 Y120 S339 L340 I341 G346 L347 L376 V380	I52-L343 HydrophobicContact CG2-CD2 3.94Å; I117-L343 HydrophobicContact CD1-CD1 4.4Å; I117-L343 HydrophobicContact CD1-CD2 4.44Å; A118-L343 HydrophobicContact CB-CD1 4.23Å; A118-L343 HydrophobicContact CB-CD2 3.96Å; Y120-L343 HydrophobicContact CE2-CD2 4.43Å; S339-L343 WeakPolarHBondContact O-CB 3.42Å; S339-L343 PolarHBondContact O-N 3.21Å; L340-L343 PolarHBondContact O-N 3.31Å; I341-L343 VanDerWaalsContact C-N 3.32Å; I341-L343 PolarHBondContact O-N 3.16Å; L343-G346 PolarHBondContact O-N 2.9Å; L343-L347 VanDerWaalsContact O-CB 3.22Å; L343-L347 WeakPolarHBondContact O-CB 3.3Å; L343-L347 PolarHBondContact O-N 2.65Å; L343-L376 HydrophobicContact CD1-CD1 4.45Å; L343-L376 HydrophobicContact CD1-CD2 4.29Å; L343-L376 HydrophobicContact CD1-CG 4.45Å; L343-V380 HydrophobicContact CD1-CG2 4.44Å
344	A	91.1	Very high	89.6	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.1	-43.9	177.3	0	0	0	0	0	112.7	A74 V77 L78 L340 I341 L347 S348	A74-A344 HydrophobicContact CB-CB 4.09Å; V77-A344 HydrophobicContact CB-CB 4.16Å; V77-A344 HydrophobicContact CG1-CB 3.82Å; L78-A344 HydrophobicContact CD2-CB 3.96Å; L78-A344 HydrophobicContact CG-CB 4.07Å; L340-A344 WeakPolarHBondContact O-CB 3.36Å; L340-A344 PolarHBondContact O-N 3.39Å; I341-A344 PolarHBondContact O-N 2.96Å; A344-L347 PolarHBondContact O-N 2.68Å; A344-S348 VanDerWaalsContact O-CB 3.24Å; A344-S348 WeakPolarHBondContact O-CB 3.48Å; A344-S348 PolarHBondContact O-N 2.89Å
345	H	90.4	Very high	89.4	Confident	52 Å²	52	34.8 Å²	34.8	24%	0.241	18%	0.175	C	C	.	.	H	α-helix	trans	-67.4	-41.2	175.9	-83.8	-105.8	0	0	0	112.5	V77 I341 L342 S348 T349 V383 V388	V77-H345 VanDerWaalsContact CG1-CD2 3.49Å; V77-H345 WeakPolarHBondContact CG1-CD2 3.43Å; V77-H345 WeakPolarHBondContact CG1-NE2 3.38Å; I341-H345 PolarHBondContact O-CD2 3.13Å; I341-H345 PolarHBondContact O-N 3.14Å; L342-H345 PolarHBondContact O-N 2.62Å; H345-S348 PolarHBondContact O-N 3.4Å; H345-T349 WeakPolarHBondContact O-CB 3.36Å; H345-T349 PolarHBondContact O-N 3.06Å; H345-T349 PolarHBondContact O-OG1 3.19Å; H345-V383 HydrophobicContact CB-CG1 4.45Å; H345-V383 HydrophobicContact CB-CG2 4.19Å; H345-V388 HydrophobicContact CB-CG2 3.94Å; H345-V388 VanDerWaalsContact CD2-CG2 3.49Å; H345-V388 WeakPolarHBondContact CD2-CG2 3.47Å; H345-V388 WeakPolarHBondContact ND1-CG2 3.49Å
346	G	90.7	Very high	88.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.2	-43.2	174	0	0	0	0	0	112.3	L342 L343 T349 V350	L342-G346 PolarHBondContact O-N 3.16Å; L343-G346 PolarHBondContact O-N 2.9Å; G346-T349 PolarHBondContact O-N 2.72Å; G346-V350 WeakPolarHBondContact O-CG2 3.4Å; G346-V350 PolarHBondContact O-N 3.34Å
347	L	91.3	Very high	88.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-48.7	176.4	-167.3	68.8	0	0	0	111.4	I50 L78 L84 I117 L343 A344 T349 V350 T351 L356 L376	I50-L347 HydrophobicContact CD1-CD2 4.1Å; L78-L347 HydrophobicContact CD1-CD2 4.24Å; L78-L347 HydrophobicContact CD2-CD2 4.33Å; L84-L347 HydrophobicContact CD1-CB 4.32Å; L84-L347 HydrophobicContact CD1-CD2 3.97Å; L84-L347 HydrophobicContact CD1-CG 3.76Å; I117-L347 HydrophobicContact CD1-CD1 4.04Å; I117-L347 HydrophobicContact CD1-CD2 3.99Å; L343-L347 VanDerWaalsContact O-CB 3.22Å; L343-L347 WeakPolarHBondContact O-CB 3.3Å; L343-L347 PolarHBondContact O-N 2.65Å; A344-L347 PolarHBondContact O-N 2.68Å; L347-T349 PolarHBondContact O-N 2.81Å; L347-V350 PolarHBondContact O-N 2.86Å; L347-T351 WeakPolarHBondContact O-CG2 3.1Å; L347-T351 PolarHBondContact O-N 2.69Å; L347-T351 PolarHBondContact O-OG1 2.9Å; L347-T351 VanDerWaalsContact O-OG1 3.12Å; L347-L356 HydrophobicContact CD1-CD1 3.97Å; L347-L356 HydrophobicContact CD1-CD2 4.31Å; L347-L376 HydrophobicContact CB-CD1 4.13Å; L347-L376 HydrophobicContact CD1-CD1 4.04Å; L347-L376 HydrophobicContact CD1-CD2 4.11Å
348	S	89.1	Confident	87.8	Confident	16 Å²	16	43.4 Å²	43.4	11%	0.112	23%	0.225	C	C	.	.	H	α-helix	trans	-58.9	-31.7	174.9	-173.8	0	0	0	0	113.2	S81 A344 H345 R352	S81-S348 WeakPolarHBondContact CB-OG 3.47Å; S81-S348 PolarHBondContact OG-OG 3.39Å; A344-S348 VanDerWaalsContact O-CB 3.24Å; A344-S348 WeakPolarHBondContact O-CB 3.48Å; A344-S348 PolarHBondContact O-N 2.89Å; H345-S348 PolarHBondContact O-N 3.4Å; S348-R352 WeakPolarHBondContact O-CG 3.45Å; S348-R352 PolarHBondContact O-NE 3.16Å
349	T	89	Confident	87.4	Confident	71 Å²	71	47 Å²	47	44%	0.436	24%	0.242	S	C	.	.	H	α-helix	trans	-74.8	-45.5	175.3	-60.9	0	0	0	0	111.7	H345 G346 L347 A379	H345-T349 WeakPolarHBondContact O-CB 3.36Å; H345-T349 PolarHBondContact O-N 3.06Å; H345-T349 PolarHBondContact O-OG1 3.19Å; G346-T349 PolarHBondContact O-N 2.72Å; L347-T349 PolarHBondContact O-N 2.81Å; T349-A379 HydrophobicContact CG2-CB 4.42Å
350	V	90.3	Very high	87.1	Confident	6 Å²	6	54.3 Å²	54.3	4%	0.036	27%	0.273	C	S	.	.	H	α-helix	trans	-68.4	-40.8	-179.7	174.7	0	0	0	0	112.3	G346 L347 R352 T353 R354 L372 S375 L376 A379	G346-V350 WeakPolarHBondContact O-CG2 3.4Å; G346-V350 PolarHBondContact O-N 3.34Å; L347-V350 PolarHBondContact O-N 2.86Å; V350-R352 PolarHBondContact O-N 2.74Å; V350-R352 VanDerWaalsContact O-N 3.1Å; V350-T353 PolarHBondContact O-N 3.04Å; V350-T353 PolarHBondContact O-OG1 3.44Å; V350-R354 HydrophobicContact CG1-CB 4.25Å; V350-R354 PolarHBondContact O-N 3.01Å; V350-L372 HydrophobicContact CG1-CD1 3.52Å; V350-L372 HydrophobicContact CG1-CG 4.05Å; V350-S375 WeakPolarHBondContact CG2-O 3.49Å; V350-L376 HydrophobicContact CG2-CD1 4.5Å; V350-A379 HydrophobicContact CG2-CB 3.41Å; V350-A379 VanDerWaalsContact CG2-CB 3.41Å
351	T	88.2	Confident	86.7	Confident	20 Å²	20	54.5 Å²	54.5	12%	0.123	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-13	-174.9	57	0	0	0	0	114.6	T83 L84 L347 T353 R354 L356	T83-T351 PolarHBondContact OG1-OG1 2.92Å; L84-T351 HydrophobicContact CD1-CG2 4.04Å; L84-T351 WeakPolarHBondContact CD1-OG1 3.06Å; L84-T351 HydrophobicContact CD2-CG2 4.15Å; L84-T351 HydrophobicContact CG-CG2 4.31Å; L347-T351 WeakPolarHBondContact O-CG2 3.1Å; L347-T351 PolarHBondContact O-N 2.69Å; L347-T351 PolarHBondContact O-OG1 2.9Å; L347-T351 VanDerWaalsContact O-OG1 3.12Å; T351-T353 PolarHBondContact O-N 3.48Å; T351-R354 WeakPolarHBondContact CA-O 3.24Å; T351-L356 HydrophobicContact CG2-CB 3.96Å
352	R	86.4	Confident	86.5	Confident	183 Å²	183	55 Å²	55	69%	0.691	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-16.5	166.9	-65.4	169.5	-176.8	-155.5	-3	113.8	S348 V350	S348-R352 WeakPolarHBondContact O-CG 3.45Å; S348-R352 PolarHBondContact O-NE 3.16Å; V350-R352 PolarHBondContact O-N 2.74Å; V350-R352 VanDerWaalsContact O-N 3.1Å
353	T	85	Confident	86.3	Confident	116 Å²	116	56.1 Å²	56.1	71%	0.712	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.5	-24.3	-172.4	66.3	0	0	0	0	114.4	V350 T351	V350-T353 PolarHBondContact O-N 3.04Å; V350-T353 PolarHBondContact O-OG1 3.44Å; T351-T353 PolarHBondContact O-N 3.48Å
354	R	84.8	Confident	85.9	Confident	121 Å²	121	64.6 Å²	64.6	46%	0.457	33%	0.326	S	S	.	.	S	Bend	trans	-140.5	134.6	179.4	-65	-176.5	178.8	-154.2	-3.1	109.8	V350 T351 P371 L372 S375	V350-R354 HydrophobicContact CG1-CB 4.25Å; V350-R354 PolarHBondContact O-N 3.01Å; T351-R354 WeakPolarHBondContact CA-O 3.24Å; R354-P371 PolarHBondContact NH1-O 3.44Å; R354-L372 HydrophobicContact CB-CD1 3.54Å; R354-L372 HydrophobicContact CG-CD1 4.35Å; R354-S375 VanDerWaalsContact CZ-OG 3.27Å; R354-S375 PolarHBondContact NH1-OG 2.89Å; R354-S375 VanDerWaalsContact NH1-OG 3.08Å
355	P	82.8	Confident	85.4	Confident	96 Å²	96	73.2 Å²	73.2	62%	0.623	36%	0.358	S	S	*	.			trans	-62.9	141.7	177.8	27.3	-34.6	0	0	0	110.9	L357	P355-L357 HydrophobicContact CB-CG 4.47Å; P355-L357 HydrophobicContact CG-CD1 4.22Å; P355-L357 HydrophobicContact CG-CG 4.44Å; P355-L357 PolarHBondContact O-N 3.34Å
356	L	80.1	Confident	84.4	Confident	20 Å²	20	76.3 Å²	76.3	11%	0.105	38%	0.383	C	S	.	.			trans	-72.9	109.7	172.8	-177.4	57.2	0	0	0	109.2	I50 L84 I117 L347 T351 P358 W370 L372	I50-L356 HydrophobicContact CD1-CD2 3.43Å; I50-L356 VanDerWaalsContact CD1-CD2 3.43Å; I50-L356 HydrophobicContact CG1-CD2 3.95Å; L84-L356 HydrophobicContact CD2-CD2 4.32Å; I117-L356 HydrophobicContact CG2-CD1 4.28Å; L347-L356 HydrophobicContact CD1-CD1 3.97Å; L347-L356 HydrophobicContact CD1-CD2 4.31Å; T351-L356 HydrophobicContact CG2-CB 3.96Å; L356-P358 HydrophobicContact CD1-CG 4.42Å; L356-P358 HydrophobicContact CG-CG 4.15Å; L356-W370 HydrophobicContact CD1-CZ2 4.4Å; L356-L372 HydrophobicContact CD1-CD2 3.54Å
357	L	80.2	Confident	83	Confident	122 Å²	122	79.5 Å²	79.5	64%	0.639	40%	0.403	S	S	*	.			trans	-121.5	86.1	176.6	-66.6	172.1	0	0	0	108.8	P355 Q359 W370	P355-L357 HydrophobicContact CB-CG 4.47Å; P355-L357 HydrophobicContact CG-CD1 4.22Å; P355-L357 HydrophobicContact CG-CG 4.44Å; P355-L357 PolarHBondContact O-N 3.34Å; L357-Q359 PolarHBondContact O-N 2.76Å; L357-W370 PolarHBondContact O-NE1 2.91Å
358	P	76.7	Confident	82.2	Confident	64 Å²	64	81.2 Å²	81.2	42%	0.416	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-64.1	122.8	175.5	-17.8	32.5	0	0	0	109.4	L356	L356-P358 HydrophobicContact CD1-CG 4.42Å; L356-P358 HydrophobicContact CG-CG 4.15Å
359	Q	82.2	Confident	82	Confident	76 Å²	76	85.1 Å²	85.1	36%	0.355	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-103.3	129.8	-176.5	-174.9	172.1	-1.2	0	0	109.7	G115 L357 L361 W370	G115-Q359 WeakPolarHBondContact CA-O 3.24Å; L357-Q359 PolarHBondContact O-N 2.76Å; Q359-L361 HydrophobicContact CG-CD2 4.21Å; Q359-L361 PolarHBondContact O-N 3.16Å; Q359-W370 HydrophobicContact CB-CG 4.49Å
360	K	85.3	Confident	81.9	Confident	158 Å²	158	82 Å²	82	69%	0.687	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-71.3	120.3	168.5	-66.6	-174.1	170	-168.9	0	108.8	D113	D113-K360 VanDerWaalsContact O-CD 3.26Å; D113-K360 WeakPolarHBondContact O-CD 3.26Å; D113-K360 WeakPolarHBondContact O-CG 3.22Å
361	L	84.3	Confident	81.7	Confident	5 Å²	5	86.3 Å²	86.3	3%	0.026	45%	0.449	C	S	.	.			trans	-114	136.8	-173.7	-66.9	162.1	0	0	0	108.2	L112 D113 F138 Q359 W370	L112-L361 CarbonylContact C-O 3.51Å; L112-L361 HydrophobicContact CB-CB 4.17Å; L112-L361 VanDerWaalsContact CB-O 3.28Å; L112-L361 WeakPolarHBondContact CB-O 3.42Å; L112-L361 HydrophobicContact CD2-CB 4.19Å; L112-L361 HydrophobicContact CD2-CD1 4.07Å; L112-L361 PolarHBondContact O-N 2.99Å; L112-L361 VanDerWaalsContact O-N 3.13Å; D113-L361 WeakPolarHBondContact CA-O 3.18Å; D113-L361 PolarHBondContact N-O 2.81Å; D113-L361 VanDerWaalsContact N-O 3.1Å; F138-L361 HydrophobicContact CB-CD1 4.08Å; F138-L361 HydrophobicContact CB-CD2 4.46Å; F138-L361 HydrophobicContact CD1-CB 4.45Å; F138-L361 HydrophobicContact CD1-CD2 4.12Å; Q359-L361 HydrophobicContact CG-CD2 4.21Å; Q359-L361 PolarHBondContact O-N 3.16Å; L361-W370 HydrophobicContact CD1-CB 4.41Å
362	S	85.3	Confident	81.7	Confident	22 Å²	22	85.9 Å²	85.9	15%	0.154	45%	0.446	C	S	.	.			trans	-130	132	-174.5	-165.2	0	0	0	0	111.3	D113 E364 R365	D113-S362 WeakPolarHBondContact OD1-CA 3.45Å; D113-S362 WeakPolarHBondContact OD1-CB 3.37Å; D113-S362 PolarHBondContact OD1-OG 3.01Å; S362-E364 VanDerWaalsContact C-N 3.28Å; S362-E364 PolarHBondContact O-N 2.81Å; S362-R365 PolarHBondContact O-N 2.8Å
363	C	86.9	Confident	81.9	Confident	25 Å²	25	77.1 Å²	77.1	17%	0.169	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-26.9	-174.2	-73.1	0	0	0	0	114.5	C109 R137 R365	C109-C363 WeakPolarHBondContact CA-SG 3.46Å; C109-C363 HydrophobicContact CB-CB 3.77Å; C109-C363 WeakPolarHBondContact CB-SG 3.47Å; C109-C363 WeakPolarHBondContact SG-CB 3.46Å; C109-C363 CovalentContact SG-SG 2.03Å; C109-C363 PolarHBondContact SG-SG 2.95Å; R137-C363 PolarHBondContact NH2-O 2.87Å; C363-R365 VanDerWaalsContact C-N 3.35Å
364	E	84.8	Confident	82.2	Confident	184 Å²	184	75 Å²	75	86%	0.86	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-22.5	-178.5	-59.2	-179.9	166.4	0	0	112.8	S362	S362-E364 VanDerWaalsContact C-N 3.28Å; S362-E364 PolarHBondContact O-N 2.81Å
365	R	79.4	Confident	82.5	Confident	180 Å²	180	70.4 Å²	70.4	68%	0.679	38%	0.383	S	S	*	.	S	Bend	trans	-90.9	152.2	-176.6	-63.9	-177.2	-173.3	167.2	4.4	111.1	R137 S362 C363	R137-R365 PolarHBondContact NH2-O 2.74Å; S362-R365 PolarHBondContact O-N 2.8Å; C363-R365 VanDerWaalsContact C-N 3.35Å
366	P	68.7	Low	83	Confident	117 Å²	117	65.9 Å²	65.9	76%	0.76	35%	0.354	S	S	*	.			trans	-56.9	138.1	170.1	24.3	-33.6	0	0	0	109.7	G368	P366-G368 PolarHBondContact O-N 2.94Å; P366-G368 VanDerWaalsContact O-N 3.13Å
367	P	62.6	Low	83.6	Confident	67 Å²	67	65 Å²	65	44%	0.435	35%	0.349	S	S	.	.			trans	-71.3	111.7	-166	26.7	-33.9	0	0	0	112.5	R137 F138	R137-P367 HydrophobicContact CG-CB 3.88Å; R137-P367 HydrophobicContact CG-CG 4.19Å; R137-P367 WeakPolarHBondContact O-CB 3.36Å; F138-P367 HydrophobicContact CD1-CB 4.07Å; F138-P367 HydrophobicContact CE1-CB 3.91Å
368	G	73.5	Confident	84.2	Confident	36 Å²	36	63.1 Å²	63.1	37%	0.371	34%	0.34	S	S	.	.			trans	-75.5	120.3	153.8	0	0	0	0	0	109.1	P366	P366-G368 PolarHBondContact O-N 2.94Å; P366-G368 VanDerWaalsContact O-N 3.13Å
369	L	84.7	Confident	84.9	Confident	99 Å²	99	60.5 Å²	60.5	52%	0.518	32%	0.323	S	S	.	.			trans	-66.6	127.8	168	-71.9	165.1	0	0	0	109	P371	L369-P371 WeakPolarHBondContact O-CD 3.39Å
370	W	88	Confident	85.3	Confident	5 Å²	5	57.2 Å²	57.2	2%	0.019	31%	0.308	C	S	.	.			trans	-66.4	113.7	176.7	-178.8	44.9	0	0	0	110.1	I117 F138 L140 P141 L356 L357 Q359 L361 L372 G373 L376	I117-W370 HydrophobicContact CB-CH2 3.71Å; I117-W370 HydrophobicContact CB-CZ2 4.49Å; I117-W370 HydrophobicContact CB-CZ3 4.26Å; I117-W370 HydrophobicContact CG2-CH2 3.77Å; I117-W370 HydrophobicContact CG2-CZ2 4.08Å; I117-W370 WeakPolarHBondContact O-CZ3 3.39Å; F138-W370 PolarHBondContact O-N 2.95Å; L140-W370 HydrophobicContact CD1-CE3 4.1Å; L140-W370 HydrophobicContact CD1-CZ3 4.35Å; P141-W370 HydrophobicContact CG-CZ3 4.36Å; L356-W370 HydrophobicContact CD1-CZ2 4.4Å; L357-W370 PolarHBondContact O-NE1 2.91Å; Q359-W370 HydrophobicContact CB-CG 4.49Å; L361-W370 HydrophobicContact CD1-CB 4.41Å; W370-L372 HydrophobicContact CD2-CB 4.24Å; W370-L372 HydrophobicContact CH2-CB 4.17Å; W370-L372 HydrophobicContact CH2-CD2 4.17Å; W370-L372 HydrophobicContact CZ2-CB 3.74Å; W370-L372 HydrophobicContact CZ2-CD2 3.82Å; W370-L372 HydrophobicContact CZ2-CG 4.32Å; W370-L372 PolarHBondContact O-N 2.96Å; W370-G373 PolarHBondContact O-N 2.99Å; W370-L376 HydrophobicContact CH2-CD2 3.92Å; W370-L376 HydrophobicContact CZ3-CD2 4.05Å
371	P	85.4	Confident	85.6	Confident	96 Å²	96	50.7 Å²	50.7	62%	0.623	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-17.8	-165.6	-25.4	36	0	0	0	115.3	R354 L369	R354-P371 PolarHBondContact NH1-O 3.44Å; L369-P371 WeakPolarHBondContact O-CD 3.39Å
372	L	89.3	Confident	85.9	Confident	11 Å²	11	54.5 Å²	54.5	6%	0.058	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-25.2	178.1	-158.4	67.7	0	0	0	112.8	V350 R354 L356 W370 L374 S375 L376	V350-L372 HydrophobicContact CG1-CD1 3.52Å; V350-L372 HydrophobicContact CG1-CG 4.05Å; R354-L372 HydrophobicContact CB-CD1 3.54Å; R354-L372 HydrophobicContact CG-CD1 4.35Å; L356-L372 HydrophobicContact CD1-CD2 3.54Å; W370-L372 HydrophobicContact CD2-CB 4.24Å; W370-L372 HydrophobicContact CH2-CB 4.17Å; W370-L372 HydrophobicContact CH2-CD2 4.17Å; W370-L372 HydrophobicContact CZ2-CB 3.74Å; W370-L372 HydrophobicContact CZ2-CD2 3.82Å; W370-L372 HydrophobicContact CZ2-CG 4.32Å; W370-L372 PolarHBondContact O-N 2.96Å; L372-L374 PolarHBondContact O-N 2.81Å; L372-S375 CarbonylContact O-C 3.59Å; L372-S375 WeakPolarHBondContact O-CA 3.38Å; L372-S375 WeakPolarHBondContact O-CB 3.43Å; L372-S375 PolarHBondContact O-N 2.88Å; L372-L376 PolarHBondContact O-N 2.81Å
373	G	90.1	Very high	86	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.8	-38.2	-167.7	0	0	0	0	0	114.1	G139 W370 L376 I377	G139-G373 WeakPolarHBondContact O-CA 3.25Å; W370-G373 PolarHBondContact O-N 2.99Å; G373-L376 PolarHBondContact O-N 3.05Å; G373-I377 WeakPolarHBondContact O-CG2 3.39Å; G373-I377 PolarHBondContact O-N 2.83Å
374	L	90.4	Very high	85.8	Confident	70 Å²	70	55.4 Å²	55.4	37%	0.366	32%	0.316	S	S	.	.	H	α-helix	trans	-67.8	-35.1	174.2	-174.8	59.1	0	0	0	112.2	T155 Y156 L372 I377 N378	T155-L374 HydrophobicContact CG2-CD1 4.01Å; Y156-L374 HydrophobicContact CE1-CB 3.77Å; Y156-L374 HydrophobicContact CE1-CD1 4.09Å; L372-L374 PolarHBondContact O-N 2.81Å; L374-I377 HydrophobicContact CD1-CG2 4.27Å; L374-N378 VanDerWaalsContact O-CB 3.26Å; L374-N378 WeakPolarHBondContact O-CB 3.4Å; L374-N378 PolarHBondContact O-N 2.88Å; L374-N378 PolarHBondContact O-ND2 2.8Å
375	S	91.7	Very high	85.4	Confident	26 Å²	26	47.9 Å²	47.9	18%	0.182	28%	0.284	C	S	.	.	H	α-helix	trans	-70.2	-39.9	174.2	-58.2	0	0	0	0	111.4	V350 R354 L372 A379	V350-S375 WeakPolarHBondContact CG2-O 3.49Å; R354-S375 VanDerWaalsContact CZ-OG 3.27Å; R354-S375 PolarHBondContact NH1-OG 2.89Å; R354-S375 VanDerWaalsContact NH1-OG 3.08Å; L372-S375 CarbonylContact O-C 3.59Å; L372-S375 WeakPolarHBondContact O-CA 3.38Å; L372-S375 WeakPolarHBondContact O-CB 3.43Å; L372-S375 PolarHBondContact O-N 2.88Å; S375-A379 VanDerWaalsContact O-CB 3.31Å; S375-A379 WeakPolarHBondContact O-CB 3.42Å; S375-A379 PolarHBondContact O-N 2.95Å
376	L	93	Very high	85.2	Confident	1 Å²	1	48 Å²	48	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-65.9	-51.2	179	-175.4	53.3	0	0	0	111.7	I117 P141 L343 L347 V350 W370 L372 G373 N378 A379 V380	I117-L376 HydrophobicContact CB-CD2 4.39Å; I117-L376 HydrophobicContact CD1-CD2 4.39Å; P141-L376 HydrophobicContact CG-CB 4.23Å; P141-L376 HydrophobicContact CG-CD2 4.16Å; P141-L376 HydrophobicContact CG-CG 4.19Å; L343-L376 HydrophobicContact CD1-CD1 4.45Å; L343-L376 HydrophobicContact CD1-CD2 4.29Å; L343-L376 HydrophobicContact CD1-CG 4.45Å; L347-L376 HydrophobicContact CB-CD1 4.13Å; L347-L376 HydrophobicContact CD1-CD1 4.04Å; L347-L376 HydrophobicContact CD1-CD2 4.11Å; V350-L376 HydrophobicContact CG2-CD1 4.5Å; W370-L376 HydrophobicContact CH2-CD2 3.92Å; W370-L376 HydrophobicContact CZ3-CD2 4.05Å; L372-L376 PolarHBondContact O-N 2.81Å; G373-L376 PolarHBondContact O-N 3.05Å; L376-N378 VanDerWaalsContact C-N 3.32Å; L376-N378 PolarHBondContact O-N 3.11Å; L376-A379 PolarHBondContact O-N 3.39Å; L376-V380 HydrophobicContact CD1-CG2 4.28Å; L376-V380 VanDerWaalsContact O-CG2 3.3Å; L376-V380 WeakPolarHBondContact O-CG2 3.36Å; L376-V380 PolarHBondContact O-N 2.85Å
377	I	92.5	Very high	85.5	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-63	-38.2	178.3	-166.3	67.1	0	0	0	112	P141 Y156 I158 G373 L374 V380 K381	P141-I377 HydrophobicContact CB-CB 4.46Å; P141-I377 HydrophobicContact CB-CD1 4.23Å; P141-I377 HydrophobicContact CG-CB 4.37Å; Y156-I377 HydrophobicContact CD1-CG2 4.26Å; Y156-I377 WeakPolarHBondContact O-CD1 3.4Å; I158-I377 HydrophobicContact CB-CD1 4.03Å; I158-I377 HydrophobicContact CG2-CD1 4.07Å; G373-I377 WeakPolarHBondContact O-CG2 3.39Å; G373-I377 PolarHBondContact O-N 2.83Å; L374-I377 HydrophobicContact CD1-CG2 4.27Å; I377-V380 PolarHBondContact O-N 3.14Å; I377-K381 HydrophobicContact CG1-CD 4.23Å; I377-K381 WeakPolarHBondContact O-CB 3.04Å; I377-K381 VanDerWaalsContact O-CG 3.25Å; I377-K381 WeakPolarHBondContact O-CG 3.3Å; I377-K381 PolarHBondContact O-N 2.91Å
378	N	92.5	Very high	86.1	Confident	82 Å²	82	43.6 Å²	43.6	44%	0.439	26%	0.262	S	S	.	.	H	α-helix	trans	-67	-39.5	176.5	-72.9	-8.4	0	0	0	111.9	L374 L376 K381 S382	L374-N378 VanDerWaalsContact O-CB 3.26Å; L374-N378 WeakPolarHBondContact O-CB 3.4Å; L374-N378 PolarHBondContact O-N 2.88Å; L374-N378 PolarHBondContact O-ND2 2.8Å; L376-N378 VanDerWaalsContact C-N 3.32Å; L376-N378 PolarHBondContact O-N 3.11Å; N378-K381 PolarHBondContact O-N 3.11Å; N378-S382 WeakPolarHBondContact O-CB 3.34Å; N378-S382 PolarHBondContact O-N 2.83Å; N378-S382 PolarHBondContact O-OG 3.34Å
379	A	91.8	Very high	85.8	Confident	8 Å²	8	49 Å²	49	7%	0.066	27%	0.271	C	S	.	.	H	α-helix	trans	-63.3	-46.3	175.1	0	0	0	0	0	111.6	T349 V350 S375 L376 K381 S382 V383	T349-A379 HydrophobicContact CG2-CB 4.42Å; V350-A379 HydrophobicContact CG2-CB 3.41Å; V350-A379 VanDerWaalsContact CG2-CB 3.41Å; S375-A379 VanDerWaalsContact O-CB 3.31Å; S375-A379 WeakPolarHBondContact O-CB 3.42Å; S375-A379 PolarHBondContact O-N 2.95Å; L376-A379 PolarHBondContact O-N 3.39Å; A379-K381 PolarHBondContact O-N 2.86Å; A379-S382 WeakPolarHBondContact CA-OG 3.43Å; A379-S382 CarbonylContact O-C 3.55Å; A379-S382 PolarHBondContact O-N 3Å; A379-S382 VanDerWaalsContact O-N 3.07Å; A379-S382 PolarHBondContact O-OG 2.86Å; A379-V383 WeakPolarHBondContact O-CG2 3.4Å; A379-V383 PolarHBondContact O-N 3.14Å
380	V	92	Very high	85.3	Confident	8 Å²	8	44.7 Å²	44.7	5%	0.048	25%	0.25	C	S	.	.	H	α-helix	trans	-58.9	-45.8	175.4	177.5	0	0	0	0	111	I158 L342 L343 L376 I377 S382 V383	I158-V380 HydrophobicContact CD1-CG1 3.65Å; L342-V380 HydrophobicContact CB-CG1 4.09Å; L342-V380 HydrophobicContact CD2-CG1 4.3Å; L343-V380 HydrophobicContact CD1-CG2 4.44Å; L376-V380 HydrophobicContact CD1-CG2 4.28Å; L376-V380 VanDerWaalsContact O-CG2 3.3Å; L376-V380 WeakPolarHBondContact O-CG2 3.36Å; L376-V380 PolarHBondContact O-N 2.85Å; I377-V380 PolarHBondContact O-N 3.14Å; V380-S382 PolarHBondContact O-N 2.91Å; V380-V383 WeakPolarHBondContact O-CG2 3.4Å; V380-V383 PolarHBondContact O-N 3.41Å
381	K	91.5	Very high	85	Confident	21 Å²	21	45.4 Å²	45.4	9%	0.091	25%	0.254	C	S	.	.	H	α-helix	trans	-61.1	-29.8	174.5	-74.3	171.2	174.2	-174.5	0	113.3	T155 A157 I158 I377 N378 A379 F397 K399 H400 G401	T155-K381 PolarHBondContact O-NZ 3.3Å; A157-K381 WeakPolarHBondContact O-CE 3.43Å; A157-K381 PolarHBondContact O-NZ 2.89Å; I158-K381 HydrophobicContact CD1-CG 4.46Å; I377-K381 HydrophobicContact CG1-CD 4.23Å; I377-K381 WeakPolarHBondContact O-CB 3.04Å; I377-K381 VanDerWaalsContact O-CG 3.25Å; I377-K381 WeakPolarHBondContact O-CG 3.3Å; I377-K381 PolarHBondContact O-N 2.91Å; N378-K381 PolarHBondContact O-N 3.11Å; A379-K381 PolarHBondContact O-N 2.86Å; K381-F397 HydrophobicContact CB-CB 4.42Å; K381-F397 HydrophobicContact CG-CB 4.35Å; K381-K399 PolarHBondContact NZ-O 3Å; K381-H400 WeakPolarHBondContact CE-O 3.42Å; K381-H400 PolarHBondContact NZ-O 2.97Å; K381-G401 VanDerWaalsContact CE-CA 3.43Å
382	S	89.7	Confident	85	Confident	84 Å²	84	40.9 Å²	40.9	59%	0.587	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-0.1	-178.7	70.8	0	0	0	0	115.6	N378 A379 V380 A384	N378-S382 WeakPolarHBondContact O-CB 3.34Å; N378-S382 PolarHBondContact O-N 2.83Å; N378-S382 PolarHBondContact O-OG 3.34Å; A379-S382 WeakPolarHBondContact CA-OG 3.43Å; A379-S382 CarbonylContact O-C 3.55Å; A379-S382 PolarHBondContact O-N 3Å; A379-S382 VanDerWaalsContact O-N 3.07Å; A379-S382 PolarHBondContact O-OG 2.86Å; V380-S382 PolarHBondContact O-N 2.91Å; S382-A384 PolarHBondContact O-N 2.81Å; S382-A384 VanDerWaalsContact O-N 3.13Å
383	V	87.7	Confident	84	Confident	15 Å²	15	42 Å²	42	9%	0.091	23%	0.233	C	C	.	.			trans	-61.5	117.5	177.8	176.7	0	0	0	0	109.4	L342 H345 A379 V380 V388 F395	L342-V383 HydrophobicContact CD2-CB 3.74Å; L342-V383 HydrophobicContact CD2-CG1 4.02Å; L342-V383 HydrophobicContact CD2-CG2 3.99Å; H345-V383 HydrophobicContact CB-CG1 4.45Å; H345-V383 HydrophobicContact CB-CG2 4.19Å; A379-V383 WeakPolarHBondContact O-CG2 3.4Å; A379-V383 PolarHBondContact O-N 3.14Å; V380-V383 WeakPolarHBondContact O-CG2 3.4Å; V380-V383 PolarHBondContact O-N 3.41Å; V383-V388 HydrophobicContact CG1-CB 4.06Å; V383-V388 HydrophobicContact CG1-CG2 3.53Å; V383-F395 HydrophobicContact CG1-CE2 4.37Å
384	A	83.3	Confident	83.6	Confident	52 Å²	52	42.9 Å²	42.9	43%	0.43	24%	0.239	S	C	.	.			trans	-71.8	134.3	178.6	0	0	0	0	0	110.6	S382 E386 T387	S382-A384 PolarHBondContact O-N 2.81Å; S382-A384 VanDerWaalsContact O-N 3.13Å; A384-E386 PolarHBondContact O-N 3.22Å; A384-T387 HydrophobicContact CB-CG2 4.33Å; A384-T387 PolarHBondContact O-N 3.06Å; A384-T387 PolarHBondContact O-OG1 2.62Å
385	S	75.8	Confident	83.5	Confident	25 Å²	25	39.7 Å²	39.7	18%	0.175	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-16.9	-176.6	-159.7	0	0	0	0	114.8	T387 P394 F395	S385-T387 VanDerWaalsContact C-N 3.34Å; S385-P394 WeakPolarHBondContact OG-CA 3.39Å; S385-P394 WeakPolarHBondContact OG-CB 3.15Å; S385-F395 WeakPolarHBondContact CB-O 3.47Å; S385-F395 PolarHBondContact OG-N 3.35Å
386	E	75.5	Confident	83.4	Confident	183 Å²	183	43.1 Å²	43.1	86%	0.855	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-28.3	172.9	-62.2	178.8	179	0	0	112.3	A384	A384-E386 PolarHBondContact O-N 3.22Å
387	T	74.6	Confident	83.3	Confident	87 Å²	87	43.9 Å²	43.9	53%	0.534	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-18.5	-175.2	66.5	0	0	0	0	114	A384 S385	A384-T387 HydrophobicContact CB-CG2 4.33Å; A384-T387 PolarHBondContact O-N 3.06Å; A384-T387 PolarHBondContact O-OG1 2.62Å; S385-T387 VanDerWaalsContact C-N 3.34Å
388	V	74.7	Confident	83.1	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.024	25%	0.245	C	C	.	.			trans	-136.8	110.8	177.8	177.5	0	0	0	0	109.2	I341 H345 V383 G390 F395	I341-V388 HydrophobicContact CB-CG1 4.37Å; I341-V388 HydrophobicContact CG2-CG1 3.52Å; I341-V388 HydrophobicContact CG2-CG2 4.47Å; H345-V388 HydrophobicContact CB-CG2 3.94Å; H345-V388 VanDerWaalsContact CD2-CG2 3.49Å; H345-V388 WeakPolarHBondContact CD2-CG2 3.47Å; H345-V388 WeakPolarHBondContact ND1-CG2 3.49Å; V383-V388 HydrophobicContact CG1-CB 4.06Å; V383-V388 HydrophobicContact CG1-CG2 3.53Å; V388-G390 PolarHBondContact O-N 3.49Å; V388-F395 HydrophobicContact CB-CE2 4.48Å; V388-F395 HydrophobicContact CB-CZ 3.78Å; V388-F395 HydrophobicContact CG1-CE1 4.22Å; V388-F395 HydrophobicContact CG1-CZ 3.63Å
389	R	67.9	Low	82.9	Confident	151 Å²	151	49.8 Å²	49.8	57%	0.57	26%	0.259	S	S	*	.			trans	-88.6	92.5	170.8	-66.9	-177.3	-178.2	-172.1	1.6	108.7
390	G	74.3	Confident	82.7	Confident	8 Å²	8	51.3 Å²	51.3	8%	0.082	26%	0.264	C	S	.	.			trans	-68.8	156.9	168.4	0	0	0	0	0	111.9	D338 V388 T392 S393	D338-G390 VanDerWaalsContact CG-CA 3.44Å; D338-G390 VanDerWaalsContact OD1-C 3.3Å; D338-G390 WeakPolarHBondContact OD1-CA 3.4Å; D338-G390 WeakPolarHBondContact OD2-CA 3.41Å; V388-G390 PolarHBondContact O-N 3.49Å; G390-T392 PolarHBondContact O-N 2.91Å; G390-T392 VanDerWaalsContact O-N 3.14Å; G390-S393 WeakPolarHBondContact O-CB 3.49Å; G390-S393 PolarHBondContact O-N 2.93Å
391	L	81.9	Confident	82.6	Confident	20 Å²	20	50.9 Å²	50.9	11%	0.105	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-18.7	169.1	-64.6	176.6	0	0	0	112.3	P293 M308 F333 Y337 D338	P293-L391 WeakPolarHBondContact CD-O 3.39Å; M308-L391 HydrophobicContact CE-CD2 4.13Å; F333-L391 HydrophobicContact CD1-CD1 4.17Å; F333-L391 HydrophobicContact CE1-CD1 3.86Å; Y337-L391 HydrophobicContact CD1-CD1 3.64Å; Y337-L391 HydrophobicContact CD1-CG 3.78Å; Y337-L391 HydrophobicContact CD2-CD1 4.43Å; Y337-L391 HydrophobicContact CE1-CD1 4.2Å; Y337-L391 HydrophobicContact CE1-CG 4.09Å; Y337-L391 HydrophobicContact CG-CD1 3.78Å; Y337-L391 HydrophobicContact CG-CG 4.43Å; D338-L391 PolarHBondContact OD1-N 2.82Å; D338-L391 PolarHBondContact OD2-N 2.77Å
392	T	83.8	Confident	82.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.2	17.1	172.5	70.6	0	0	0	0	114.1	I291 I331 L335 D338 G390 R403	I291-T392 WeakPolarHBondContact O-CA 3.39Å; I291-T392 WeakPolarHBondContact O-CB 3.39Å; I331-T392 HydrophobicContact CD1-CG2 3.8Å; L335-T392 HydrophobicContact CD2-CG2 3.77Å; L335-T392 HydrophobicContact CG-CG2 4.36Å; D338-T392 WeakPolarHBondContact OD2-CB 3.26Å; D338-T392 PolarHBondContact OD2-N 3.46Å; D338-T392 PolarHBondContact OD2-OG1 3.43Å; G390-T392 PolarHBondContact O-N 2.91Å; G390-T392 VanDerWaalsContact O-N 3.14Å; T392-R403 PolarHBondContact O-NH2 2.63Å; T392-R403 PolarHBondContact OG1-NH1 2.82Å; T392-R403 PolarHBondContact OG1-NH2 2.67Å; T392-R403 VanDerWaalsContact OG1-NH2 3.1Å
393	S	69.6	Low	82.5	Confident	34 Å²	34	47.3 Å²	47.3	24%	0.238	24%	0.237	C	C	.	.			trans	-48	143	-176.1	171.6	0	0	0	0	114	G390	G390-S393 WeakPolarHBondContact O-CB 3.49Å; G390-S393 PolarHBondContact O-N 2.93Å
394	P	81.9	Confident	82.6	Confident	20 Å²	20	47.9 Å²	47.9	13%	0.13	24%	0.24	C	C	.	.			cis	-87	171.4	0.7	34.6	-36.6	0	0	0	113.9	S385 R403 L405 F406 D407	S385-P394 WeakPolarHBondContact OG-CA 3.39Å; S385-P394 WeakPolarHBondContact OG-CB 3.15Å; P394-R403 PolarHBondContact O-NH2 2.77Å; P394-L405 HydrophobicContact CB-CD2 4.19Å; P394-L405 HydrophobicContact CB-CG 4.45Å; P394-L405 HydrophobicContact CG-CD2 4.32Å; P394-L405 HydrophobicContact CG-CG 4.15Å; P394-F406 WeakPolarHBondContact O-CA 3.42Å; P394-D407 WeakPolarHBondContact CD-OD2 3.09Å; P394-D407 HydrophobicContact CG-CB 4.46Å
395	F	87.1	Confident	83	Confident	3 Å²	3	46.5 Å²	46.5	1%	0.013	23%	0.225	C	C	.	.			trans	-141	149.6	169.2	51.1	-113.5	0	0	0	114.5	L342 V383 S385 V388 F397 L405	L342-F395 HydrophobicContact CD1-CD2 4.47Å; L342-F395 HydrophobicContact CD1-CE1 4.18Å; L342-F395 HydrophobicContact CD1-CE2 4.16Å; L342-F395 HydrophobicContact CD1-CZ 3.97Å; L342-F395 HydrophobicContact CD2-CD2 4.35Å; L342-F395 HydrophobicContact CD2-CE2 3.56Å; L342-F395 HydrophobicContact CD2-CZ 3.76Å; L342-F395 HydrophobicContact CG-CE1 4.34Å; L342-F395 HydrophobicContact CG-CE2 4.02Å; L342-F395 HydrophobicContact CG-CZ 3.74Å; V383-F395 HydrophobicContact CG1-CE2 4.37Å; S385-F395 WeakPolarHBondContact CB-O 3.47Å; S385-F395 PolarHBondContact OG-N 3.35Å; V388-F395 HydrophobicContact CB-CE2 4.48Å; V388-F395 HydrophobicContact CB-CZ 3.78Å; V388-F395 HydrophobicContact CG1-CE1 4.22Å; V388-F395 HydrophobicContact CG1-CZ 3.63Å; F395-F397 HydrophobicContact CB-CE2 4.36Å; F395-F397 HydrophobicContact CB-CZ 4.33Å; F395-F397 AromaticContact CD2-CE2 3.87Å; F395-F397 HydrophobicContact CD2-CE2 3.87Å; F395-F397 HydrophobicContact CD2-CZ 4.49Å; F395-F397 HydrophobicContact CG-CE2 4.28Å; F395-F397 HydrophobicContact CG-CZ 4.47Å; F395-L405 WeakPolarHBondContact CA-O 3.5Å
396	R	90.4	Very high	83.7	Confident	98 Å²	98	45.3 Å²	45.3	37%	0.37	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	132.4	168.5	-175.3	174.1	62.6	-146.7	0.9	108.5	T404 L405 D427	R396-T404 PolarHBondContact O-N 2.95Å; R396-T404 PolarHBondContact O-OG1 2.73Å; R396-L405 HydrophobicContact CB-CB 3.44Å; R396-L405 VanDerWaalsContact CB-CB 3.44Å; R396-L405 HydrophobicContact CB-CD2 4.16Å; R396-L405 HydrophobicContact CB-CG 4.46Å; R396-L405 PolarHBondContact N-O 2.97Å; R396-L405 PolarHBondContact O-N 2.96Å; R396-D427 IonicContact CZ-OD1 3.4Å; R396-D427 IonicContact CZ-OD2 3.59Å; R396-D427 IonicContact NH1-OD1 2.69Å; R396-D427 PolarHBondContact NH1-OD1 3.48Å; R396-D427 IonicContact NH1-OD2 3.57Å; R396-D427 PolarHBondContact NH1-OD2 3.08Å; R396-D427 IonicContact NH2-OD1 3.28Å; R396-D427 PolarHBondContact NH2-OD1 3.31Å; R396-D427 IonicContact NH2-OD2 3.45Å; R396-D427 PolarHBondContact NH2-OD2 3.1Å
397	F	90.9	Very high	84.3	Confident	16 Å²	16	38.6 Å²	38.6	7%	0.07	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	147.7	178	-56.2	-81.1	0	0	0	110.4	I158 L160 L342 K381 F395 L402 R403	I158-F397 HydrophobicContact CD1-CD1 3.82Å; I158-F397 HydrophobicContact CD1-CD2 3.83Å; I158-F397 HydrophobicContact CD1-CE1 3.76Å; I158-F397 HydrophobicContact CD1-CE2 3.78Å; I158-F397 HydrophobicContact CD1-CG 3.86Å; I158-F397 HydrophobicContact CD1-CZ 3.76Å; I158-F397 HydrophobicContact CG1-CD1 3.61Å; I158-F397 HydrophobicContact CG1-CE1 3.64Å; I158-F397 HydrophobicContact CG1-CG 4.09Å; I158-F397 HydrophobicContact CG1-CZ 4.14Å; L160-F397 HydrophobicContact CD1-CZ 4.22Å; L342-F397 HydrophobicContact CD1-CE2 3.78Å; L342-F397 HydrophobicContact CD1-CZ 3.75Å; L342-F397 HydrophobicContact CD2-CE2 4.2Å; K381-F397 HydrophobicContact CB-CB 4.42Å; K381-F397 HydrophobicContact CG-CB 4.35Å; F395-F397 HydrophobicContact CB-CE2 4.36Å; F395-F397 HydrophobicContact CB-CZ 4.33Å; F395-F397 AromaticContact CD2-CE2 3.87Å; F395-F397 HydrophobicContact CD2-CE2 3.87Å; F395-F397 HydrophobicContact CD2-CZ 4.49Å; F395-F397 HydrophobicContact CG-CE2 4.28Å; F395-F397 HydrophobicContact CG-CZ 4.47Å; F397-L402 CarbonylContact C-O 3.59Å; F397-L402 WeakPolarHBondContact CA-O 2.94Å; F397-R403 HydrophobicContact CD1-CB 4.11Å; F397-R403 HydrophobicContact CE1-CB 3.93Å; F397-R403 HydrophobicContact CE1-CG 4.27Å
398	D	88.3	Confident	85	Confident	41 Å²	41	34.6 Å²	34.6	22%	0.219	16%	0.162	C	C	.	.			trans	-78.1	179.9	168.1	97.5	-56.8	0	0	0	111.1	H400 G401 L402 T404	D398-H400 PolarHBondContact O-N 3.39Å; D398-H400 WeakPolarHBondContact OD1-CA 3.39Å; D398-H400 WeakPolarHBondContact OD1-CB 3.3Å; D398-H400 PolarHBondContact OD1-N 3.14Å; D398-H400 WeakPolarHBondContact OD2-CB 3.36Å; D398-H400 IonicContact OD2-CD2 3.17Å; D398-H400 PolarHBondContact OD2-CD2 3.36Å; D398-H400 IonicContact OD2-CG 3.86Å; D398-H400 PolarHBondContact OD2-N 3.02Å; D398-G401 PolarHBondContact O-N 2.72Å; D398-G401 PolarHBondContact OD1-N 2.59Å; D398-L402 PolarHBondContact N-O 2.88Å; D398-L402 WeakPolarHBondContact OD1-CB 2.92Å; D398-L402 PolarHBondContact OD1-N 3.42Å; D398-T404 HydrophobicContact CB-CG2 3.98Å
399	K	88.5	Confident	85.6	Confident	168 Å²	168	34.8 Å²	34.8	73%	0.73	16%	0.164	S	C	*	.	S	Bend	trans	-57.6	-33.8	175.2	64.2	-167.2	175.7	-168.2	0	113.3	K381	K381-K399 PolarHBondContact NZ-O 3Å
400	H	87.9	Confident	86.5	Confident	39 Å²	39	27.7 Å²	27.7	18%	0.181	14%	0.137	C	C	.	.	S	Bend	trans	-76.5	-31.7	178.4	-62.2	-56.1	0	0	0	112.5	T154 K381 D398	T154-H400 WeakPolarHBondContact O-CA 3.36Å; T154-H400 PolarHBondContact O-ND1 3.21Å; T154-H400 PolarHBondContact OG1-O 3.26Å; T154-H400 VanDerWaalsContact OG1-O 3.06Å; K381-H400 WeakPolarHBondContact CE-O 3.42Å; K381-H400 PolarHBondContact NZ-O 2.97Å; D398-H400 PolarHBondContact O-N 3.39Å; D398-H400 WeakPolarHBondContact OD1-CA 3.39Å; D398-H400 WeakPolarHBondContact OD1-CB 3.3Å; D398-H400 PolarHBondContact OD1-N 3.14Å; D398-H400 WeakPolarHBondContact OD2-CB 3.36Å; D398-H400 IonicContact OD2-CD2 3.17Å; D398-H400 PolarHBondContact OD2-CD2 3.36Å; D398-H400 IonicContact OD2-CG 3.86Å; D398-H400 PolarHBondContact OD2-N 3.02Å
401	G	88.6	Confident	87.1	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	114.8	11.6	-179.4	0	0	0	0	0	113.6	H159 K381 D398	H159-G401 PolarHBondContact N-O 2.95Å; K381-G401 VanDerWaalsContact CE-CA 3.43Å; D398-G401 PolarHBondContact O-N 2.72Å; D398-G401 PolarHBondContact OD1-N 2.59Å
402	L	90	Very high	87.3	Confident	28 Å²	28	27.7 Å²	27.7	15%	0.147	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	134.3	175.7	-58.7	171.2	0	0	0	109.4	H159 F397 D398 T404	H159-L402 HydrophobicContact CB-CD2 4.36Å; F397-L402 CarbonylContact C-O 3.59Å; F397-L402 WeakPolarHBondContact CA-O 2.94Å; D398-L402 PolarHBondContact N-O 2.88Å; D398-L402 WeakPolarHBondContact OD1-CB 2.92Å; D398-L402 PolarHBondContact OD1-N 3.42Å; L402-T404 PolarHBondContact O-N 3.02Å
403	R	90.6	Very high	87.4	Confident	1 Å²	1	28.8 Å²	28.8	0%	0.004	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	116.2	178.1	-173.1	175.4	178	172.4	0.9	111.1	L160 H161 S163 T392 P394 F397 L405 F406	L160-R403 WeakPolarHBondContact O-CD 3.1Å; L160-R403 PolarHBondContact O-NH1 2.86Å; H161-R403 WeakPolarHBondContact O-CB 3.35Å; S163-R403 PolarHBondContact N-O 3.17Å; T392-R403 PolarHBondContact O-NH2 2.63Å; T392-R403 PolarHBondContact OG1-NH1 2.82Å; T392-R403 PolarHBondContact OG1-NH2 2.67Å; T392-R403 VanDerWaalsContact OG1-NH2 3.1Å; P394-R403 PolarHBondContact O-NH2 2.77Å; F397-R403 HydrophobicContact CD1-CB 4.11Å; F397-R403 HydrophobicContact CE1-CB 3.93Å; F397-R403 HydrophobicContact CE1-CG 4.27Å; R403-L405 WeakPolarHBondContact CG-O 3.29Å; R403-L405 PolarHBondContact NE-O 3.33Å; R403-F406 HydrophobicContact CG-CD1 4.39Å
404	T	90.1	Very high	87.9	Confident	28 Å²	28	29.8 Å²	29.8	17%	0.172	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-34.2	-177.3	53.8	0	0	0	0	113.3	R396 D398 L402 I426	R396-T404 PolarHBondContact O-N 2.95Å; R396-T404 PolarHBondContact O-OG1 2.73Å; D398-T404 HydrophobicContact CB-CG2 3.98Å; L402-T404 PolarHBondContact O-N 3.02Å; T404-I426 WeakPolarHBondContact O-CG2 3.44Å
405	L	90.7	Very high	87.6	Confident	22 Å²	22	34.9 Å²	34.9	12%	0.115	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134	171.6	-172.9	69	0	0	0	110.1	P394 F395 R396 R403 N425 I426	P394-L405 HydrophobicContact CB-CD2 4.19Å; P394-L405 HydrophobicContact CB-CG 4.45Å; P394-L405 HydrophobicContact CG-CD2 4.32Å; P394-L405 HydrophobicContact CG-CG 4.15Å; F395-L405 WeakPolarHBondContact CA-O 3.5Å; R396-L405 HydrophobicContact CB-CB 3.44Å; R396-L405 VanDerWaalsContact CB-CB 3.44Å; R396-L405 HydrophobicContact CB-CD2 4.16Å; R396-L405 HydrophobicContact CB-CG 4.46Å; R396-L405 PolarHBondContact N-O 2.97Å; R396-L405 PolarHBondContact O-N 2.96Å; R403-L405 WeakPolarHBondContact CG-O 3.29Å; R403-L405 PolarHBondContact NE-O 3.33Å; L405-N425 HydrophobicContact CD1-CB 3.94Å; L405-I426 HydrophobicContact CB-CG2 4.48Å; L405-I426 HydrophobicContact CD1-CG2 3.95Å
406	F	90.1	Very high	86.7	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.205	C	C	.	.			trans	-169.1	151.7	172.8	51	-83	0	0	0	107.2	P162 I291 P394 R403 L408 W424 N425	P162-F406 HydrophobicContact CB-CD1 3.83Å; P162-F406 HydrophobicContact CB-CD2 4.31Å; P162-F406 HydrophobicContact CB-CE1 3.55Å; P162-F406 HydrophobicContact CB-CE2 4.02Å; P162-F406 HydrophobicContact CB-CG 4.23Å; P162-F406 HydrophobicContact CB-CZ 3.65Å; P162-F406 HydrophobicContact CG-CD1 3.88Å; P162-F406 HydrophobicContact CG-CD2 3.84Å; P162-F406 HydrophobicContact CG-CE1 4.06Å; P162-F406 HydrophobicContact CG-CE2 3.98Å; P162-F406 HydrophobicContact CG-CG 3.8Å; P162-F406 HydrophobicContact CG-CZ 4.11Å; I291-F406 HydrophobicContact CG2-CB 4.44Å; I291-F406 HydrophobicContact CG2-CD2 3.83Å; I291-F406 HydrophobicContact CG2-CG 4.47Å; P394-F406 WeakPolarHBondContact O-CA 3.42Å; R403-F406 HydrophobicContact CG-CD1 4.39Å; F406-L408 HydrophobicContact CD2-CB 4.11Å; F406-L408 HydrophobicContact CE2-CB 3.95Å; F406-L408 HydrophobicContact CE2-CD1 4.14Å; F406-L408 HydrophobicContact CE2-CG 4.48Å; F406-L408 PolarHBondContact O-N 3.08Å; F406-W424 HydrophobicContact CE1-CZ3 4.42Å; F406-W424 HydrophobicContact CE2-CE3 4.27Å; F406-W424 AromaticContact CE2-CZ3 3.94Å; F406-W424 HydrophobicContact CE2-CZ3 3.94Å; F406-W424 HydrophobicContact CZ-CE3 4.48Å; F406-W424 AromaticContact CZ-CZ3 3.71Å; F406-W424 HydrophobicContact CZ-CZ3 3.71Å; F406-N425 WeakPolarHBondContact O-CB 3.4Å
407	D	88.5	Confident	86	Confident	43 Å²	43	34.5 Å²	34.5	23%	0.23	19%	0.194	C	C	.	.			trans	-92.3	97.5	175.3	-82.6	-4.5	0	0	0	109.2	P394 T409 V423 N425	P394-D407 WeakPolarHBondContact CD-OD2 3.09Å; P394-D407 HydrophobicContact CG-CB 4.46Å; D407-T409 PolarHBondContact O-N 2.88Å; D407-T409 PolarHBondContact O-OG1 2.93Å; D407-V423 HydrophobicContact CB-CG1 3.56Å; D407-N425 WeakPolarHBondContact OD1-CB 3.4Å; D407-N425 PolarHBondContact OD1-ND2 3.15Å
408	L	89.3	Confident	85.5	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	92.7	174.6	-169.4	69.6	0	0	0	108.9	Y167 W268 I289 I291 F406 V423 W424	Y167-L408 HydrophobicContact CD2-CD1 4.05Å; Y167-L408 HydrophobicContact CE2-CD1 4.1Å; W268-L408 HydrophobicContact CH2-CD1 3.88Å; W268-L408 HydrophobicContact CZ3-CD1 3.83Å; I289-L408 HydrophobicContact CG2-CD1 3.38Å; I289-L408 HydrophobicContact CG2-CD2 4.49Å; I289-L408 HydrophobicContact CG2-CG 3.77Å; I291-L408 HydrophobicContact CG2-CD1 4.25Å; F406-L408 HydrophobicContact CD2-CB 4.11Å; F406-L408 HydrophobicContact CE2-CB 3.95Å; F406-L408 HydrophobicContact CE2-CD1 4.14Å; F406-L408 HydrophobicContact CE2-CG 4.48Å; F406-L408 PolarHBondContact O-N 3.08Å; L408-V423 WeakPolarHBondContact O-CA 3.48Å; L408-W424 HydrophobicContact CB-CB 4.19Å; L408-W424 HydrophobicContact CB-CE3 4.08Å; L408-W424 WeakPolarHBondContact CB-O 3.21Å; L408-W424 HydrophobicContact CD2-CE3 4.35Å; L408-W424 PolarHBondContact N-O 2.97Å; L408-W424 PolarHBondContact O-N 3.43Å
409	T	87.4	Confident	85	Confident	8 Å²	8	36.9 Å²	36.9	5%	0.049	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	123.3	-176.4	-58	0	0	0	0	110.5	S290 D407 L411 P420 G422 V423	S290-T409 PolarHBondContact N-O 2.96Å; S290-T409 WeakPolarHBondContact O-CA 3.22Å; S290-T409 WeakPolarHBondContact O-CB 3.47Å; S290-T409 PolarHBondContact O-N 3.43Å; D407-T409 PolarHBondContact O-N 2.88Å; D407-T409 PolarHBondContact O-OG1 2.93Å; T409-L411 HydrophobicContact CG2-CD2 3.91Å; T409-P420 HydrophobicContact CG2-CB 4Å; T409-G422 WeakPolarHBondContact CA-O 3.22Å; T409-V423 HydrophobicContact CG2-CG2 4.4Å
410	T	87.6	Confident	84.6	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.012	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.4	173.1	62	0	0	0	0	109.8	Y174 P420 T421 G422 M430	Y174-T410 HydrophobicContact CD1-CG2 3.73Å; Y174-T410 HydrophobicContact CD2-CG2 3.86Å; Y174-T410 HydrophobicContact CE1-CG2 3.63Å; Y174-T410 HydrophobicContact CE2-CG2 3.82Å; Y174-T410 HydrophobicContact CG-CG2 3.86Å; T410-P420 CarbonylContact O-C 3.59Å; T410-P420 WeakPolarHBondContact O-CA 3.4Å; T410-T421 PolarHBondContact O-N 3.26Å; T410-T421 PolarHBondContact O-OG1 3.43Å; T410-T421 PolarHBondContact OG1-OG1 2.98Å; T410-G422 PolarHBondContact N-O 2.99Å; T410-G422 WeakPolarHBondContact OG1-CA 3.07Å; T410-G422 PolarHBondContact OG1-N 3.22Å; T410-G422 VanDerWaalsContact OG1-N 3.09Å; T410-G422 PolarHBondContact OG1-O 3.06Å; T410-M430 HydrophobicContact CG2-CE 4.24Å
411	L	86.4	Confident	84.1	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	140.7	-176.7	-57.7	176.6	0	0	0	110.2	A271 K287 A288 T409 F418 K419 P420	A271-L411 HydrophobicContact CB-CD1 3.92Å; K287-L411 CarbonylContact C-O 3.57Å; K287-L411 WeakPolarHBondContact CA-O 3.44Å; K287-L411 WeakPolarHBondContact CB-O 3.41Å; A288-L411 HydrophobicContact CB-CB 4.41Å; A288-L411 PolarHBondContact N-O 3.35Å; A288-L411 WeakPolarHBondContact O-CB 3.43Å; A288-L411 PolarHBondContact O-N 3.25Å; T409-L411 HydrophobicContact CG2-CD2 3.91Å; L411-F418 HydrophobicContact CB-CB 4.23Å; L411-F418 HydrophobicContact CB-CD1 3.87Å; L411-F418 HydrophobicContact CB-CG 4.38Å; L411-F418 HydrophobicContact CD1-CB 4.37Å; L411-K419 CarbonylContact C-O 3.46Å; L411-K419 WeakPolarHBondContact CA-O 3.36Å; L411-P420 HydrophobicContact CD2-CB 4.21Å
412	E	86.5	Confident	83.7	Confident	28 Å²	28	29.8 Å²	29.8	13%	0.131	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.3	175.6	-175.6	162.7	-130.9	0	0	109.5	K287 T414 F418 K419 T421 Q435	K287-E412 WeakPolarHBondContact CE-OE1 3.29Å; K287-E412 HydrophobicContact CG-CB 4.26Å; K287-E412 HydrophobicContact CG-CG 4.19Å; K287-E412 IonicContact NZ-OE1 3.33Å; E412-T414 PolarHBondContact O-N 3.16Å; E412-F418 WeakPolarHBondContact O-CA 3.47Å; E412-K419 PolarHBondContact N-O 3.4Å; E412-K419 PolarHBondContact O-N 2.8Å; E412-T421 HydrophobicContact CB-CG2 3.45Å; E412-T421 VanDerWaalsContact CB-CG2 3.45Å; E412-T421 HydrophobicContact CG-CG2 4.43Å; E412-T421 WeakPolarHBondContact OE2-CG2 3.39Å; E412-Q435 PolarHBondContact OE2-NE2 3.49Å
413	L	85.7	Confident	83.4	Confident	24 Å²	24	30.4 Å²	30.4	13%	0.126	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	121.2	-179.5	-174.7	65.7	0	0	0	109.7	L275 F278 K279 I286 F418	L275-L413 HydrophobicContact CB-CD2 3.96Å; L275-L413 HydrophobicContact CD1-CD2 4.32Å; F278-L413 HydrophobicContact CB-CD2 4.3Å; K279-L413 HydrophobicContact CG-CD1 4.09Å; K279-L413 HydrophobicContact CG-CD2 4.4Å; K279-L413 HydrophobicContact CG-CG 4.27Å; I286-L413 HydrophobicContact CB-CB 4.04Å; I286-L413 HydrophobicContact CB-CD2 4.06Å; I286-L413 HydrophobicContact CD1-CD2 4.07Å; I286-L413 HydrophobicContact CG2-CB 4.12Å; I286-L413 HydrophobicContact CG2-CD2 4.04Å; I286-L413 WeakPolarHBondContact O-CB 3.26Å; I286-L413 PolarHBondContact O-N 2.91Å; L413-F418 HydrophobicContact CB-CD1 4.11Å; L413-F418 HydrophobicContact CB-CE1 3.89Å; L413-F418 HydrophobicContact CB-CZ 4.37Å; L413-F418 HydrophobicContact CD1-CD1 4.42Å; L413-F418 HydrophobicContact CD1-CD2 4.15Å; L413-F418 HydrophobicContact CD1-CE1 4.42Å; L413-F418 HydrophobicContact CD1-CE2 4.15Å; L413-F418 HydrophobicContact CD1-CG 4.29Å; L413-F418 HydrophobicContact CD1-CZ 4.29Å
414	T	80.5	Confident	83.3	Confident	54 Å²	54	30.4 Å²	30.4	33%	0.331	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	177.1	175.8	69.5	0	0	0	0	109.9	E412 G416 G417 K419	E412-T414 PolarHBondContact O-N 3.16Å; T414-G416 PolarHBondContact O-N 3.21Å; T414-G416 PolarHBondContact OG1-N 3.08Å; T414-G417 PolarHBondContact N-O 3.26Å; T414-G417 WeakPolarHBondContact O-CA 3.38Å; T414-G417 PolarHBondContact O-N 3Å; T414-G417 PolarHBondContact OG1-O 2.88Å; T414-K419 HydrophobicContact CG2-CB 4.32Å
415	Q	74.5	Confident	83.2	Confident	128 Å²	128	29.5 Å²	29.5	60%	0.598	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-39.7	171.6	-65.3	-169.9	1.4	0	0	112.8	D281 G417	D281-Q415 WeakPolarHBondContact OD1-CG 3.43Å; D281-Q415 PolarHBondContact OD1-NE2 3.48Å; D281-Q415 PolarHBondContact OD2-NE2 2.92Å; Q415-G417 PolarHBondContact O-N 3.36Å; Q415-G417 VanDerWaalsContact O-N 3.14Å
416	G	69.3	Low	83	Confident	78 Å²	78	30.4 Å²	30.4	80%	0.804	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	8.7	175.9	0	0	0	0	0	114.7	T414	T414-G416 PolarHBondContact O-N 3.21Å; T414-G416 PolarHBondContact OG1-N 3.08Å
417	G	75.6	Confident	82.9	Confident	15 Å²	15	35 Å²	35	16%	0.155	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	85.6	-164.3	-169.8	0	0	0	0	0	112.7	T414 Q415 K419	T414-G417 PolarHBondContact N-O 3.26Å; T414-G417 WeakPolarHBondContact O-CA 3.38Å; T414-G417 PolarHBondContact O-N 3Å; T414-G417 PolarHBondContact OG1-O 2.88Å; Q415-G417 PolarHBondContact O-N 3.36Å; Q415-G417 VanDerWaalsContact O-N 3.14Å; G417-K419 PolarHBondContact O-N 3.33Å
418	F	79.4	Confident	82.6	Confident	10 Å²	10	38 Å²	38	4%	0.044	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	119.6	178.8	-77.3	-71.8	0	0	0	112.2	I270 L275 I286 A288 L411 E412 L413	I270-F418 HydrophobicContact CG2-CE2 4.11Å; I270-F418 HydrophobicContact CG2-CZ 3.8Å; I270-F418 WeakPolarHBondContact O-CE2 3.46Å; L275-F418 HydrophobicContact CD1-CE2 3.9Å; L275-F418 HydrophobicContact CD1-CZ 3.74Å; I286-F418 HydrophobicContact CG2-CE1 4.34Å; I286-F418 HydrophobicContact CG2-CZ 4.29Å; A288-F418 HydrophobicContact CB-CD1 4.37Å; A288-F418 HydrophobicContact CB-CE1 3.78Å; A288-F418 HydrophobicContact CB-CZ 4.1Å; L411-F418 HydrophobicContact CB-CB 4.23Å; L411-F418 HydrophobicContact CB-CD1 3.87Å; L411-F418 HydrophobicContact CB-CG 4.38Å; L411-F418 HydrophobicContact CD1-CB 4.37Å; E412-F418 WeakPolarHBondContact O-CA 3.47Å; L413-F418 HydrophobicContact CB-CD1 4.11Å; L413-F418 HydrophobicContact CB-CE1 3.89Å; L413-F418 HydrophobicContact CB-CZ 4.37Å; L413-F418 HydrophobicContact CD1-CD1 4.42Å; L413-F418 HydrophobicContact CD1-CD2 4.15Å; L413-F418 HydrophobicContact CD1-CE1 4.42Å; L413-F418 HydrophobicContact CD1-CE2 4.15Å; L413-F418 HydrophobicContact CD1-CG 4.29Å; L413-F418 HydrophobicContact CD1-CZ 4.29Å
419	K	78.9	Confident	82.4	Confident	97 Å²	97	43.3 Å²	43.3	42%	0.422	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	139.2	175.7	-178.4	-176.1	175.7	-177.3	0	110.2	L411 E412 T414 G417	L411-K419 CarbonylContact C-O 3.46Å; L411-K419 WeakPolarHBondContact CA-O 3.36Å; E412-K419 PolarHBondContact N-O 3.4Å; E412-K419 PolarHBondContact O-N 2.8Å; T414-K419 HydrophobicContact CG2-CB 4.32Å; G417-K419 PolarHBondContact O-N 3.33Å
420	P	78.6	Confident	82	Confident	41 Å²	41	44.1 Å²	44.1	27%	0.266	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	134.4	173.4	27.5	-34.1	0	0	0	112.2	T409 T410 L411	T409-P420 HydrophobicContact CG2-CB 4Å; T410-P420 CarbonylContact O-C 3.59Å; T410-P420 WeakPolarHBondContact O-CA 3.4Å; L411-P420 HydrophobicContact CD2-CB 4.21Å
421	T	77.5	Confident	81.5	Confident	14 Å²	14	49 Å²	49	9%	0.086	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	-16.4	178.8	53.6	0	0	0	0	113.3	T410 E412 A433	T410-T421 PolarHBondContact O-N 3.26Å; T410-T421 PolarHBondContact O-OG1 3.43Å; T410-T421 PolarHBondContact OG1-OG1 2.98Å; E412-T421 HydrophobicContact CB-CG2 3.45Å; E412-T421 VanDerWaalsContact CB-CG2 3.45Å; E412-T421 HydrophobicContact CG-CG2 4.43Å; E412-T421 WeakPolarHBondContact OE2-CG2 3.39Å; T421-A433 PolarHBondContact O-N 3.39Å; T421-A433 VanDerWaalsContact O-O 3.08Å
422	G	79.7	Confident	80.6	Confident	2 Å²	2	52 Å²	52	2%	0.021	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	164.3	-179.5	0	0	0	0	0	111.9	T409 T410 K431	T409-G422 WeakPolarHBondContact CA-O 3.22Å; T410-G422 PolarHBondContact N-O 2.99Å; T410-G422 WeakPolarHBondContact OG1-CA 3.07Å; T410-G422 PolarHBondContact OG1-N 3.22Å; T410-G422 VanDerWaalsContact OG1-N 3.09Å; T410-G422 PolarHBondContact OG1-O 3.06Å; G422-K431 CarbonylContact C-O 3.59Å; G422-K431 VanDerWaalsContact CA-O 3.26Å; G422-K431 WeakPolarHBondContact CA-O 3.47Å
423	V	85.4	Confident	79.3	Confident	41 Å²	41	53.3 Å²	53.3	25%	0.248	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	132.1	174.4	177.9	0	0	0	0	107.6	D407 L408 T409 K431	D407-V423 HydrophobicContact CB-CG1 3.56Å; L408-V423 WeakPolarHBondContact O-CA 3.48Å; T409-V423 HydrophobicContact CG2-CG2 4.4Å; V423-K431 PolarHBondContact N-O 3.02Å; V423-K431 CarbonylContact O-C 3.58Å; V423-K431 WeakPolarHBondContact O-CA 3.3Å; V423-K431 WeakPolarHBondContact O-CB 3.42Å; V423-K431 PolarHBondContact O-N 3.41Å
424	W	88.7	Confident	77.4	Confident	1 Å²	1	61.7 Å²	61.7	0%	0.004	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	138.7	167.9	176.7	99.1	0	0	0	110.1	S166 L169 E173 F406 L408 I426 M430	S166-W424 VanDerWaalsContact O-CH2 3.24Å; S166-W424 WeakPolarHBondContact O-CH2 3.38Å; L169-W424 HydrophobicContact CB-CZ2 4.44Å; L169-W424 HydrophobicContact CD2-CZ2 4.17Å; L169-W424 HydrophobicContact CG-CZ2 4.1Å; E173-W424 PolarHBondContact OE2-NE1 3.02Å; F406-W424 HydrophobicContact CE1-CZ3 4.42Å; F406-W424 HydrophobicContact CE2-CE3 4.27Å; F406-W424 AromaticContact CE2-CZ3 3.94Å; F406-W424 HydrophobicContact CE2-CZ3 3.94Å; F406-W424 HydrophobicContact CZ-CE3 4.48Å; F406-W424 AromaticContact CZ-CZ3 3.71Å; F406-W424 HydrophobicContact CZ-CZ3 3.71Å; L408-W424 HydrophobicContact CB-CB 4.19Å; L408-W424 HydrophobicContact CB-CE3 4.08Å; L408-W424 WeakPolarHBondContact CB-O 3.21Å; L408-W424 HydrophobicContact CD2-CE3 4.35Å; L408-W424 PolarHBondContact N-O 2.97Å; L408-W424 PolarHBondContact O-N 3.43Å; W424-I426 HydrophobicContact CH2-CB 3.9Å; W424-I426 HydrophobicContact CH2-CG1 4.38Å; W424-I426 HydrophobicContact CZ2-CB 4.38Å; W424-M430 HydrophobicContact CB-SD 3.8Å
425	N	87	Confident	75.7	Confident	10 Å²	10	62.6 Å²	62.6	5%	0.053	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	163.8	163.2	63.6	44.4	0	0	0	109.9	L405 F406 D407 D427 E428 R429	L405-N425 HydrophobicContact CD1-CB 3.94Å; F406-N425 WeakPolarHBondContact O-CB 3.4Å; D407-N425 WeakPolarHBondContact OD1-CB 3.4Å; D407-N425 PolarHBondContact OD1-ND2 3.15Å; N425-D427 VanDerWaalsContact C-N 3.28Å; N425-D427 PolarHBondContact O-N 2.88Å; N425-E428 PolarHBondContact ND2-OE2 3.34Å; N425-E428 VanDerWaalsContact ND2-OE2 3.1Å; N425-E428 WeakPolarHBondContact OD1-CA 3.36Å; N425-E428 VanDerWaalsContact OD1-CB 3.23Å; N425-E428 WeakPolarHBondContact OD1-CB 3.45Å; N425-E428 WeakPolarHBondContact OD1-CG 3.2Å; N425-E428 PolarHBondContact OD1-N 3.06Å; N425-R429 WeakPolarHBondContact O-CA 3.45Å; N425-R429 PolarHBondContact O-N 2.97Å
426	I	87	Confident	73.8	Confident	40 Å²	40	61.5 Å²	61.5	21%	0.205	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-27.1	-170.3	-166.7	169	0	0	0	113.9	T404 L405 W424 R429	T404-I426 WeakPolarHBondContact O-CG2 3.44Å; L405-I426 HydrophobicContact CB-CG2 4.48Å; L405-I426 HydrophobicContact CD1-CG2 3.95Å; W424-I426 HydrophobicContact CH2-CB 3.9Å; W424-I426 HydrophobicContact CH2-CG1 4.38Å; W424-I426 HydrophobicContact CZ2-CB 4.38Å; I426-R429 PolarHBondContact O-NE 3.36Å; I426-R429 VanDerWaalsContact O-NE 3.09Å
427	D	87.4	Confident	71.9	Confident	96 Å²	96	62.7 Å²	62.7	51%	0.513	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-39.3	-175	-63.7	-20.9	0	0	0	112.3	R396 N425	R396-D427 IonicContact CZ-OD1 3.4Å; R396-D427 IonicContact CZ-OD2 3.59Å; R396-D427 IonicContact NH1-OD1 2.69Å; R396-D427 PolarHBondContact NH1-OD1 3.48Å; R396-D427 IonicContact NH1-OD2 3.57Å; R396-D427 PolarHBondContact NH1-OD2 3.08Å; R396-D427 IonicContact NH2-OD1 3.28Å; R396-D427 PolarHBondContact NH2-OD1 3.31Å; R396-D427 IonicContact NH2-OD2 3.45Å; R396-D427 PolarHBondContact NH2-OD2 3.1Å; N425-D427 VanDerWaalsContact C-N 3.28Å; N425-D427 PolarHBondContact O-N 2.88Å
428	E	82.7	Confident	70	Confident	107 Å²	107	68.3 Å²	68.3	50%	0.5	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-8.5	-175.3	-47.2	-175.2	105.5	0	0	113.9	N425 K431	N425-E428 PolarHBondContact ND2-OE2 3.34Å; N425-E428 VanDerWaalsContact ND2-OE2 3.1Å; N425-E428 WeakPolarHBondContact OD1-CA 3.36Å; N425-E428 VanDerWaalsContact OD1-CB 3.23Å; N425-E428 WeakPolarHBondContact OD1-CB 3.45Å; N425-E428 WeakPolarHBondContact OD1-CG 3.2Å; N425-E428 PolarHBondContact OD1-N 3.06Å; E428-K431 WeakPolarHBondContact OE1-CE 3.36Å; E428-K431 IonicContact OE1-NZ 3.55Å; E428-K431 PolarHBondContact OE1-NZ 3.16Å; E428-K431 WeakPolarHBondContact OE2-CE 3.32Å; E428-K431 IonicContact OE2-NZ 2.73Å; E428-K431 PolarHBondContact OE2-NZ 3.3Å
429	R	84.2	Confident	67.6	Low	113 Å²	113	70.9 Å²	70.9	43%	0.426	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	59.4	-158.3	-177.5	-54.7	-60.3	173.8	111.3	2.9	113	E173 N425 I426 K431	E173-R429 IonicContact OE1-CZ 2.74Å; E173-R429 IonicContact OE1-NH1 3.96Å; E173-R429 PolarHBondContact OE1-NH1 3.12Å; E173-R429 WeakPolarHBondContact OE2-CD 3.49Å; N425-R429 WeakPolarHBondContact O-CA 3.45Å; N425-R429 PolarHBondContact O-N 2.97Å; I426-R429 PolarHBondContact O-NE 3.36Å; I426-R429 VanDerWaalsContact O-NE 3.09Å; R429-K431 PolarHBondContact O-N 2.71Å
430	M	79.3	Confident	65.5	Low	26 Å²	26	71.7 Å²	71.7	13%	0.128	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	94.9	-170.7	-170.8	69.5	-147.6	0	0	112.5	Y174 V178 T410 W424 V432	Y174-M430 HydrophobicContact CD2-CE 3.97Å; Y174-M430 HydrophobicContact CD2-SD 4.23Å; V178-M430 HydrophobicContact CG2-CE 4.15Å; V178-M430 HydrophobicContact CG2-CG 3.46Å; V178-M430 VanDerWaalsContact CG2-CG 3.46Å; V178-M430 HydrophobicContact CG2-SD 4.18Å; T410-M430 HydrophobicContact CG2-CE 4.24Å; W424-M430 HydrophobicContact CB-SD 3.8Å; M430-V432 HydrophobicContact CE-CG2 4.23Å; M430-V432 HydrophobicContact CG-CG2 4.05Å; M430-V432 PolarHBondContact O-N 2.87Å
431	K	76.8	Confident	63.2	Low	104 Å²	104	71.7 Å²	71.7	45%	0.452	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	90.4	165.9	-72.1	178.4	174.3	172.5	0	110	G422 V423 E428 R429 A433	G422-K431 CarbonylContact C-O 3.59Å; G422-K431 VanDerWaalsContact CA-O 3.26Å; G422-K431 WeakPolarHBondContact CA-O 3.47Å; V423-K431 PolarHBondContact N-O 3.02Å; V423-K431 CarbonylContact O-C 3.58Å; V423-K431 WeakPolarHBondContact O-CA 3.3Å; V423-K431 WeakPolarHBondContact O-CB 3.42Å; V423-K431 PolarHBondContact O-N 3.41Å; E428-K431 WeakPolarHBondContact OE1-CE 3.36Å; E428-K431 IonicContact OE1-NZ 3.55Å; E428-K431 PolarHBondContact OE1-NZ 3.16Å; E428-K431 WeakPolarHBondContact OE2-CE 3.32Å; E428-K431 IonicContact OE2-NZ 2.73Å; E428-K431 PolarHBondContact OE2-NZ 3.3Å; R429-K431 PolarHBondContact O-N 2.71Å; K431-A433 PolarHBondContact O-N 3.28Å; K431-A433 VanDerWaalsContact O-N 3.14Å
432	V	67.6	Low	61.3	Low	63 Å²	63	80.3 Å²	80.3	38%	0.382	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	114.5	164.6	-173.8	0	0	0	0	108	V178 M430 K434	V178-V432 HydrophobicContact CB-CG2 4.2Å; V178-V432 HydrophobicContact CG1-CG1 4.33Å; V178-V432 HydrophobicContact CG1-CG2 3.71Å; V178-V432 HydrophobicContact CG2-CG2 3.42Å; V178-V432 VanDerWaalsContact CG2-CG2 3.42Å; M430-V432 HydrophobicContact CE-CG2 4.23Å; M430-V432 HydrophobicContact CG-CG2 4.05Å; M430-V432 PolarHBondContact O-N 2.87Å; V432-K434 PolarHBondContact O-N 3.06Å
433	A	59.4	Low	59.3	Low	56 Å²	56	88.7 Å²	88.7	46%	0.463	45%	0.453	S	S	.	.			trans	-64.8	112.6	167.1	0	0	0	0	0	105.3	T421 K431 Q435	T421-A433 PolarHBondContact O-N 3.39Å; T421-A433 VanDerWaalsContact O-O 3.08Å; K431-A433 PolarHBondContact O-N 3.28Å; K431-A433 VanDerWaalsContact O-N 3.14Å; A433-Q435 PolarHBondContact O-N 3.13Å
434	K	45.4	Very low	57.3	Low	199 Å²	199	89.7 Å²	89.7	87%	0.865	46%	0.456	S	S	*	.			trans	-44	107.2	-174.4	-86	-174.9	177.7	176.1	0	108.8	V432 P436	V432-K434 PolarHBondContact O-N 3.06Å; K434-P436 VanDerWaalsContact O-N 3.17Å
435	Q	46.4	Very low	55.1	Low	74 Å²	74	93.4 Å²	93.4	35%	0.346	48%	0.481	S	S	.	.			trans	-50.5	130.3	161.6	-77.5	-178.5	-31.2	0	0	104.5	E412 A433 V437	E412-Q435 PolarHBondContact OE2-NE2 3.49Å; A433-Q435 PolarHBondContact O-N 3.13Å; Q435-V437 WeakPolarHBondContact O-CA 3.33Å; Q435-V437 PolarHBondContact O-N 3.43Å
436	P	32.9	Very low	53.1	Low	104 Å²	104	102.7 Å²	102.7	68%	0.675	52%	0.52	S	S	*	.			trans	-56.7	103.6	156.6	26.3	-29.2	0	0	0	102.3	K434 I438	K434-P436 VanDerWaalsContact O-N 3.17Å; P436-I438 PolarHBondContact O-N 2.97Å; P436-I438 VanDerWaalsContact O-N 3.16Å
437	V	30.8	Very low	51.4	Low	104 Å²	104	103.4 Å²	103.4	63%	0.63	52%	0.524	S	S	*	.			trans	-51.9	134.5	-155.6	-168.8	0	0	0	0	105.7	Q435 T439	Q435-V437 WeakPolarHBondContact O-CA 3.33Å; Q435-V437 PolarHBondContact O-N 3.43Å; V437-T439 PolarHBondContact O-N 3.49Å; V437-T439 PolarHBondContact O-OG1 2.72Å; V437-T439 VanDerWaalsContact O-OG1 3.06Å
438	I	35.9	Very low	49.8	Very low	133 Å²	133	107.4 Å²	107.4	68%	0.682	54%	0.537	S	S	*	.			trans	-67.7	70.7	153.1	-53.6	-177.8	0	0	0	104.6	P436 L440	P436-I438 PolarHBondContact O-N 2.97Å; P436-I438 VanDerWaalsContact O-N 3.16Å; I438-L440 VanDerWaalsContact C-N 3.34Å; I438-L440 PolarHBondContact O-N 3.38Å
439	T	29.2	Very low	49	Very low	64 Å²	64	104.1 Å²	104.1	39%	0.393	53%	0.532	S	S	.	.			trans	-45.1	111.6	158.5	-55.2	0	0	0	0	100.1	V437 P441 K442	V437-T439 PolarHBondContact O-N 3.49Å; V437-T439 PolarHBondContact O-OG1 2.72Å; V437-T439 VanDerWaalsContact O-OG1 3.06Å; T439-P441 WeakPolarHBondContact O-CA 3.4Å; T439-P441 WeakPolarHBondContact O-CB 3.18Å; T439-P441 VanDerWaalsContact O-CD 3.3Å; T439-P441 WeakPolarHBondContact O-CD 3.29Å; T439-K442 HydrophobicContact CG2-CB 3.73Å; T439-K442 HydrophobicContact CG2-CD 3.93Å; T439-K442 HydrophobicContact CG2-CG 3.64Å
440	L	34.1	Very low	48.8	Very low	113 Å²	113	101.8 Å²	101.8	59%	0.592	53%	0.53	S	S	*	.	S	Bend	trans	-63.7	108.2	-179.2	-165.2	157.3	0	0	0	104.3	I438 K442 P797	I438-L440 VanDerWaalsContact C-N 3.34Å; I438-L440 PolarHBondContact O-N 3.38Å; L440-K442 PolarHBondContact O-N 2.69Å; L440-P797 HydrophobicContact CD2-CB 3.75Å
441	P	30.9	Very low	49.2	Very low	42 Å²	42	104.4 Å²	104.4	27%	0.273	55%	0.547	S	S	.	.				-67.8	104	-121.5	18.2	-32.6	0	0	0	114.4	T439 Q443 L444	T439-P441 WeakPolarHBondContact O-CA 3.4Å; T439-P441 WeakPolarHBondContact O-CB 3.18Å; T439-P441 VanDerWaalsContact O-CD 3.3Å; T439-P441 WeakPolarHBondContact O-CD 3.29Å; P441-Q443 CarbonylContact C-O 3.57Å; P441-Q443 VanDerWaalsContact C-O 3.3Å; P441-Q443 VanDerWaalsContact CB-O 3.22Å; P441-Q443 WeakPolarHBondContact CB-O 3.36Å; P441-Q443 CarbonylContact O-C 3.44Å; P441-Q443 PolarHBondContact O-N 2.95Å; P441-L444 PolarHBondContact O-N 3.41Å
442	K	37.3	Very low	49.9	Very low	194 Å²	194	99.5 Å²	99.5	84%	0.843	53%	0.526	S	S	*	.	S	Bend	trans	-61.8	-24.1	-175.2	-79.1	-173.8	175.5	-172.5	0	112.9	T439 L440	T439-K442 HydrophobicContact CG2-CB 3.73Å; T439-K442 HydrophobicContact CG2-CD 3.93Å; T439-K442 HydrophobicContact CG2-CG 3.64Å; L440-K442 PolarHBondContact O-N 2.69Å
443	Q	37	Very low	51.1	Low	179 Å²	179	99.4 Å²	99.4	84%	0.836	52%	0.52	S	S	*	.	S	Bend	trans	-113.7	124.7	141.5	-64.4	170.8	-16.5	0	0	104.6	P441	P441-Q443 CarbonylContact C-O 3.57Å; P441-Q443 VanDerWaalsContact C-O 3.3Å; P441-Q443 VanDerWaalsContact CB-O 3.22Å; P441-Q443 WeakPolarHBondContact CB-O 3.36Å; P441-Q443 CarbonylContact O-C 3.44Å; P441-Q443 PolarHBondContact O-N 2.95Å
444	L	44.5	Very low	52.8	Low	61 Å²	61	96.8 Å²	96.8	32%	0.319	50%	0.498	S	S	.	.			trans	-50.8	153.7	170.7	-77.6	75.5	0	0	0	108.2	P441 W798 P801	P441-L444 PolarHBondContact O-N 3.41Å; L444-W798 HydrophobicContact CD2-CE3 4.4Å; L444-W798 HydrophobicContact CD2-CH2 4.12Å; L444-W798 HydrophobicContact CD2-CZ3 3.66Å; L444-P801 HydrophobicContact CD1-CB 4.46Å; L444-P801 HydrophobicContact CD1-CG 3.85Å
445	P	40.9	Very low	55.1	Low	79 Å²	79	87.3 Å²	87.3	51%	0.513	46%	0.457	S	S	.	.			trans	-50.4	169.1	152.8	-14.1	25.8	0	0	0	108.7	I447	P445-I447 HydrophobicContact CB-CD1 4.41Å; P445-I447 HydrophobicContact CB-CG1 3.75Å; P445-I447 HydrophobicContact CG-CD1 3.96Å; P445-I447 HydrophobicContact CG-CG1 3.86Å; P445-I447 PolarHBondContact O-N 2.96Å
446	K	45	Very low	57.4	Low	205 Å²	205	83.8 Å²	83.8	89%	0.891	44%	0.441	S	S	*	.			trans	-73.7	62.6	169.1	-71	178.2	179.5	173.4	0	110.3	K448	K446-K448 PolarHBondContact O-N 2.81Å
447	I	52.8	Low	60.2	Low	56 Å²	56	79.1 Å²	79.1	29%	0.287	41%	0.41	S	S	.	.			trans	-71.6	57.7	170.5	-46.1	-175.6	0	0	0	108.2	P445 V450 W798	P445-I447 HydrophobicContact CB-CD1 4.41Å; P445-I447 HydrophobicContact CB-CG1 3.75Å; P445-I447 HydrophobicContact CG-CD1 3.96Å; P445-I447 HydrophobicContact CG-CG1 3.86Å; P445-I447 PolarHBondContact O-N 2.96Å; I447-V450 HydrophobicContact CG2-CB 3.62Å; I447-V450 HydrophobicContact CG2-CG2 3.25Å; I447-W798 HydrophobicContact CG2-CH2 4.13Å
448	K	52.8	Low	63	Low	180 Å²	180	76.3 Å²	76.3	78%	0.783	39%	0.394	S	S	*	.			trans	-83	118.8	167.8	-74.6	-161.4	167.2	-158.5	0	107.5	K446 G497	K446-K448 PolarHBondContact O-N 2.81Å; K448-G497 WeakPolarHBondContact CA-O 3.28Å
449	G	65.9	Low	65.5	Low	37 Å²	37	72 Å²	72	38%	0.381	37%	0.372	S	S	.	.	S	Bend	trans	91.8	16.1	174.4	0	0	0	0	0	117	G497	G449-G497 PolarHBondContact N-O 2.62Å
450	V	80.2	Confident	68.4	Low	64 Å²	64	70.4 Å²	70.4	39%	0.388	37%	0.366	S	S	.	.			trans	-63.3	137.9	155.5	157.5	0	0	0	0	108.4	I447 L452 N499 W798	I447-V450 HydrophobicContact CG2-CB 3.62Å; I447-V450 HydrophobicContact CG2-CG2 3.25Å; V450-L452 HydrophobicContact CG1-CD2 3.74Å; V450-L452 HydrophobicContact CG1-CG 4.42Å; V450-N499 PolarHBondContact O-N 2.85Å; V450-N499 VanDerWaalsContact O-O 3.12Å; V450-W798 HydrophobicContact CG1-CZ2 4.24Å
451	V	87.4	Confident	71.2	Confident	81 Å²	81	65 Å²	65	49%	0.491	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	111.8	177.6	-177.5	0	0	0	0	108.3	N499 T501	V451-N499 CarbonylContact C-O 3.6Å; V451-N499 WeakPolarHBondContact CA-O 3.45Å; V451-N499 HydrophobicContact CG2-CB 3.99Å; V451-T501 HydrophobicContact CG1-CG2 3.82Å
452	L	91.2	Very high	74.2	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	133.3	176.2	-58.3	-179.1	0	0	0	110.7	V450 V454 F498 N499 Y500 T501 D536 M537 W798	V450-L452 HydrophobicContact CG1-CD2 3.74Å; V450-L452 HydrophobicContact CG1-CG 4.42Å; L452-V454 PolarHBondContact O-N 3.47Å; L452-F498 HydrophobicContact CD1-CB 4.07Å; L452-F498 HydrophobicContact CD1-CD1 4Å; L452-F498 HydrophobicContact CD1-CD2 3.82Å; L452-F498 HydrophobicContact CD1-CE1 4.37Å; L452-F498 HydrophobicContact CD1-CE2 4.2Å; L452-F498 HydrophobicContact CD1-CG 3.71Å; L452-F498 HydrophobicContact CD1-CZ 4.47Å; L452-F498 HydrophobicContact CG-CB 4.27Å; L452-F498 HydrophobicContact CG-CD2 4.29Å; L452-F498 HydrophobicContact CG-CG 4.32Å; L452-N499 PolarHBondContact N-O 3.06Å; L452-Y500 CarbonylContact O-C 3.59Å; L452-Y500 WeakPolarHBondContact O-CA 3.46Å; L452-Y500 WeakPolarHBondContact O-CB 3.35Å; L452-T501 PolarHBondContact O-N 3.23Å; L452-D536 HydrophobicContact CB-CB 4.13Å; L452-D536 HydrophobicContact CD2-CB 4.02Å; L452-M537 HydrophobicContact CB-SD 4.34Å; L452-M537 HydrophobicContact CD1-SD 3.75Å; L452-W798 HydrophobicContact CD1-CD2 3.98Å; L452-W798 HydrophobicContact CD1-CE3 4.35Å; L452-W798 HydrophobicContact CD1-CG 4.25Å; L452-W798 HydrophobicContact CD1-CZ2 4.45Å; L452-W798 HydrophobicContact CD2-CD2 4.45Å; L452-W798 HydrophobicContact CD2-CZ2 3.86Å
453	K	92.7	Very high	76.9	Confident	61 Å²	61	53.9 Å²	53.9	27%	0.265	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	109.9	171.9	-176.8	-176.5	166.9	-159	0	109.2	H503 E534 D536	K453-H503 HydrophobicContact CD-CB 4.37Å; K453-H503 VanDerWaalsContact CE-CB 3.46Å; K453-H503 VanDerWaalsContact CE-CD2 3.4Å; K453-H503 WeakPolarHBondContact CE-CD2 3.41Å; K453-H503 WeakPolarHBondContact CE-ND1 3.18Å; K453-H503 HydrophobicContact CG-CB 3.99Å; K453-E534 VanDerWaalsContact CD-O 3.3Å; K453-E534 WeakPolarHBondContact CD-O 3.41Å; K453-E534 WeakPolarHBondContact CE-O 3.37Å; K453-E534 PolarHBondContact NZ-O 3.21Å; K453-D536 PolarHBondContact N-OD2 3.34Å; K453-D536 PolarHBondContact O-N 3.27Å
454	V	95.4	Very high	79.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	113	-177.9	179.4	0	0	0	0	109.6	L452 L489 Y500 T501 H503 M537 V539	L452-V454 PolarHBondContact O-N 3.47Å; V454-L489 HydrophobicContact CB-CD2 4.48Å; V454-L489 HydrophobicContact CG1-CD2 4.09Å; V454-L489 HydrophobicContact CG2-CD2 4.04Å; V454-Y500 HydrophobicContact CG2-CD2 4.26Å; V454-Y500 HydrophobicContact CG2-CG 4.32Å; V454-T501 WeakPolarHBondContact CB-O 3.41Å; V454-T501 PolarHBondContact N-O 3.29Å; V454-H503 PolarHBondContact O-N 2.84Å; V454-M537 WeakPolarHBondContact CA-O 3.29Å; V454-M537 HydrophobicContact CB-CG 4.41Å; V454-M537 HydrophobicContact CG1-CG 4.47Å; V454-M537 HydrophobicContact CG2-CG 3.72Å; V454-M537 HydrophobicContact CG2-SD 3.98Å; V454-V539 HydrophobicContact CG1-CB 3.82Å; V454-V539 HydrophobicContact CG1-CG2 3.68Å
455	T	94.5	Very high	81.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	142.8	174.7	-171.5	0	0	0	0	112	H503 T505 I526 E529 A535 M537 A538 V539	T455-H503 CarbonylContact C-O 3.53Å; T455-H503 WeakPolarHBondContact CA-O 3.38Å; T455-T505 WeakPolarHBondContact OG1-CG2 3.4Å; T455-I526 HydrophobicContact CG2-CG1 4.42Å; T455-I526 HydrophobicContact CG2-CG2 4.05Å; T455-E529 WeakPolarHBondContact CB-OE2 3.44Å; T455-E529 PolarHBondContact OG1-OE2 3Å; T455-A535 HydrophobicContact CG2-CB 3.69Å; T455-M537 PolarHBondContact N-O 3Å; T455-A538 HydrophobicContact CG2-CB 3.67Å; T455-A538 WeakPolarHBondContact O-CA 3.17Å; T455-V539 PolarHBondContact O-N 2.95Å; T455-V539 VanDerWaalsContact O-N 3.12Å
456	T	94	Very high	84.2	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	177.3	-174.9	-155.4	0	0	0	0	113.3	M463 W481 V502 H503 T505 V539	T456-M463 HydrophobicContact CG2-CE 3.75Å; T456-M463 WeakPolarHBondContact OG1-CG 3.22Å; T456-W481 HydrophobicContact CG2-CH2 4.27Å; T456-W481 HydrophobicContact CG2-CZ3 4.46Å; T456-V502 HydrophobicContact CG2-CG1 3.61Å; T456-H503 PolarHBondContact N-O 3.36Å; T456-T505 PolarHBondContact O-N 3.44Å; T456-V539 WeakPolarHBondContact CB-O 3.47Å; T456-V539 PolarHBondContact OG1-O 3.31Å
457	I	91.2	Very high	86.3	Confident	7 Å²	7	39.6 Å²	39.6	4%	0.036	22%	0.216	C	C	.	.			trans	-132.7	149.8	164	64.8	173	0	0	0	110.6	D459 T505 Y510 I526	I457-D459 VanDerWaalsContact C-N 3.31Å; I457-D459 PolarHBondContact O-N 2.77Å; I457-T505 VanDerWaalsContact CG2-OG1 3.27Å; I457-T505 WeakPolarHBondContact CG2-OG1 3.42Å; I457-Y510 HydrophobicContact CD1-CD1 4.17Å; I457-Y510 HydrophobicContact CD1-CD2 3.79Å; I457-Y510 HydrophobicContact CD1-CE1 3.91Å; I457-Y510 HydrophobicContact CD1-CE2 3.51Å; I457-Y510 HydrophobicContact CD1-CG 4.11Å; I457-Y510 HydrophobicContact CG1-CE1 4.12Å; I457-Y510 HydrophobicContact CG1-CE2 4.48Å; I457-I526 HydrophobicContact CG2-CD1 4.32Å
458	P	90.1	Very high	88	Confident	44 Å²	44	41.5 Å²	41.5	29%	0.286	22%	0.222	S	C	.	.			trans	-79.5	70.9	-174.9	33.6	-37	0	0	0	113.1	M463 P465 W481	P458-M463 CarbonylContact C-O 3.57Å; P458-M463 VanDerWaalsContact C-O 3.3Å; P458-M463 WeakPolarHBondContact CA-O 3.41Å; P458-P465 HydrophobicContact CB-CG 4.37Å; P458-W481 HydrophobicContact CB-CH2 4.32Å; P458-W481 HydrophobicContact CB-CZ3 4.11Å
459	D	88.1	Confident	89.5	Confident	43 Å²	43	35.1 Å²	35.1	23%	0.23	20%	0.197	C	C	.	.			trans	-105.8	119.8	177.2	-79.5	4.2	0	0	0	111.9	I457 F462 M463 Y510 W765	I457-D459 VanDerWaalsContact C-N 3.31Å; I457-D459 PolarHBondContact O-N 2.77Å; D459-F462 WeakPolarHBondContact O-CA 3.25Å; D459-F462 WeakPolarHBondContact O-CB 3.4Å; D459-F462 PolarHBondContact O-N 3.3Å; D459-M463 CarbonylContact C-O 3.55Å; D459-M463 PolarHBondContact N-O 3.23Å; D459-M463 PolarHBondContact O-N 3Å; D459-Y510 PolarHBondContact OD2-OH 2.85Å; D459-W765 HydrophobicContact CB-CZ2 4.33Å
460	A	90.3	Very high	90.4	Very high	31 Å²	31	38 Å²	38	26%	0.256	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	145	171.2	0	0	0	0	0	111.7	I464 W765 Y768	A460-I464 HydrophobicContact CB-CD1 3.92Å; A460-I464 HydrophobicContact CB-CG1 3.96Å; A460-W765 PolarHBondContact O-NE1 3.18Å; A460-W765 VanDerWaalsContact O-NE1 3.16Å; A460-Y768 HydrophobicContact CB-CE1 4.47Å
461	P	93.3	Very high	90.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	cis	-84.4	4.3	-2.1	34.1	-35.7	0	0	0	114.7	G483 Y484 Y768 W822 W823	P461-G483 CarbonylContact O-C 3.52Å; P461-G483 VanDerWaalsContact O-CA 3.26Å; P461-G483 WeakPolarHBondContact O-CA 3.48Å; P461-Y484 PolarHBondContact O-N 2.94Å; P461-Y768 HydrophobicContact CB-CD2 3.81Å; P461-Y768 HydrophobicContact CB-CE2 3.56Å; P461-Y768 HydrophobicContact CG-CD2 3.63Å; P461-Y768 HydrophobicContact CG-CE2 3.92Å; P461-Y768 HydrophobicContact CG-CG 4.24Å; P461-W822 HydrophobicContact CB-CB 4.31Å; P461-W822 HydrophobicContact CB-CE3 4.48Å; P461-W823 HydrophobicContact CG-CD2 4.24Å; P461-W823 HydrophobicContact CG-CE3 4.2Å; P461-W823 HydrophobicContact CG-CH2 3.6Å; P461-W823 HydrophobicContact CG-CZ2 3.63Å; P461-W823 HydrophobicContact CG-CZ3 3.89Å
462	F	94.3	Very high	90.1	Very high	1 Å²	1	46.2 Å²	46.2	0%	0.004	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-53.2	-170.7	-56.1	-72.2	0	0	0	112.2	D459 G483 Y484 C485 W558 W765 Y788 W823	D459-F462 WeakPolarHBondContact O-CA 3.25Å; D459-F462 WeakPolarHBondContact O-CB 3.4Å; D459-F462 PolarHBondContact O-N 3.3Å; F462-G483 CarbonylContact O-C 3.45Å; F462-G483 VanDerWaalsContact O-C 3.29Å; F462-G483 WeakPolarHBondContact O-CA 3.37Å; F462-Y484 PolarHBondContact O-N 3.41Å; F462-C485 HydrophobicContact CB-CB 4.46Å; F462-C485 VanDerWaalsContact O-CB 3.3Å; F462-C485 WeakPolarHBondContact O-CB 3.38Å; F462-C485 PolarHBondContact O-N 3.03Å; F462-W558 AromaticContact CD1-CH2 3.91Å; F462-W558 HydrophobicContact CD1-CH2 3.91Å; F462-W558 AromaticContact CE1-CH2 3.86Å; F462-W558 HydrophobicContact CE1-CH2 3.86Å; F462-W558 HydrophobicContact CE1-CZ3 4.41Å; F462-W765 HydrophobicContact CD2-CZ2 4.22Å; F462-W765 HydrophobicContact CE2-CD2 4.4Å; F462-W765 AromaticContact CE2-CE2 3.69Å; F462-W765 AromaticContact CE2-CZ2 3.79Å; F462-W765 HydrophobicContact CE2-CZ2 3.79Å; F462-W765 AromaticContact CE2-NE1 3.69Å; F462-Y788 HydrophobicContact CE1-CD2 4.07Å; F462-Y788 AromaticContact CE1-CE2 3.61Å; F462-Y788 HydrophobicContact CE1-CE2 3.61Å; F462-Y788 HydrophobicContact CE2-CE2 4.45Å; F462-Y788 HydrophobicContact CZ-CD2 4.32Å; F462-Y788 AromaticContact CZ-CE2 3.42Å; F462-Y788 HydrophobicContact CZ-CE2 3.42Å; F462-Y788 VanDerWaalsContact CZ-CE2 3.42Å; F462-Y788 AromaticContact CZ-CZ 3.87Å; F462-W823 HydrophobicContact CD1-CH2 4.28Å; F462-W823 AromaticContact CE1-CH2 3.67Å; F462-W823 HydrophobicContact CE1-CH2 3.67Å; F462-W823 HydrophobicContact CE1-CZ2 4.04Å; F462-W823 HydrophobicContact CZ-CH2 4.16Å; F462-W823 HydrophobicContact CZ-CZ2 4.06Å
463	M	93.3	Very high	89.6	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	27%	0.27	C	S	.	.			trans	-143.4	113.9	-173.4	-65.1	-70.1	-78.2	0	0	109.8	T456 P458 D459 W481 C485 I486 V502	T456-M463 HydrophobicContact CG2-CE 3.75Å; T456-M463 WeakPolarHBondContact OG1-CG 3.22Å; P458-M463 CarbonylContact C-O 3.57Å; P458-M463 VanDerWaalsContact C-O 3.3Å; P458-M463 WeakPolarHBondContact CA-O 3.41Å; D459-M463 CarbonylContact C-O 3.55Å; D459-M463 PolarHBondContact N-O 3.23Å; D459-M463 PolarHBondContact O-N 3Å; M463-W481 HydrophobicContact CB-CE3 4.22Å; M463-W481 HydrophobicContact CB-CZ3 4.16Å; M463-W481 HydrophobicContact CE-CE3 4.21Å; M463-C485 HydrophobicContact CG-CB 3.85Å; M463-C485 HydrophobicContact SD-CB 3.46Å; M463-C485 WeakPolarHBondContact SD-CB 3.47Å; M463-I486 HydrophobicContact CE-CD1 3.6Å; M463-I486 HydrophobicContact CE-CG1 4.22Å; M463-I486 HydrophobicContact SD-CD1 3.71Å; M463-I486 HydrophobicContact SD-CG1 3.71Å; M463-V502 HydrophobicContact CE-CG1 3.8Å; M463-V502 HydrophobicContact CE-CG2 4.42Å
464	I	93.1	Very high	89.2	Confident	20 Å²	20	51.3 Å²	51.3	10%	0.103	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	118.7	-176.8	-50.2	175.6	0	0	0	108	A460 W481 M482 W822 F826	A460-I464 HydrophobicContact CB-CD1 3.92Å; A460-I464 HydrophobicContact CB-CG1 3.96Å; I464-W481 WeakPolarHBondContact O-CA 3.42Å; I464-M482 HydrophobicContact CB-CE 4.11Å; I464-M482 HydrophobicContact CB-CG 4Å; I464-M482 HydrophobicContact CD1-CE 4.32Å; I464-M482 HydrophobicContact CG2-CE 3.73Å; I464-M482 PolarHBondContact N-O 3.44Å; I464-M482 PolarHBondContact O-N 3.13Å; I464-W822 HydrophobicContact CD1-CZ3 4.41Å; I464-F826 HydrophobicContact CD1-CE1 3.78Å; I464-F826 HydrophobicContact CD1-CZ 3.94Å
465	P	91.9	Very high	88.8	Confident	29 Å²	29	54.7 Å²	54.7	19%	0.188	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	136.9	175	30.6	-33.9	0	0	0	110.9	P458 F468 P474 W481	P458-P465 HydrophobicContact CB-CG 4.37Å; P465-F468 HydrophobicContact CB-CE1 4.13Å; P465-F468 HydrophobicContact CB-CZ 3.93Å; P465-F468 HydrophobicContact CG-CE1 4.08Å; P465-F468 HydrophobicContact CG-CZ 3.84Å; P465-P474 HydrophobicContact CB-CB 3.64Å; P465-P474 HydrophobicContact CB-CG 3.5Å; P465-P474 HydrophobicContact CG-CG 3.93Å; P465-W481 HydrophobicContact CB-CD2 4.4Å; P465-W481 HydrophobicContact CB-CE3 4.16Å; P465-W481 HydrophobicContact CB-CH2 4.28Å; P465-W481 HydrophobicContact CB-CZ2 4.5Å; P465-W481 HydrophobicContact CB-CZ3 4.1Å; P465-W481 HydrophobicContact CG-CZ3 4.37Å
466	I	91.2	Very high	88.4	Confident	81 Å²	81	56.2 Å²	56.2	42%	0.415	30%	0.298	S	S	.	.			trans	-107.2	-41.2	175	-57.1	161.9	0	0	0	110.8	A480 M482	I466-A480 PolarHBondContact N-O 3.22Å; I466-M482 HydrophobicContact CD1-CB 3.71Å; I466-M482 HydrophobicContact CD1-CG 3.7Å; I466-M482 HydrophobicContact CD1-SD 3.87Å; I466-M482 HydrophobicContact CG1-CB 4.35Å; I466-M482 HydrophobicContact CG1-CE 4.1Å; I466-M482 HydrophobicContact CG1-CG 3.82Å; I466-M482 HydrophobicContact CG1-SD 3.98Å
467	K	88.7	Confident	88.1	Confident	93 Å²	93	59 Å²	59	40%	0.404	32%	0.315	S	S	.	.			trans	-114.2	132.7	-174.1	-52.7	178.6	-170.8	176.3	0	110.8	P474 L475 D479 A480	K467-P474 WeakPolarHBondContact O-CA 3.39Å; K467-L475 HydrophobicContact CB-CD1 3.83Å; K467-L475 PolarHBondContact O-N 3.29Å; K467-L475 VanDerWaalsContact O-N 3.07Å; K467-D479 WeakPolarHBondContact CE-O 3.36Å; K467-D479 PolarHBondContact NZ-O 2.88Å; K467-D479 IonicContact NZ-OD2 2.66Å; K467-D479 PolarHBondContact NZ-OD2 3.21Å; K467-A480 HydrophobicContact CB-CB 3.84Å; K467-A480 HydrophobicContact CD-CB 4.37Å; K467-A480 HydrophobicContact CG-CB 4.35Å; K467-A480 PolarHBondContact N-O 2.79Å; K467-A480 VanDerWaalsContact N-O 3.16Å
468	F	88	Confident	88	Confident	97 Å²	97	60.7 Å²	60.7	43%	0.425	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-117.7	153	-179.6	-56.5	-97.5	0	0	0	110.4	P465 R473 P474 L475	P465-F468 HydrophobicContact CB-CE1 4.13Å; P465-F468 HydrophobicContact CB-CZ 3.93Å; P465-F468 HydrophobicContact CG-CE1 4.08Å; P465-F468 HydrophobicContact CG-CZ 3.84Å; F468-R473 CarbonylContact C-O 3.58Å; F468-R473 WeakPolarHBondContact CA-O 3.41Å; F468-P474 HydrophobicContact CD1-CG 3.89Å; F468-P474 HydrophobicContact CE1-CG 3.72Å; F468-L475 VanDerWaalsContact C-CD1 3.42Å; F468-L475 WeakPolarHBondContact O-CD1 3.18Å
469	D	84.7	Confident	88	Confident	45 Å²	45	63 Å²	63	24%	0.241	34%	0.337	C	S	.	.			trans	-78	179.5	168.8	78.1	-6.3	0	0	0	111.4	Y471 D472 R473	D469-Y471 PolarHBondContact O-N 3.27Å; D469-Y471 WeakPolarHBondContact OD1-CA 3.46Å; D469-Y471 WeakPolarHBondContact OD1-CB 3.49Å; D469-Y471 PolarHBondContact OD1-N 2.98Å; D469-D472 PolarHBondContact O-N 3.19Å; D469-D472 PolarHBondContact OD1-N 3.24Å; D469-R473 PolarHBondContact N-O 3.25Å; D469-R473 WeakPolarHBondContact OD1-CB 3.45Å; D469-R473 PolarHBondContact OD1-N 3.35Å; D469-R473 IonicContact OD1-NE 2.7Å; D469-R473 IonicContact OD2-CZ 2.76Å; D469-R473 IonicContact OD2-NE 3.7Å; D469-R473 PolarHBondContact OD2-NE 2.83Å; D469-R473 IonicContact OD2-NH2 3.9Å; D469-R473 PolarHBondContact OD2-NH2 3.21Å
470	A	84	Confident	88.2	Confident	99 Å²	99	61 Å²	61	82%	0.818	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	9.9	179.3	0	0	0	0	0	114.9
471	Y	82.7	Confident	88.3	Confident	178 Å²	178	60 Å²	60	70%	0.698	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.8	21.8	178.4	-55.8	-76.3	0	0	0	112.1	D469 R473	D469-Y471 PolarHBondContact O-N 3.27Å; D469-Y471 WeakPolarHBondContact OD1-CA 3.46Å; D469-Y471 WeakPolarHBondContact OD1-CB 3.49Å; D469-Y471 PolarHBondContact OD1-N 2.98Å; Y471-R473 PolarHBondContact O-N 3.06Å
472	D	79	Confident	88.4	Confident	139 Å²	139	62.3 Å²	62.3	74%	0.743	33%	0.327	S	S	*	.	S	Bend	trans	57.1	27.1	-177.1	-61.3	-36.2	0	0	0	114.5	D469	D469-D472 PolarHBondContact O-N 3.19Å; D469-D472 PolarHBondContact OD1-N 3.24Å
473	R	81.1	Confident	88.3	Confident	147 Å²	147	62.3 Å²	62.3	56%	0.555	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-100.2	128.6	175	-51.8	177.9	-62.2	-170.8	2.5	109.4	F468 D469 Y471 L475	F468-R473 CarbonylContact C-O 3.58Å; F468-R473 WeakPolarHBondContact CA-O 3.41Å; D469-R473 PolarHBondContact N-O 3.25Å; D469-R473 WeakPolarHBondContact OD1-CB 3.45Å; D469-R473 PolarHBondContact OD1-N 3.35Å; D469-R473 IonicContact OD1-NE 2.7Å; D469-R473 IonicContact OD2-CZ 2.76Å; D469-R473 IonicContact OD2-NE 3.7Å; D469-R473 PolarHBondContact OD2-NE 2.83Å; D469-R473 IonicContact OD2-NH2 3.9Å; D469-R473 PolarHBondContact OD2-NH2 3.21Å; Y471-R473 PolarHBondContact O-N 3.06Å; R473-L475 PolarHBondContact O-N 3.03Å
474	P	83.7	Confident	88.5	Confident	23 Å²	23	62.3 Å²	62.3	15%	0.149	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-55.4	136.6	175.4	-28	36.4	0	0	0	112.2	P465 K467 F468 W481 I504	P465-P474 HydrophobicContact CB-CB 3.64Å; P465-P474 HydrophobicContact CB-CG 3.5Å; P465-P474 HydrophobicContact CG-CG 3.93Å; K467-P474 WeakPolarHBondContact O-CA 3.39Å; F468-P474 HydrophobicContact CD1-CG 3.89Å; F468-P474 HydrophobicContact CE1-CG 3.72Å; P474-W481 HydrophobicContact CB-CH2 4.18Å; P474-W481 HydrophobicContact CB-CZ2 3.56Å; P474-W481 HydrophobicContact CG-CH2 4.4Å; P474-W481 HydrophobicContact CG-CZ2 4.24Å; P474-I504 HydrophobicContact CB-CD1 4.06Å; P474-I504 HydrophobicContact CG-CD1 3.72Å
475	L	87.4	Confident	88.6	Confident	70 Å²	70	61.3 Å²	61.3	37%	0.366	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-66.7	144.1	173.9	-72.7	103.3	0	0	0	110.4	K467 F468 R473 T477 A480 W481	K467-L475 HydrophobicContact CB-CD1 3.83Å; K467-L475 PolarHBondContact O-N 3.29Å; K467-L475 VanDerWaalsContact O-N 3.07Å; F468-L475 VanDerWaalsContact C-CD1 3.42Å; F468-L475 WeakPolarHBondContact O-CD1 3.18Å; R473-L475 PolarHBondContact O-N 3.03Å; L475-T477 PolarHBondContact O-N 2.99Å; L475-A480 HydrophobicContact CB-CB 3.73Å; L475-A480 WeakPolarHBondContact O-CB 3.49Å; L475-W481 PolarHBondContact O-NE1 2.93Å
476	G	86.1	Confident	88.8	Confident	33 Å²	33	60.1 Å²	60.1	34%	0.34	31%	0.314	S	S	.	.	S	Bend	trans	-78.3	9.9	178.7	0	0	0	0	0	115.3	T501 V502	G476-T501 CarbonylContact O-C 3.48Å; G476-T501 WeakPolarHBondContact O-CA 3.41Å; G476-T501 WeakPolarHBondContact O-CB 3.28Å; G476-V502 WeakPolarHBondContact CA-O 3.29Å; G476-V502 PolarHBondContact O-N 3.19Å
477	T	88.8	Confident	89	Confident	57 Å²	57	58.6 Å²	58.6	35%	0.35	31%	0.307	S	S	.	.	S	Bend	trans	-88	143	179.7	59.8	0	0	0	0	110.8	L475 D479 A480	L475-T477 PolarHBondContact O-N 2.99Å; T477-D479 WeakPolarHBondContact CB-OD1 3.49Å; T477-D479 PolarHBondContact O-N 2.92Å; T477-D479 VanDerWaalsContact O-N 3.12Å; T477-D479 PolarHBondContact OG1-OD1 3.24Å; T477-A480 WeakPolarHBondContact O-CB 3.27Å; T477-A480 PolarHBondContact O-N 2.74Å
478	P	88.7	Confident	89.3	Confident	44 Å²	44	54.2 Å²	54.2	29%	0.286	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-55.6	-31	-177.8	-30.8	37.7	0	0	0	115.2	A480 W481 Y500	P478-A480 VanDerWaalsContact C-N 3.26Å; P478-A480 PolarHBondContact O-N 3.47Å; P478-W481 PolarHBondContact O-N 3.33Å; P478-Y500 HydrophobicContact CB-CE1 4.44Å; P478-Y500 HydrophobicContact CB-CE2 3.76Å; P478-Y500 HydrophobicContact CG-CD2 3.91Å; P478-Y500 HydrophobicContact CG-CE1 4.32Å; P478-Y500 HydrophobicContact CG-CE2 3.65Å; P478-Y500 HydrophobicContact CG-CG 4.38Å; P478-Y500 VanDerWaalsContact CG-O 3.28Å; P478-Y500 WeakPolarHBondContact CG-O 3.38Å
479	D	90.6	Very high	89.7	Confident	93 Å²	93	49.6 Å²	49.6	50%	0.497	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-79	-3.7	180	74.3	-57.1	0	0	0	114.2	K467 T477	K467-D479 WeakPolarHBondContact CE-O 3.36Å; K467-D479 PolarHBondContact NZ-O 2.88Å; K467-D479 IonicContact NZ-OD2 2.66Å; K467-D479 PolarHBondContact NZ-OD2 3.21Å; T477-D479 WeakPolarHBondContact CB-OD1 3.49Å; T477-D479 PolarHBondContact O-N 2.92Å; T477-D479 VanDerWaalsContact O-N 3.12Å; T477-D479 PolarHBondContact OG1-OD1 3.24Å
480	A	91.1	Very high	90.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-88.5	-3.4	173.2	0	0	0	0	0	113.1	I466 K467 L475 T477 P478	I466-A480 PolarHBondContact N-O 3.22Å; K467-A480 HydrophobicContact CB-CB 3.84Å; K467-A480 HydrophobicContact CD-CB 4.37Å; K467-A480 HydrophobicContact CG-CB 4.35Å; K467-A480 PolarHBondContact N-O 2.79Å; K467-A480 VanDerWaalsContact N-O 3.16Å; L475-A480 HydrophobicContact CB-CB 3.73Å; L475-A480 WeakPolarHBondContact O-CB 3.49Å; T477-A480 WeakPolarHBondContact O-CB 3.27Å; T477-A480 PolarHBondContact O-N 2.74Å; P478-A480 VanDerWaalsContact C-N 3.26Å; P478-A480 PolarHBondContact O-N 3.47Å
481	W	93.6	Very high	90.7	Very high	10 Å²	10	49.6 Å²	49.6	4%	0.038	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	154.8	-173.3	-65.2	79.8	0	0	0	112	T456 P458 M463 I464 P465 P474 L475 P478 I486 V502 I504	T456-W481 HydrophobicContact CG2-CH2 4.27Å; T456-W481 HydrophobicContact CG2-CZ3 4.46Å; P458-W481 HydrophobicContact CB-CH2 4.32Å; P458-W481 HydrophobicContact CB-CZ3 4.11Å; M463-W481 HydrophobicContact CB-CE3 4.22Å; M463-W481 HydrophobicContact CB-CZ3 4.16Å; M463-W481 HydrophobicContact CE-CE3 4.21Å; I464-W481 WeakPolarHBondContact O-CA 3.42Å; P465-W481 HydrophobicContact CB-CD2 4.4Å; P465-W481 HydrophobicContact CB-CE3 4.16Å; P465-W481 HydrophobicContact CB-CH2 4.28Å; P465-W481 HydrophobicContact CB-CZ2 4.5Å; P465-W481 HydrophobicContact CB-CZ3 4.1Å; P465-W481 HydrophobicContact CG-CZ3 4.37Å; P474-W481 HydrophobicContact CB-CH2 4.18Å; P474-W481 HydrophobicContact CB-CZ2 3.56Å; P474-W481 HydrophobicContact CG-CH2 4.4Å; P474-W481 HydrophobicContact CG-CZ2 4.24Å; L475-W481 PolarHBondContact O-NE1 2.93Å; P478-W481 PolarHBondContact O-N 3.33Å; W481-I486 HydrophobicContact CB-CD1 3.56Å; W481-I486 HydrophobicContact CB-CG1 3.72Å; W481-I486 HydrophobicContact CG-CD1 4.35Å; W481-V502 HydrophobicContact CD2-CG1 4.03Å; W481-V502 HydrophobicContact CG-CG1 4.41Å; W481-V502 HydrophobicContact CG-CG2 4.39Å; W481-V502 HydrophobicContact CH2-CG1 4.41Å; W481-V502 HydrophobicContact CZ2-CG1 3.8Å; W481-I504 HydrophobicContact CH2-CD1 3.64Å; W481-I504 HydrophobicContact CH2-CG1 3.75Å; W481-I504 HydrophobicContact CZ2-CD1 3.74Å; W481-I504 HydrophobicContact CZ2-CG1 3.77Å
482	M	94.3	Very high	91.3	Very high	49 Å²	49	41.1 Å²	41.1	24%	0.241	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	173.3	165.6	64.3	-179.9	173.9	0	0	110.4	I464 I466 W822 F826	I464-M482 HydrophobicContact CB-CE 4.11Å; I464-M482 HydrophobicContact CB-CG 4Å; I464-M482 HydrophobicContact CD1-CE 4.32Å; I464-M482 HydrophobicContact CG2-CE 3.73Å; I464-M482 PolarHBondContact N-O 3.44Å; I464-M482 PolarHBondContact O-N 3.13Å; I466-M482 HydrophobicContact CD1-CB 3.71Å; I466-M482 HydrophobicContact CD1-CG 3.7Å; I466-M482 HydrophobicContact CD1-SD 3.87Å; I466-M482 HydrophobicContact CG1-CB 4.35Å; I466-M482 HydrophobicContact CG1-CE 4.1Å; I466-M482 HydrophobicContact CG1-CG 3.82Å; I466-M482 HydrophobicContact CG1-SD 3.98Å; M482-W822 HydrophobicContact CB-CH2 3.94Å; M482-W822 HydrophobicContact CG-CH2 4.11Å; M482-W822 HydrophobicContact SD-CH2 4.31Å; M482-F826 HydrophobicContact CE-CE2 4.19Å; M482-F826 HydrophobicContact CE-CZ 3.84Å; M482-F826 HydrophobicContact SD-CE2 4.09Å; M482-F826 HydrophobicContact SD-CZ 4.29Å
483	G	93.6	Very high	92	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	130.2	167.8	177.9	0	0	0	0	0	112	P461 F462 C485 I486 D487 W822	P461-G483 CarbonylContact O-C 3.52Å; P461-G483 VanDerWaalsContact O-CA 3.26Å; P461-G483 WeakPolarHBondContact O-CA 3.48Å; F462-G483 CarbonylContact O-C 3.45Å; F462-G483 VanDerWaalsContact O-C 3.29Å; F462-G483 WeakPolarHBondContact O-CA 3.37Å; G483-C485 PolarHBondContact O-N 2.88Å; G483-I486 PolarHBondContact O-N 3.03Å; G483-D487 PolarHBondContact O-N 2.86Å; G483-D487 VanDerWaalsContact O-N 3.15Å; G483-W822 VanDerWaalsContact C-CE2 3.43Å; G483-W822 VanDerWaalsContact CA-CH2 3.49Å; G483-W822 VanDerWaalsContact N-CH2 3.25Å
484	Y	96.1	Very high	92.5	Very high	1 Å²	1	33.1 Å²	33.1	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-54.5	-38.7	-178.5	-179.1	-82.8	0	0	0	112.4	P461 F462 D487 L488 W558 M559 L815 L818 K819 W822 W823	P461-Y484 PolarHBondContact O-N 2.94Å; F462-Y484 PolarHBondContact O-N 3.41Å; Y484-D487 PolarHBondContact O-N 3.45Å; Y484-L488 HydrophobicContact CE1-CB 4.33Å; Y484-L488 HydrophobicContact CE1-CD2 4.12Å; Y484-L488 VanDerWaalsContact O-CB 3.25Å; Y484-L488 WeakPolarHBondContact O-CB 3.24Å; Y484-L488 PolarHBondContact O-N 3.29Å; Y484-W558 HydrophobicContact CD1-CE3 4.26Å; Y484-W558 HydrophobicContact CD1-CH2 4.17Å; Y484-W558 AromaticContact CD1-CZ3 3.67Å; Y484-W558 HydrophobicContact CD1-CZ3 3.67Å; Y484-W558 HydrophobicContact CE1-CD2 4.43Å; Y484-W558 AromaticContact CE1-CE3 3.41Å; Y484-W558 HydrophobicContact CE1-CE3 3.41Å; Y484-W558 VanDerWaalsContact CE1-CE3 3.41Å; Y484-W558 HydrophobicContact CE1-CH2 4.12Å; Y484-W558 AromaticContact CE1-CZ3 3.23Å; Y484-W558 HydrophobicContact CE1-CZ3 3.23Å; Y484-M559 HydrophobicContact CD2-CE 4.5Å; Y484-M559 HydrophobicContact CE1-CE 4.15Å; Y484-M559 HydrophobicContact CE2-CE 3.85Å; Y484-L815 PolarHBondContact OH-O 3.32Å; Y484-L818 HydrophobicContact CD2-CB 3.78Å; Y484-L818 HydrophobicContact CE2-CB 3.42Å; Y484-L818 VanDerWaalsContact CE2-CB 3.42Å; Y484-K819 HydrophobicContact CE2-CB 4.24Å; Y484-W822 HydrophobicContact CD2-CB 4.29Å; Y484-W822 AromaticContact CD2-CD1 3.97Å; Y484-W822 HydrophobicContact CD2-CG 4.38Å; Y484-W823 HydrophobicContact CD2-CE3 4.44Å; Y484-W823 HydrophobicContact CD2-CH2 4.44Å; Y484-W823 AromaticContact CD2-CZ3 3.59Å; Y484-W823 HydrophobicContact CD2-CZ3 3.59Å; Y484-W823 HydrophobicContact CE2-CZ3 4.26Å; Y484-W823 HydrophobicContact CG-CH2 4.36Å; Y484-W823 AromaticContact CG-CZ3 3.85Å; Y484-W823 HydrophobicContact CG-CZ3 3.85Å
485	C	95.8	Very high	92.8	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-74	-28.1	-179.6	-76	0	0	0	0	112.9	F462 M463 G483 L489 V539	F462-C485 HydrophobicContact CB-CB 4.46Å; F462-C485 VanDerWaalsContact O-CB 3.3Å; F462-C485 WeakPolarHBondContact O-CB 3.38Å; F462-C485 PolarHBondContact O-N 3.03Å; M463-C485 HydrophobicContact CG-CB 3.85Å; M463-C485 HydrophobicContact SD-CB 3.46Å; M463-C485 WeakPolarHBondContact SD-CB 3.47Å; G483-C485 PolarHBondContact O-N 2.88Å; C485-L489 WeakPolarHBondContact O-CB 3.3Å; C485-L489 PolarHBondContact O-N 3.05Å; C485-V539 HydrophobicContact CB-CG1 3.76Å
486	I	95.5	Very high	93	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-68.1	-46.5	171.6	-66.3	-61.9	0	0	0	110.4	M463 W481 G483 L489 N490 V502	M463-I486 HydrophobicContact CE-CD1 3.6Å; M463-I486 HydrophobicContact CE-CG1 4.22Å; M463-I486 HydrophobicContact SD-CD1 3.71Å; M463-I486 HydrophobicContact SD-CG1 3.71Å; W481-I486 HydrophobicContact CB-CD1 3.56Å; W481-I486 HydrophobicContact CB-CG1 3.72Å; W481-I486 HydrophobicContact CG-CD1 4.35Å; G483-I486 PolarHBondContact O-N 3.03Å; I486-L489 PolarHBondContact O-N 3.27Å; I486-N490 WeakPolarHBondContact CG2-ND2 3.43Å; I486-N490 WeakPolarHBondContact O-CB 3.29Å; I486-N490 PolarHBondContact O-N 3.14Å; I486-N490 PolarHBondContact O-ND2 2.69Å; I486-V502 HydrophobicContact CD1-CG2 4.29Å
487	D	95.5	Very high	93	Very high	49 Å²	49	32.8 Å²	32.8	26%	0.262	19%	0.191	S	C	.	.	H	α-helix	trans	-63.9	-44.7	177.6	-74.5	-11.9	0	0	0	111.9	G483 Y484 L489 N490 H491 L818 W822	G483-D487 PolarHBondContact O-N 2.86Å; G483-D487 VanDerWaalsContact O-N 3.15Å; Y484-D487 PolarHBondContact O-N 3.45Å; D487-L489 VanDerWaalsContact C-N 3.34Å; D487-L489 PolarHBondContact O-N 2.87Å; D487-N490 PolarHBondContact O-N 2.96Å; D487-H491 PolarHBondContact O-CD2 2.96Å; D487-H491 VanDerWaalsContact O-CD2 3.24Å; D487-H491 PolarHBondContact O-N 3.39Å; D487-L818 HydrophobicContact CB-CD1 4.01Å; D487-L818 HydrophobicContact CB-CD2 3.66Å; D487-L818 HydrophobicContact CB-CG 4.46Å; D487-W822 PolarHBondContact OD2-NE1 2.99Å
488	L	95.7	Very high	93	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-56.4	-48.5	173.6	175.6	62.5	0	0	0	111.2	Y484 H491 I492 W558 L809 L815	Y484-L488 HydrophobicContact CE1-CB 4.33Å; Y484-L488 HydrophobicContact CE1-CD2 4.12Å; Y484-L488 VanDerWaalsContact O-CB 3.25Å; Y484-L488 WeakPolarHBondContact O-CB 3.24Å; Y484-L488 PolarHBondContact O-N 3.29Å; L488-H491 PolarHBondContact O-N 3.31Å; L488-I492 HydrophobicContact CD1-CD1 3.76Å; L488-I492 HydrophobicContact CD1-CG1 4.32Å; L488-I492 HydrophobicContact CG-CD1 3.83Å; L488-I492 VanDerWaalsContact O-CG1 3.3Å; L488-I492 WeakPolarHBondContact O-CG1 3.47Å; L488-I492 PolarHBondContact O-N 2.88Å; L488-W558 HydrophobicContact CD2-CB 4.28Å; L488-W558 HydrophobicContact CD2-CD2 3.71Å; L488-W558 HydrophobicContact CD2-CE3 4.12Å; L488-W558 HydrophobicContact CD2-CG 3.78Å; L488-L809 HydrophobicContact CD1-CD1 3.92Å; L488-L815 HydrophobicContact CD1-CD2 3.51Å
489	L	95.1	Very high	93.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-68.7	-37.7	-177.9	-176.8	57.4	0	0	0	112.1	V454 C485 I486 D487 H491 I492 A493 F498 Y500 M537 V539	V454-L489 HydrophobicContact CB-CD2 4.48Å; V454-L489 HydrophobicContact CG1-CD2 4.09Å; V454-L489 HydrophobicContact CG2-CD2 4.04Å; C485-L489 WeakPolarHBondContact O-CB 3.3Å; C485-L489 PolarHBondContact O-N 3.05Å; I486-L489 PolarHBondContact O-N 3.27Å; D487-L489 VanDerWaalsContact C-N 3.34Å; D487-L489 PolarHBondContact O-N 2.87Å; L489-H491 PolarHBondContact O-N 2.98Å; L489-I492 PolarHBondContact O-N 2.81Å; L489-A493 WeakPolarHBondContact O-CB 3.42Å; L489-A493 PolarHBondContact O-N 2.84Å; L489-F498 HydrophobicContact CD1-CE2 3.85Å; L489-F498 HydrophobicContact CD1-CZ 3.94Å; L489-Y500 HydrophobicContact CD2-CD1 4.16Å; L489-Y500 HydrophobicContact CD2-CD2 3.53Å; L489-Y500 HydrophobicContact CD2-CE1 4.05Å; L489-Y500 HydrophobicContact CD2-CE2 3.37Å; L489-Y500 HydrophobicContact CD2-CG 3.92Å; L489-Y500 HydrophobicContact CG-CD1 3.96Å; L489-Y500 HydrophobicContact CG-CD2 4.24Å; L489-Y500 HydrophobicContact CG-CE1 3.73Å; L489-Y500 HydrophobicContact CG-CE2 4.01Å; L489-Y500 HydrophobicContact CG-CG 4.21Å; L489-M537 HydrophobicContact CD1-CE 3.95Å; L489-V539 HydrophobicContact CD1-CG2 4.34Å; L489-V539 HydrophobicContact CD2-CG2 4.47Å
490	N	95.3	Very high	93.3	Very high	70 Å²	70	28.9 Å²	28.9	37%	0.374	16%	0.164	S	C	.	.	H	α-helix	trans	-60.6	-42.9	171.9	-75.9	-30.3	0	0	0	111.9	I486 D487 S494 Y500	I486-N490 WeakPolarHBondContact CG2-ND2 3.43Å; I486-N490 WeakPolarHBondContact O-CB 3.29Å; I486-N490 PolarHBondContact O-N 3.14Å; I486-N490 PolarHBondContact O-ND2 2.69Å; D487-N490 PolarHBondContact O-N 2.96Å; N490-S494 WeakPolarHBondContact O-CB 3.36Å; N490-S494 PolarHBondContact O-N 2.69Å; N490-Y500 PolarHBondContact OD1-OH 2.81Å
491	H	95.1	Very high	93.4	Very high	75 Å²	75	31.6 Å²	31.6	35%	0.347	18%	0.181	S	C	.	.	H	α-helix	trans	-63.8	-44.2	174.8	-85.7	-65.3	0	0	0	112.7	D487 L488 L489 D495 L809	D487-H491 PolarHBondContact O-CD2 2.96Å; D487-H491 VanDerWaalsContact O-CD2 3.24Å; D487-H491 PolarHBondContact O-N 3.39Å; L488-H491 PolarHBondContact O-N 3.31Å; L489-H491 PolarHBondContact O-N 2.98Å; H491-D495 PolarHBondContact O-N 2.98Å; H491-L809 HydrophobicContact CB-CD1 3.79Å; H491-L809 HydrophobicContact CB-CD2 3.91Å
492	I	94.9	Very high	93.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-67.8	-44.6	178.5	-66.8	168.9	0	0	0	111.1	L488 L489 S494 D495 V496 F498 I790 V802 I806 L809	L488-I492 HydrophobicContact CD1-CD1 3.76Å; L488-I492 HydrophobicContact CD1-CG1 4.32Å; L488-I492 HydrophobicContact CG-CD1 3.83Å; L488-I492 VanDerWaalsContact O-CG1 3.3Å; L488-I492 WeakPolarHBondContact O-CG1 3.47Å; L488-I492 PolarHBondContact O-N 2.88Å; L489-I492 PolarHBondContact O-N 2.81Å; I492-S494 VanDerWaalsContact C-N 3.3Å; I492-S494 PolarHBondContact O-N 2.62Å; I492-D495 PolarHBondContact O-N 3.26Å; I492-V496 HydrophobicContact CG2-CG2 4.09Å; I492-V496 WeakPolarHBondContact O-CB 3.45Å; I492-V496 WeakPolarHBondContact O-CG2 3.33Å; I492-V496 PolarHBondContact O-N 2.85Å; I492-F498 HydrophobicContact CG2-CE1 3.9Å; I492-F498 HydrophobicContact CG2-CZ 3.83Å; I492-I790 HydrophobicContact CD1-CD1 3.7Å; I492-V802 HydrophobicContact CD1-CG1 4.25Å; I492-V802 HydrophobicContact CG2-CB 4.35Å; I492-V802 HydrophobicContact CG2-CG1 4.03Å; I492-V802 HydrophobicContact CG2-CG2 3.9Å; I492-I806 HydrophobicContact CD1-CD1 4.38Å; I492-I806 HydrophobicContact CD1-CG1 3.83Å; I492-L809 HydrophobicContact CG1-CD1 3.84Å
493	A	93.3	Very high	93.3	Very high	11 Å²	11	31.6 Å²	31.6	9%	0.091	18%	0.181	C	C	.	.	H	α-helix	trans	-58	-42.1	176.9	0	0	0	0	0	111.6	L489 G497 F498 Y500	L489-A493 WeakPolarHBondContact O-CB 3.42Å; L489-A493 PolarHBondContact O-N 2.84Å; A493-G497 VanDerWaalsContact O-CA 3.28Å; A493-G497 WeakPolarHBondContact O-CA 3.46Å; A493-G497 PolarHBondContact O-N 3.04Å; A493-F498 HydrophobicContact CB-CD2 3.96Å; A493-F498 HydrophobicContact CB-CE2 3.67Å; A493-F498 HydrophobicContact CB-CZ 4.1Å; A493-F498 WeakPolarHBondContact CB-O 3.31Å; A493-F498 PolarHBondContact O-N 3.34Å; A493-Y500 HydrophobicContact CB-CD1 4.19Å; A493-Y500 HydrophobicContact CB-CE1 4.25Å
494	S	91.9	Very high	93.2	Very high	106 Å²	106	33.3 Å²	33.3	74%	0.741	19%	0.19	S	C	*	.	H	α-helix	trans	-64.3	-40.2	176.7	-168.5	0	0	0	0	113.2	N490 I492	N490-S494 WeakPolarHBondContact O-CB 3.36Å; N490-S494 PolarHBondContact O-N 2.69Å; I492-S494 VanDerWaalsContact C-N 3.3Å; I492-S494 PolarHBondContact O-N 2.62Å
495	D	91.4	Very high	92.8	Very high	70 Å²	70	33.3 Å²	33.3	37%	0.374	19%	0.19	S	C	.	.	H	α-helix	trans	-82	-31.1	-177.3	179.9	66.2	0	0	0	113.9	H491 I492 S805 K808	H491-D495 PolarHBondContact O-N 2.98Å; I492-D495 PolarHBondContact O-N 3.26Å; D495-S805 WeakPolarHBondContact CB-OG 3.12Å; D495-S805 VanDerWaalsContact OD2-CB 3.31Å; D495-S805 WeakPolarHBondContact OD2-CB 3.27Å; D495-S805 PolarHBondContact OD2-OG 2.96Å; D495-K808 IonicContact OD1-NZ 3.55Å; D495-K808 PolarHBondContact OD1-NZ 3.16Å; D495-K808 WeakPolarHBondContact OD2-CD 3.47Å; D495-K808 IonicContact OD2-NZ 2.68Å; D495-K808 PolarHBondContact OD2-NZ 3.14Å
496	V	90.5	Very high	92.2	Very high	30 Å²	30	38.9 Å²	38.9	18%	0.182	23%	0.226	C	C	.	.	H	α-helix	trans	-92.3	-32.5	178.8	-178.4	0	0	0	0	112.1	I492 F498 W798 P801	I492-V496 HydrophobicContact CG2-CG2 4.09Å; I492-V496 WeakPolarHBondContact O-CB 3.45Å; I492-V496 WeakPolarHBondContact O-CG2 3.33Å; I492-V496 PolarHBondContact O-N 2.85Å; V496-F498 HydrophobicContact CB-CD1 3.81Å; V496-F498 HydrophobicContact CB-CE1 3.85Å; V496-F498 HydrophobicContact CG1-CD1 3.74Å; V496-F498 HydrophobicContact CG1-CE1 4.05Å; V496-F498 HydrophobicContact CG2-CE1 4.34Å; V496-W798 HydrophobicContact CG1-CE3 4.2Å; V496-W798 HydrophobicContact CG1-CZ3 4.04Å; V496-P801 HydrophobicContact CG1-CB 3.98Å; V496-P801 HydrophobicContact CG2-CB 4.41Å
497	G	86.8	Confident	91.6	Very high	20 Å²	20	41.5 Å²	41.5	21%	0.206	24%	0.24	C	C	.	.			trans	100.7	12.5	173.6	0	0	0	0	0	116.7	K448 G449 A493	K448-G497 WeakPolarHBondContact CA-O 3.28Å; G449-G497 PolarHBondContact N-O 2.62Å; A493-G497 VanDerWaalsContact O-CA 3.28Å; A493-G497 WeakPolarHBondContact O-CA 3.46Å; A493-G497 PolarHBondContact O-N 3.04Å
498	F	89.3	Confident	91.2	Very high	4 Å²	4	47 Å²	47	2%	0.018	26%	0.257	C	S	.	.			trans	-90.6	157.1	175.9	63.2	-101.7	0	0	0	112.5	L452 L489 I492 A493 V496 Y500 M537 W798 V802	L452-F498 HydrophobicContact CD1-CB 4.07Å; L452-F498 HydrophobicContact CD1-CD1 4Å; L452-F498 HydrophobicContact CD1-CD2 3.82Å; L452-F498 HydrophobicContact CD1-CE1 4.37Å; L452-F498 HydrophobicContact CD1-CE2 4.2Å; L452-F498 HydrophobicContact CD1-CG 3.71Å; L452-F498 HydrophobicContact CD1-CZ 4.47Å; L452-F498 HydrophobicContact CG-CB 4.27Å; L452-F498 HydrophobicContact CG-CD2 4.29Å; L452-F498 HydrophobicContact CG-CG 4.32Å; L489-F498 HydrophobicContact CD1-CE2 3.85Å; L489-F498 HydrophobicContact CD1-CZ 3.94Å; I492-F498 HydrophobicContact CG2-CE1 3.9Å; I492-F498 HydrophobicContact CG2-CZ 3.83Å; A493-F498 HydrophobicContact CB-CD2 3.96Å; A493-F498 HydrophobicContact CB-CE2 3.67Å; A493-F498 HydrophobicContact CB-CZ 4.1Å; A493-F498 WeakPolarHBondContact CB-O 3.31Å; A493-F498 PolarHBondContact O-N 3.34Å; V496-F498 HydrophobicContact CB-CD1 3.81Å; V496-F498 HydrophobicContact CB-CE1 3.85Å; V496-F498 HydrophobicContact CG1-CD1 3.74Å; V496-F498 HydrophobicContact CG1-CE1 4.05Å; V496-F498 HydrophobicContact CG2-CE1 4.34Å; F498-Y500 HydrophobicContact CE2-CD1 4.36Å; F498-M537 HydrophobicContact CE2-SD 4.48Å; F498-M537 HydrophobicContact CZ-CE 4.4Å; F498-M537 HydrophobicContact CZ-SD 4.39Å; F498-W798 HydrophobicContact CB-CH2 4.47Å; F498-W798 HydrophobicContact CB-CZ3 4.42Å; F498-W798 HydrophobicContact CD1-CE3 4.37Å; F498-W798 HydrophobicContact CD1-CZ3 4.26Å; F498-V802 HydrophobicContact CE1-CG2 4.24Å
499	N	91.5	Very high	90.7	Very high	94 Å²	94	49.9 Å²	49.9	50%	0.503	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	167	162.3	-69.6	-17.3	0	0	0	108.8	V450 V451 L452	V450-N499 PolarHBondContact O-N 2.85Å; V450-N499 VanDerWaalsContact O-O 3.12Å; V451-N499 CarbonylContact C-O 3.6Å; V451-N499 WeakPolarHBondContact CA-O 3.45Å; V451-N499 HydrophobicContact CG2-CB 3.99Å; L452-N499 PolarHBondContact N-O 3.06Å
500	Y	93.4	Very high	90.4	Very high	13 Å²	13	51.4 Å²	51.4	5%	0.051	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	160.4	177.7	66	-87.1	0	0	0	113.5	L452 V454 P478 L489 N490 A493 F498 V502	L452-Y500 CarbonylContact O-C 3.59Å; L452-Y500 WeakPolarHBondContact O-CA 3.46Å; L452-Y500 WeakPolarHBondContact O-CB 3.35Å; V454-Y500 HydrophobicContact CG2-CD2 4.26Å; V454-Y500 HydrophobicContact CG2-CG 4.32Å; P478-Y500 HydrophobicContact CB-CE1 4.44Å; P478-Y500 HydrophobicContact CB-CE2 3.76Å; P478-Y500 HydrophobicContact CG-CD2 3.91Å; P478-Y500 HydrophobicContact CG-CE1 4.32Å; P478-Y500 HydrophobicContact CG-CE2 3.65Å; P478-Y500 HydrophobicContact CG-CG 4.38Å; P478-Y500 VanDerWaalsContact CG-O 3.28Å; P478-Y500 WeakPolarHBondContact CG-O 3.38Å; L489-Y500 HydrophobicContact CD2-CD1 4.16Å; L489-Y500 HydrophobicContact CD2-CD2 3.53Å; L489-Y500 HydrophobicContact CD2-CE1 4.05Å; L489-Y500 HydrophobicContact CD2-CE2 3.37Å; L489-Y500 HydrophobicContact CD2-CG 3.92Å; L489-Y500 HydrophobicContact CG-CD1 3.96Å; L489-Y500 HydrophobicContact CG-CD2 4.24Å; L489-Y500 HydrophobicContact CG-CE1 3.73Å; L489-Y500 HydrophobicContact CG-CE2 4.01Å; L489-Y500 HydrophobicContact CG-CG 4.21Å; N490-Y500 PolarHBondContact OD1-OH 2.81Å; A493-Y500 HydrophobicContact CB-CD1 4.19Å; A493-Y500 HydrophobicContact CB-CE1 4.25Å; F498-Y500 HydrophobicContact CE2-CD1 4.36Å; Y500-V502 HydrophobicContact CD2-CG2 4.14Å; Y500-V502 HydrophobicContact CE2-CG2 3.95Å
501	T	93.6	Very high	89.8	Confident	57 Å²	57	48.3 Å²	48.3	35%	0.35	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	146.8	164.6	47.6	0	0	0	0	109.4	V451 L452 V454 G476	V451-T501 HydrophobicContact CG1-CG2 3.82Å; L452-T501 PolarHBondContact O-N 3.23Å; V454-T501 WeakPolarHBondContact CB-O 3.41Å; V454-T501 PolarHBondContact N-O 3.29Å; G476-T501 CarbonylContact O-C 3.48Å; G476-T501 WeakPolarHBondContact O-CA 3.41Å; G476-T501 WeakPolarHBondContact O-CB 3.28Å
502	V	93.2	Very high	89	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.4	179	-174	0	0	0	0	109.1	T456 M463 G476 W481 I486 Y500	T456-V502 HydrophobicContact CG2-CG1 3.61Å; M463-V502 HydrophobicContact CE-CG1 3.8Å; M463-V502 HydrophobicContact CE-CG2 4.42Å; G476-V502 WeakPolarHBondContact CA-O 3.29Å; G476-V502 PolarHBondContact O-N 3.19Å; W481-V502 HydrophobicContact CD2-CG1 4.03Å; W481-V502 HydrophobicContact CG-CG1 4.41Å; W481-V502 HydrophobicContact CG-CG2 4.39Å; W481-V502 HydrophobicContact CH2-CG1 4.41Å; W481-V502 HydrophobicContact CZ2-CG1 3.8Å; I486-V502 HydrophobicContact CD1-CG2 4.29Å; Y500-V502 HydrophobicContact CD2-CG2 4.14Å; Y500-V502 HydrophobicContact CE2-CG2 3.95Å
503	H	91.5	Very high	88.1	Confident	53 Å²	53	47.7 Å²	47.7	25%	0.245	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.8	178.8	169.9	82.4	0	0	0	109.8	K453 V454 T455 T456 E529	K453-H503 HydrophobicContact CD-CB 4.37Å; K453-H503 VanDerWaalsContact CE-CB 3.46Å; K453-H503 VanDerWaalsContact CE-CD2 3.4Å; K453-H503 WeakPolarHBondContact CE-CD2 3.41Å; K453-H503 WeakPolarHBondContact CE-ND1 3.18Å; K453-H503 HydrophobicContact CG-CB 3.99Å; V454-H503 PolarHBondContact O-N 2.84Å; T455-H503 CarbonylContact C-O 3.53Å; T455-H503 WeakPolarHBondContact CA-O 3.38Å; T456-H503 PolarHBondContact N-O 3.36Å; H503-E529 IonicContact CD2-OE1 2.87Å; H503-E529 IonicContact CD2-OE2 3Å; H503-E529 PolarHBondContact CD2-OE2 2.92Å; H503-E529 IonicContact CE1-OE1 3.19Å; H503-E529 IonicContact NE2-OE1 3.45Å; H503-E529 PolarHBondContact NE2-OE1 2.93Å; H503-E529 IonicContact NE2-OE2 2.65Å; H503-E529 PolarHBondContact NE2-OE2 2.97Å
504	I	91.1	Very high	87.2	Confident	36 Å²	36	51.1 Å²	51.1	19%	0.185	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	130.8	178.6	-48.8	176.8	0	0	0	108.8	P474 W481 R508	P474-I504 HydrophobicContact CB-CD1 4.06Å; P474-I504 HydrophobicContact CG-CD1 3.72Å; W481-I504 HydrophobicContact CH2-CD1 3.64Å; W481-I504 HydrophobicContact CH2-CG1 3.75Å; W481-I504 HydrophobicContact CZ2-CD1 3.74Å; W481-I504 HydrophobicContact CZ2-CG1 3.77Å; I504-R508 HydrophobicContact CG2-CG 4.33Å
505	T	87.5	Confident	86.4	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.006	28%	0.279	C	S	.	.			trans	-56.1	131	172	53.1	0	0	0	0	111.3	T455 T456 I457 D507 R508 Q509 I526 E529	T455-T505 WeakPolarHBondContact OG1-CG2 3.4Å; T456-T505 PolarHBondContact O-N 3.44Å; I457-T505 VanDerWaalsContact CG2-OG1 3.27Å; I457-T505 WeakPolarHBondContact CG2-OG1 3.42Å; T505-D507 PolarHBondContact O-N 2.92Å; T505-D507 VanDerWaalsContact O-N 3.13Å; T505-R508 PolarHBondContact O-N 2.95Å; T505-R508 WeakPolarHBondContact OG1-CA 3.36Å; T505-R508 PolarHBondContact OG1-N 3.34Å; T505-Q509 PolarHBondContact OG1-N 3.13Å; T505-I526 HydrophobicContact CG2-CB 4.34Å; T505-I526 HydrophobicContact CG2-CG1 3.58Å; T505-E529 HydrophobicContact CG2-CG 4.36Å
506	P	84.8	Confident	85.2	Confident	116 Å²	116	52.6 Å²	52.6	75%	0.753	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-30.1	-177.1	-29.5	35.5	0	0	0	115	E529	P506-E529 WeakPolarHBondContact CD-OE1 3.33Å
507	D	83.2	Confident	83.6	Confident	59 Å²	59	52.7 Å²	52.7	32%	0.316	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	3.2	179.8	68.3	-20.8	0	0	0	114	T505 Q509 N524 G525	T505-D507 PolarHBondContact O-N 2.92Å; T505-D507 VanDerWaalsContact O-N 3.13Å; D507-Q509 VanDerWaalsContact C-N 3.31Å; D507-Q509 WeakPolarHBondContact O-CG 3.46Å; D507-Q509 PolarHBondContact O-N 3.37Å; D507-Q509 PolarHBondContact O-NE2 3.46Å; D507-Q509 VanDerWaalsContact O-NE2 3.1Å; D507-N524 VanDerWaalsContact OD2-CB 3.31Å; D507-N524 WeakPolarHBondContact OD2-CB 3.47Å; D507-N524 PolarHBondContact OD2-ND2 3.39Å; D507-G525 VanDerWaalsContact OD1-CA 3.28Å; D507-G525 WeakPolarHBondContact OD1-CA 3.45Å; D507-G525 PolarHBondContact OD1-N 3.05Å; D507-G525 PolarHBondContact OD2-N 3.33Å
508	R	85.7	Confident	82.3	Confident	164 Å²	164	60 Å²	60	62%	0.619	33%	0.332	S	S	*	.			trans	49.9	42.1	177.6	-58.9	-174.9	-179.6	-171.4	0.2	114.4	I504 T505	I504-R508 HydrophobicContact CG2-CG 4.33Å; T505-R508 PolarHBondContact O-N 2.95Å; T505-R508 WeakPolarHBondContact OG1-CA 3.36Å; T505-R508 PolarHBondContact OG1-N 3.34Å
509	Q	85.8	Confident	81.1	Confident	62 Å²	62	62.9 Å²	62.9	29%	0.29	36%	0.363	S	S	.	.			trans	-126.6	151.3	-177.2	-78.7	167	76.7	0	0	113.3	T505 D507 G511 N524 G525 I526	T505-Q509 PolarHBondContact OG1-N 3.13Å; D507-Q509 VanDerWaalsContact C-N 3.31Å; D507-Q509 WeakPolarHBondContact O-CG 3.46Å; D507-Q509 PolarHBondContact O-N 3.37Å; D507-Q509 PolarHBondContact O-NE2 3.46Å; D507-Q509 VanDerWaalsContact O-NE2 3.1Å; Q509-G511 PolarHBondContact O-N 3.49Å; Q509-N524 VanDerWaalsContact CD-ND2 3.29Å; Q509-N524 PolarHBondContact OE1-ND2 3.5Å; Q509-G525 CarbonylContact O-C 3.6Å; Q509-G525 WeakPolarHBondContact O-CA 3.36Å; Q509-I526 PolarHBondContact O-N 3.1Å
510	Y	88	Confident	80.1	Confident	31 Å²	31	62.6 Å²	62.6	12%	0.122	37%	0.365	C	S	.	.			trans	-64.7	-22.3	167.8	-71.2	-68.2	0	0	0	113.4	I457 D459 I526 M527 A540 G541 F542 W765	I457-Y510 HydrophobicContact CD1-CD1 4.17Å; I457-Y510 HydrophobicContact CD1-CD2 3.79Å; I457-Y510 HydrophobicContact CD1-CE1 3.91Å; I457-Y510 HydrophobicContact CD1-CE2 3.51Å; I457-Y510 HydrophobicContact CD1-CG 4.11Å; I457-Y510 HydrophobicContact CG1-CE1 4.12Å; I457-Y510 HydrophobicContact CG1-CE2 4.48Å; D459-Y510 PolarHBondContact OD2-OH 2.85Å; Y510-I526 HydrophobicContact CD1-CD1 4.1Å; Y510-M527 PolarHBondContact O-N 3.32Å; Y510-A540 HydrophobicContact CE1-CB 3.8Å; Y510-G541 WeakPolarHBondContact CE1-O 3.47Å; Y510-F542 AromaticContact CD1-CD2 3.86Å; Y510-F542 HydrophobicContact CD1-CD2 3.86Å; Y510-W765 HydrophobicContact CE2-CH2 4.01Å; Y510-W765 WeakPolarHBondContact OH-CH2 3.37Å
511	G	83.1	Confident	79.2	Confident	5 Å²	5	66.6 Å²	66.6	5%	0.052	39%	0.386	C	S	.	.			trans	90.5	135.1	-179.2	0	0	0	0	0	114.1	Q509 N524 R548	Q509-G511 PolarHBondContact O-N 3.49Å; G511-N524 WeakPolarHBondContact CA-O 3.26Å; G511-N524 WeakPolarHBondContact CA-OD1 3.36Å; G511-R548 PolarHBondContact O-NH2 2.93Å
512	S	78.4	Confident	78.6	Confident	25 Å²	25	68.9 Å²	68.9	18%	0.175	39%	0.392	C	S	.	.			trans	-134.8	166.7	172.6	54.6	0	0	0	0	110	I514 N524	S512-I514 PolarHBondContact O-N 3.38Å; S512-N524 PolarHBondContact N-OD1 2.93Å; S512-N524 PolarHBondContact O-OD1 2.98Å
513	G	76.7	Confident	78.2	Confident	38 Å²	38	70.4 Å²	70.4	39%	0.392	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	114.6	176.8	0	0	0	0	0	111.5	I521	G513-I521 VanDerWaalsContact CA-CG2 3.47Å
514	I	73.7	Confident	78	Confident	83 Å²	83	68.6 Å²	68.6	43%	0.426	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118.6	173.6	-57.3	171.6	0	0	0	107.9	S512 V516 I521 F522 N524	S512-I514 PolarHBondContact O-N 3.38Å; I514-V516 PolarHBondContact O-N 3.49Å; I514-I521 CarbonylContact O-C 3.57Å; I514-I521 WeakPolarHBondContact O-CA 3.46Å; I514-F522 PolarHBondContact N-O 3.46Å; I514-F522 PolarHBondContact O-N 2.99Å; I514-N524 HydrophobicContact CD1-CB 4.18Å
515	D	74.5	Confident	77.8	Confident	105 Å²	105	67 Å²	67	56%	0.561	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	117.7	170.3	-170.3	-8.8	0	0	0	109.2	G517	D515-G517 WeakPolarHBondContact OD1-CA 3.1Å; D515-G517 PolarHBondContact OD1-N 3.2Å
516	V	67.2	Low	78	Confident	102 Å²	102	67 Å²	67	62%	0.618	38%	0.381	S	S	*	.			trans	-89.3	4.3	179.9	-169	0	0	0	0	111	I514 T520 F522	I514-V516 PolarHBondContact O-N 3.49Å; V516-T520 PolarHBondContact N-O 3.25Å; V516-F522 HydrophobicContact CG2-CB 3.46Å; V516-F522 VanDerWaalsContact CG2-CB 3.46Å
517	G	55.9	Low	78.3	Confident	32 Å²	32	61.4 Å²	61.4	33%	0.33	35%	0.345	S	S	.	.	S	Bend	trans	89.3	174.5	-166.6	0	0	0	0	0	111.4	D515 G519 T520	D515-G517 WeakPolarHBondContact OD1-CA 3.1Å; D515-G517 PolarHBondContact OD1-N 3.2Å; G517-G519 PolarHBondContact O-N 3.01Å; G517-T520 PolarHBondContact O-N 2.76Å; G517-T520 PolarHBondContact O-OG1 3.46Å
518	N	60.5	Low	78.5	Confident	173 Å²	173	58.7 Å²	58.7	93%	0.925	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	12.7	-175.6	-59.5	-22.7	0	0	0	115.2	T520	N518-T520 VanDerWaalsContact C-N 3.28Å
519	G	64.7	Low	78.8	Confident	65 Å²	65	51.1 Å²	51.1	67%	0.67	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	10.5	-174.4	0	0	0	0	0	114.3	G517	G517-G519 PolarHBondContact O-N 3.01Å
520	T	69.2	Low	79.1	Confident	88 Å²	88	48.2 Å²	48.2	54%	0.54	29%	0.289	S	S	.	.			trans	-91.2	106.6	175.4	34.7	0	0	0	0	111.2	V516 G517 N518	V516-T520 PolarHBondContact N-O 3.25Å; G517-T520 PolarHBondContact O-N 2.76Å; G517-T520 PolarHBondContact O-OG1 3.46Å; N518-T520 VanDerWaalsContact C-N 3.28Å
521	I	74.3	Confident	79.2	Confident	96 Å²	96	50.1 Å²	50.1	49%	0.492	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	120.6	174.5	-54.8	174.5	0	0	0	109.2	G513 I514 Y523	G513-I521 VanDerWaalsContact CA-CG2 3.47Å; I514-I521 CarbonylContact O-C 3.57Å; I514-I521 WeakPolarHBondContact O-CA 3.46Å; I521-Y523 HydrophobicContact CB-CE2 4.33Å; I521-Y523 HydrophobicContact CG2-CD2 4.2Å; I521-Y523 HydrophobicContact CG2-CE2 3.64Å
522	F	82.4	Confident	79.3	Confident	106 Å²	106	54.6 Å²	54.6	47%	0.465	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	131.9	171.7	-178.9	-92.1	0	0	0	110	I514 V516	I514-F522 PolarHBondContact N-O 3.46Å; I514-F522 PolarHBondContact O-N 2.99Å; V516-F522 HydrophobicContact CG2-CB 3.46Å; V516-F522 VanDerWaalsContact CG2-CB 3.46Å
523	Y	84.9	Confident	79.8	Confident	38 Å²	38	57.4 Å²	57.4	15%	0.149	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126	176.4	-72	-94.1	0	0	0	110.4	I521 M527 G528 I531 L551	I521-Y523 HydrophobicContact CB-CE2 4.33Å; I521-Y523 HydrophobicContact CG2-CD2 4.2Å; I521-Y523 HydrophobicContact CG2-CE2 3.64Å; Y523-M527 HydrophobicContact CD1-CB 4.26Å; Y523-M527 HydrophobicContact CD1-CE 4.45Å; Y523-G528 WeakPolarHBondContact O-CA 3.11Å; Y523-I531 HydrophobicContact CD2-CD1 3.86Å; Y523-I531 HydrophobicContact CG-CD1 3.82Å; Y523-L551 HydrophobicContact CD2-CD1 3.97Å; Y523-L551 HydrophobicContact CE1-CD1 4.21Å; Y523-L551 HydrophobicContact CE2-CD1 3.33Å; Y523-L551 VanDerWaalsContact CZ-CD1 3.47Å
524	N	86.2	Confident	80.3	Confident	15 Å²	15	59.7 Å²	59.7	8%	0.08	33%	0.327	C	S	.	.			trans	-93	-173.5	173.6	78.2	-50.4	0	0	0	111.4	D507 Q509 G511 S512 I514 G528	D507-N524 VanDerWaalsContact OD2-CB 3.31Å; D507-N524 WeakPolarHBondContact OD2-CB 3.47Å; D507-N524 PolarHBondContact OD2-ND2 3.39Å; Q509-N524 VanDerWaalsContact CD-ND2 3.29Å; Q509-N524 PolarHBondContact OE1-ND2 3.5Å; G511-N524 WeakPolarHBondContact CA-O 3.26Å; G511-N524 WeakPolarHBondContact CA-OD1 3.36Å; S512-N524 PolarHBondContact N-OD1 2.93Å; S512-N524 PolarHBondContact O-OD1 2.98Å; I514-N524 HydrophobicContact CD1-CB 4.18Å; N524-G528 PolarHBondContact O-N 2.85Å
525	G	87.5	Confident	81.1	Confident	3 Å²	3	55.9 Å²	55.9	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	58.2	-154.4	174.7	0	0	0	0	0	115.8	D507 Q509 M527 G528 E529	D507-G525 VanDerWaalsContact OD1-CA 3.28Å; D507-G525 WeakPolarHBondContact OD1-CA 3.45Å; D507-G525 PolarHBondContact OD1-N 3.05Å; D507-G525 PolarHBondContact OD2-N 3.33Å; Q509-G525 CarbonylContact O-C 3.6Å; Q509-G525 WeakPolarHBondContact O-CA 3.36Å; G525-M527 VanDerWaalsContact C-N 3.27Å; G525-M527 PolarHBondContact O-N 3.3Å; G525-G528 WeakPolarHBondContact O-CA 3.37Å; G525-G528 PolarHBondContact O-N 2.99Å; G525-E529 PolarHBondContact O-N 3.09Å; G525-E529 VanDerWaalsContact O-N 3.1Å
526	I	91.6	Very high	81.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-54	-44.4	178.4	-72	-179.3	0	0	0	110.9	T455 I457 T505 Q509 Y510 G528 E529 L530 A538 A540 F542	T455-I526 HydrophobicContact CG2-CG1 4.42Å; T455-I526 HydrophobicContact CG2-CG2 4.05Å; I457-I526 HydrophobicContact CG2-CD1 4.32Å; T505-I526 HydrophobicContact CG2-CB 4.34Å; T505-I526 HydrophobicContact CG2-CG1 3.58Å; Q509-I526 PolarHBondContact O-N 3.1Å; Y510-I526 HydrophobicContact CD1-CD1 4.1Å; I526-G528 VanDerWaalsContact C-N 3.3Å; I526-G528 PolarHBondContact O-N 3.3Å; I526-E529 PolarHBondContact O-N 2.81Å; I526-L530 HydrophobicContact CG2-CD1 4.17Å; I526-L530 HydrophobicContact CG2-CG 4.5Å; I526-L530 WeakPolarHBondContact O-CG 3.42Å; I526-L530 PolarHBondContact O-N 3.48Å; I526-A538 HydrophobicContact CG2-CB 3.39Å; I526-A540 HydrophobicContact CD1-CB 3.98Å; I526-F542 HydrophobicContact CB-CE2 4.28Å; I526-F542 HydrophobicContact CB-CZ 4.48Å; I526-F542 HydrophobicContact CG2-CD1 4.42Å; I526-F542 HydrophobicContact CG2-CD2 4.28Å; I526-F542 HydrophobicContact CG2-CE1 3.96Å; I526-F542 HydrophobicContact CG2-CE2 3.79Å; I526-F542 HydrophobicContact CG2-CZ 3.6Å
527	M	91	Very high	83.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-55.8	-43.9	174.7	-79.7	-61.5	-56.1	0	0	112.5	Y510 Y523 G525 L530 I531 F542 R548 L551 V552	Y510-M527 PolarHBondContact O-N 3.32Å; Y523-M527 HydrophobicContact CD1-CB 4.26Å; Y523-M527 HydrophobicContact CD1-CE 4.45Å; G525-M527 VanDerWaalsContact C-N 3.27Å; G525-M527 PolarHBondContact O-N 3.3Å; M527-L530 PolarHBondContact O-N 2.87Å; M527-I531 HydrophobicContact CE-CD1 3.79Å; M527-I531 HydrophobicContact CE-CG1 4.43Å; M527-I531 WeakPolarHBondContact O-CB 3.37Å; M527-I531 WeakPolarHBondContact O-CD1 3.45Å; M527-I531 VanDerWaalsContact O-CG1 3.25Å; M527-I531 WeakPolarHBondContact O-CG1 3.3Å; M527-I531 PolarHBondContact O-N 2.72Å; M527-F542 HydrophobicContact CG-CE2 4.21Å; M527-F542 HydrophobicContact CG-CZ 4.01Å; M527-F542 HydrophobicContact SD-CE2 4.32Å; M527-F542 HydrophobicContact SD-CZ 3.62Å; M527-R548 HydrophobicContact CE-CB 3.96Å; M527-R548 HydrophobicContact CE-CG 3.95Å; M527-R548 HydrophobicContact CG-CG 4.07Å; M527-R548 HydrophobicContact SD-CB 3.67Å; M527-R548 HydrophobicContact SD-CG 3.44Å; M527-R548 WeakPolarHBondContact SD-CG 3.45Å; M527-L551 HydrophobicContact CE-CB 4.35Å; M527-V552 HydrophobicContact CE-CB 4.48Å; M527-V552 HydrophobicContact CE-CG1 3.82Å; M527-V552 HydrophobicContact CE-CG2 3.86Å; M527-V552 HydrophobicContact SD-CG1 4.31Å; M527-V552 HydrophobicContact SD-CG2 3.69Å
528	G	87.7	Confident	85.1	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.01	25%	0.25	C	C	.	.	H	α-helix	trans	-63.2	-46.1	178.5	0	0	0	0	0	113.1	Y523 N524 G525 I526 I531 R532	Y523-G528 WeakPolarHBondContact O-CA 3.11Å; N524-G528 PolarHBondContact O-N 2.85Å; G525-G528 WeakPolarHBondContact O-CA 3.37Å; G525-G528 PolarHBondContact O-N 2.99Å; I526-G528 VanDerWaalsContact C-N 3.3Å; I526-G528 PolarHBondContact O-N 3.3Å; G528-I531 PolarHBondContact O-N 3.3Å; G528-R532 VanDerWaalsContact C-NH1 3.31Å; G528-R532 WeakPolarHBondContact O-CB 3.49Å; G528-R532 WeakPolarHBondContact O-CG 3.18Å; G528-R532 VanDerWaalsContact O-CZ 3.32Å; G528-R532 PolarHBondContact O-N 2.94Å; G528-R532 PolarHBondContact O-NH1 3.04Å
529	E	91.8	Very high	86.8	Confident	5 Å²	5	39 Å²	39	2%	0.023	21%	0.206	C	C	.	.	H	α-helix	trans	-65.1	-38.8	178.4	-64.5	-165.5	160.1	0	0	112.2	T455 H503 T505 P506 G525 I526 R532 E533 E534	T455-E529 WeakPolarHBondContact CB-OE2 3.44Å; T455-E529 PolarHBondContact OG1-OE2 3Å; H503-E529 IonicContact CD2-OE1 2.87Å; H503-E529 IonicContact CD2-OE2 3Å; H503-E529 PolarHBondContact CD2-OE2 2.92Å; H503-E529 IonicContact CE1-OE1 3.19Å; H503-E529 IonicContact NE2-OE1 3.45Å; H503-E529 PolarHBondContact NE2-OE1 2.93Å; H503-E529 IonicContact NE2-OE2 2.65Å; H503-E529 PolarHBondContact NE2-OE2 2.97Å; T505-E529 HydrophobicContact CG2-CG 4.36Å; P506-E529 WeakPolarHBondContact CD-OE1 3.33Å; G525-E529 PolarHBondContact O-N 3.09Å; G525-E529 VanDerWaalsContact O-N 3.1Å; I526-E529 PolarHBondContact O-N 2.81Å; E529-R532 PolarHBondContact O-N 2.78Å; E529-E533 PolarHBondContact O-N 2.78Å; E529-E534 HydrophobicContact CB-CB 4.16Å; E529-E534 PolarHBondContact O-N 2.98Å
530	L	92	Very high	88.2	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-65	-43.4	174.6	-71.3	177.2	0	0	0	112.5	I526 M527 R532 E533 A538 F542 V552 P793	I526-L530 HydrophobicContact CG2-CD1 4.17Å; I526-L530 HydrophobicContact CG2-CG 4.5Å; I526-L530 WeakPolarHBondContact O-CG 3.42Å; I526-L530 PolarHBondContact O-N 3.48Å; M527-L530 PolarHBondContact O-N 2.87Å; L530-R532 VanDerWaalsContact C-N 3.3Å; L530-R532 PolarHBondContact O-N 2.89Å; L530-E533 PolarHBondContact O-N 3.22Å; L530-A538 HydrophobicContact CD1-CB 3.79Å; L530-A538 HydrophobicContact CD2-CB 4.1Å; L530-A538 HydrophobicContact CG-CB 4.17Å; L530-F542 HydrophobicContact CD1-CE1 3.92Å; L530-F542 HydrophobicContact CD1-CZ 4.25Å; L530-V552 HydrophobicContact CB-CG1 3.72Å; L530-V552 HydrophobicContact CD1-CB 4.29Å; L530-V552 HydrophobicContact CD1-CG1 4.21Å; L530-V552 HydrophobicContact CD1-CG2 4.3Å; L530-P793 HydrophobicContact CD2-CG 4.47Å
531	I	89.7	Confident	89.3	Confident	72 Å²	72	31.7 Å²	31.7	37%	0.369	15%	0.149	S	C	.	.	H	α-helix	trans	-67.4	-31.2	179.3	-72.3	167.5	0	0	0	111.7	Y523 M527 G528 E533 L551 V552	Y523-I531 HydrophobicContact CD2-CD1 3.86Å; Y523-I531 HydrophobicContact CG-CD1 3.82Å; M527-I531 HydrophobicContact CE-CD1 3.79Å; M527-I531 HydrophobicContact CE-CG1 4.43Å; M527-I531 WeakPolarHBondContact O-CB 3.37Å; M527-I531 WeakPolarHBondContact O-CD1 3.45Å; M527-I531 VanDerWaalsContact O-CG1 3.25Å; M527-I531 WeakPolarHBondContact O-CG1 3.3Å; M527-I531 PolarHBondContact O-N 2.72Å; G528-I531 PolarHBondContact O-N 3.3Å; I531-E533 VanDerWaalsContact C-N 3.33Å; I531-L551 HydrophobicContact CD1-CB 4Å; I531-L551 HydrophobicContact CD1-CD1 3.94Å; I531-L551 HydrophobicContact CG1-CB 4.3Å; I531-V552 HydrophobicContact CG1-CG1 3.76Å
532	R	86.3	Confident	90.2	Very high	99 Å²	99	27.1 Å²	27.1	37%	0.374	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	2.9	176.6	-65.1	-172	-55.1	-83.3	-7.5	114	G528 E529 L530 E534	G528-R532 VanDerWaalsContact C-NH1 3.31Å; G528-R532 WeakPolarHBondContact O-CB 3.49Å; G528-R532 WeakPolarHBondContact O-CG 3.18Å; G528-R532 VanDerWaalsContact O-CZ 3.32Å; G528-R532 PolarHBondContact O-N 2.94Å; G528-R532 PolarHBondContact O-NH1 3.04Å; E529-R532 PolarHBondContact O-N 2.78Å; L530-R532 VanDerWaalsContact C-N 3.3Å; L530-R532 PolarHBondContact O-N 2.89Å; R532-E534 HydrophobicContact CB-CG 3.86Å; R532-E534 WeakPolarHBondContact CD-OE1 3.24Å; R532-E534 IonicContact CZ-OE1 2.67Å; R532-E534 IonicContact CZ-OE2 2.63Å; R532-E534 IonicContact NE-OE1 2.96Å; R532-E534 PolarHBondContact NE-OE1 3.4Å; R532-E534 IonicContact NE-OE2 2.73Å; R532-E534 PolarHBondContact NE-OE2 3.39Å; R532-E534 IonicContact NH2-OE1 2.74Å; R532-E534 IonicContact NH2-OE2 2.73Å; R532-E534 PolarHBondContact NH2-OE2 3.45Å; R532-E534 PolarHBondContact O-N 2.83Å
533	E	87.8	Confident	90.8	Very high	84 Å²	84	22.2 Å²	22.2	39%	0.393	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	26.4	-175	-53.8	179.3	141.5	0	0	113	Q260 E529 L530 I531 A535 P793	Q260-E533 PolarHBondContact NE2-OE2 3.34Å; E529-E533 PolarHBondContact O-N 2.78Å; L530-E533 PolarHBondContact O-N 3.22Å; I531-E533 VanDerWaalsContact C-N 3.33Å; E533-A535 VanDerWaalsContact C-N 3.3Å; E533-P793 HydrophobicContact CG-CB 4.36Å
534	E	87.6	Confident	91.2	Very high	86 Å²	86	22.2 Å²	22.2	40%	0.402	11%	0.106	S	C	.	.			trans	-80.5	-10.4	179.9	-72.9	171	-175.1	0	0	112.8	K453 E529 R532	K453-E534 VanDerWaalsContact CD-O 3.3Å; K453-E534 WeakPolarHBondContact CD-O 3.41Å; K453-E534 WeakPolarHBondContact CE-O 3.37Å; K453-E534 PolarHBondContact NZ-O 3.21Å; E529-E534 HydrophobicContact CB-CB 4.16Å; E529-E534 PolarHBondContact O-N 2.98Å; R532-E534 HydrophobicContact CB-CG 3.86Å; R532-E534 WeakPolarHBondContact CD-OE1 3.24Å; R532-E534 IonicContact CZ-OE1 2.67Å; R532-E534 IonicContact CZ-OE2 2.63Å; R532-E534 IonicContact NE-OE1 2.96Å; R532-E534 PolarHBondContact NE-OE1 3.4Å; R532-E534 IonicContact NE-OE2 2.73Å; R532-E534 PolarHBondContact NE-OE2 3.39Å; R532-E534 IonicContact NH2-OE1 2.74Å; R532-E534 IonicContact NH2-OE2 2.73Å; R532-E534 PolarHBondContact NH2-OE2 3.45Å; R532-E534 PolarHBondContact O-N 2.83Å
535	A	90.5	Very high	91.5	Very high	2 Å²	2	23.2 Å²	23.2	2%	0.017	11%	0.113	C	C	.	.	S	Bend	trans	-144.8	141.5	174.2	0	0	0	0	0	110.4	T455 E533	T455-A535 HydrophobicContact CG2-CB 3.69Å; E533-A535 VanDerWaalsContact C-N 3.3Å
536	D	92.1	Very high	91.6	Very high	57 Å²	57	31.8 Å²	31.8	31%	0.305	15%	0.146	S	C	.	.	S	Bend	trans	-73	-29.7	-175.5	-62.4	-73.7	0	0	0	112.9	L452 K453 P793	L452-D536 HydrophobicContact CB-CB 4.13Å; L452-D536 HydrophobicContact CD2-CB 4.02Å; K453-D536 PolarHBondContact N-OD2 3.34Å; K453-D536 PolarHBondContact O-N 3.27Å; D536-P793 WeakPolarHBondContact O-CD 3.45Å
537	M	94.6	Very high	91.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	159	179.8	64.8	-166.8	-72.1	0	0	111.6	L452 V454 T455 L489 F498 V539 I790 G791 F792	L452-M537 HydrophobicContact CB-SD 4.34Å; L452-M537 HydrophobicContact CD1-SD 3.75Å; V454-M537 WeakPolarHBondContact CA-O 3.29Å; V454-M537 HydrophobicContact CB-CG 4.41Å; V454-M537 HydrophobicContact CG1-CG 4.47Å; V454-M537 HydrophobicContact CG2-CG 3.72Å; V454-M537 HydrophobicContact CG2-SD 3.98Å; T455-M537 PolarHBondContact N-O 3Å; L489-M537 HydrophobicContact CD1-CE 3.95Å; F498-M537 HydrophobicContact CE2-SD 4.48Å; F498-M537 HydrophobicContact CZ-CE 4.4Å; F498-M537 HydrophobicContact CZ-SD 4.39Å; M537-V539 HydrophobicContact CE-CG2 3.75Å; M537-I790 HydrophobicContact CB-CG2 4.35Å; M537-I790 HydrophobicContact CE-CD1 4.35Å; M537-I790 HydrophobicContact CE-CG2 3.65Å; M537-G791 CarbonylContact C-O 3.6Å; M537-G791 VanDerWaalsContact CA-O 3.24Å; M537-G791 WeakPolarHBondContact CA-O 3.42Å; M537-F792 HydrophobicContact CB-CD1 3.64Å; M537-F792 HydrophobicContact CB-CE1 3.6Å; M537-F792 HydrophobicContact CE-CE1 4.28Å; M537-F792 HydrophobicContact CE-CZ 4.48Å; M537-F792 HydrophobicContact SD-CE1 4.45Å
538	A	95.9	Very high	91.4	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	127.5	177	0	0	0	0	0	111.5	T455 I526 L530 F542 I790 G791	T455-A538 HydrophobicContact CG2-CB 3.67Å; T455-A538 WeakPolarHBondContact O-CA 3.17Å; I526-A538 HydrophobicContact CG2-CB 3.39Å; L530-A538 HydrophobicContact CD1-CB 3.79Å; L530-A538 HydrophobicContact CD2-CB 4.1Å; L530-A538 HydrophobicContact CG-CB 4.17Å; A538-F542 HydrophobicContact CB-CD1 4.29Å; A538-F542 HydrophobicContact CB-CE1 4.28Å; A538-I790 WeakPolarHBondContact O-CA 3.35Å; A538-G791 PolarHBondContact N-O 3Å; A538-G791 PolarHBondContact O-N 3.2Å; A538-G791 VanDerWaalsContact O-N 3.09Å
539	V	95.6	Very high	91.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	19%	0.192	C	C	.	.			trans	-132.5	104.7	179.2	-168.4	0	0	0	0	109.5	V454 T455 T456 C485 L489 M537 I790	V454-V539 HydrophobicContact CG1-CB 3.82Å; V454-V539 HydrophobicContact CG1-CG2 3.68Å; T455-V539 PolarHBondContact O-N 2.95Å; T455-V539 VanDerWaalsContact O-N 3.12Å; T456-V539 WeakPolarHBondContact CB-O 3.47Å; T456-V539 PolarHBondContact OG1-O 3.31Å; C485-V539 HydrophobicContact CB-CG1 3.76Å; L489-V539 HydrophobicContact CD1-CG2 4.34Å; L489-V539 HydrophobicContact CD2-CG2 4.47Å; M537-V539 HydrophobicContact CE-CG2 3.75Å; V539-I790 HydrophobicContact CG2-CD1 4.15Å; V539-I790 HydrophobicContact CG2-CG1 4.19Å; V539-I790 HydrophobicContact CG2-CG2 4.09Å
540	A	93.6	Very high	91.5	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.008	22%	0.221	C	C	.	.	S	Bend	trans	-159.9	-172.5	178.9	0	0	0	0	0	108.4	Y510 I526 F542 W558	Y510-A540 HydrophobicContact CE1-CB 3.8Å; I526-A540 HydrophobicContact CD1-CB 3.98Å; A540-F542 PolarHBondContact O-N 3.31Å; A540-W558 WeakPolarHBondContact O-CZ2 3.47Å
541	G	92.6	Very high	91.3	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.236	C	C	.	.	S	Bend	trans	-66.1	56	165.3	0	0	0	0	0	113.2	Y510 T543 Y788	Y510-G541 WeakPolarHBondContact CE1-O 3.47Å; G541-T543 PolarHBondContact O-N 3.03Å; G541-Y788 VanDerWaalsContact O-CE1 3.27Å; G541-Y788 WeakPolarHBondContact O-CE1 3.3Å
542	F	92.9	Very high	91.5	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.218	C	C	.	.			trans	-92.9	95.4	-163.2	-166.8	-140.7	0	0	0	111.1	Y510 I526 M527 L530 A538 A540 I544 F554 G789	Y510-F542 AromaticContact CD1-CD2 3.86Å; Y510-F542 HydrophobicContact CD1-CD2 3.86Å; I526-F542 HydrophobicContact CB-CE2 4.28Å; I526-F542 HydrophobicContact CB-CZ 4.48Å; I526-F542 HydrophobicContact CG2-CD1 4.42Å; I526-F542 HydrophobicContact CG2-CD2 4.28Å; I526-F542 HydrophobicContact CG2-CE1 3.96Å; I526-F542 HydrophobicContact CG2-CE2 3.79Å; I526-F542 HydrophobicContact CG2-CZ 3.6Å; M527-F542 HydrophobicContact CG-CE2 4.21Å; M527-F542 HydrophobicContact CG-CZ 4.01Å; M527-F542 HydrophobicContact SD-CE2 4.32Å; M527-F542 HydrophobicContact SD-CZ 3.62Å; L530-F542 HydrophobicContact CD1-CE1 3.92Å; L530-F542 HydrophobicContact CD1-CZ 4.25Å; A538-F542 HydrophobicContact CB-CD1 4.29Å; A538-F542 HydrophobicContact CB-CE1 4.28Å; A540-F542 PolarHBondContact O-N 3.31Å; F542-I544 PolarHBondContact O-N 3.36Å; F542-F554 HydrophobicContact CD1-CD1 4.49Å; F542-F554 AromaticContact CD1-CE1 3.51Å; F542-F554 HydrophobicContact CD1-CE1 3.51Å; F542-F554 HydrophobicContact CD1-CZ 4.1Å; F542-F554 AromaticContact CE1-CE1 3.55Å; F542-F554 HydrophobicContact CE1-CE1 3.55Å; F542-F554 AromaticContact CE1-CZ 3.7Å; F542-F554 HydrophobicContact CE1-CZ 3.7Å; F542-F554 HydrophobicContact CG-CE1 4.36Å; F542-F554 HydrophobicContact CZ-CE1 4.44Å; F542-F554 HydrophobicContact CZ-CZ 4.22Å; F542-G789 PolarHBondContact O-N 3.4Å
543	T	94.5	Very high	91.9	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.018	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-57.8	124.1	179.1	-26.1	0	0	0	0	111.1	G541 T545 R548 S714 E762 K786	G541-T543 PolarHBondContact O-N 3.03Å; T543-T545 HydrophobicContact CG2-CG2 4.32Å; T543-T545 PolarHBondContact O-N 2.95Å; T543-R548 PolarHBondContact O-NH1 2.91Å; T543-S714 PolarHBondContact OG1-OG 3.04Å; T543-E762 WeakPolarHBondContact CG2-OE1 3.35Å; T543-E762 PolarHBondContact OG1-OE1 2.84Å; T543-K786 HydrophobicContact CG2-CB 4.1Å; T543-K786 HydrophobicContact CG2-CD 3.71Å; T543-K786 HydrophobicContact CG2-CG 3.98Å
544	I	94.3	Very high	92.3	Very high	37 Å²	37	41.3 Å²	41.3	19%	0.19	19%	0.191	C	C	.	.			trans	-67.8	127.9	166.4	-54.9	170.6	0	0	0	107.8	F542 F554 P557 G787	F542-I544 PolarHBondContact O-N 3.36Å; I544-F554 HydrophobicContact CD1-CB 4.47Å; I544-F554 HydrophobicContact CD1-CD1 4.5Å; I544-F554 HydrophobicContact CG1-CB 4.4Å; I544-F554 HydrophobicContact CG1-CD1 3.68Å; I544-F554 HydrophobicContact CG1-CE1 4.01Å; I544-F554 HydrophobicContact CG1-CG 4.02Å; I544-F554 HydrophobicContact CG2-CD2 4.21Å; I544-F554 HydrophobicContact CG2-CE2 4.47Å; I544-F554 HydrophobicContact CG2-CG 4.29Å; I544-P557 HydrophobicContact CD1-CB 4Å; I544-G787 WeakPolarHBondContact CG1-O 3.44Å; I544-G787 PolarHBondContact N-O 3.48Å
545	T	91.5	Very high	92.7	Very high	36 Å²	36	37.5 Å²	37.5	22%	0.221	18%	0.175	C	C	.	.			trans	-140.8	152.5	172.9	72.8	0	0	0	0	110.2	T543 E547 R548 E549	T543-T545 HydrophobicContact CG2-CG2 4.32Å; T543-T545 PolarHBondContact O-N 2.95Å; T545-E547 VanDerWaalsContact C-N 3.28Å; T545-E547 PolarHBondContact O-N 3.13Å; T545-R548 WeakPolarHBondContact O-CB 3.3Å; T545-R548 PolarHBondContact O-N 2.85Å; T545-R548 WeakPolarHBondContact OG1-CG 3.11Å; T545-E549 PolarHBondContact O-N 3.27Å
546	Y	89.4	Confident	92.9	Very high	184 Å²	184	39.5 Å²	39.5	72%	0.722	19%	0.186	S	C	*	.	H	α-helix	trans	-54.6	-39.5	-177.7	175.8	-104.5	0	0	0	113.8	R548 K550	Y546-R548 VanDerWaalsContact C-N 3.3Å; Y546-R548 PolarHBondContact O-N 3.39Å; Y546-K550 PolarHBondContact O-N 3.03Å
547	E	87.1	Confident	93.1	Very high	84 Å²	84	39.7 Å²	39.7	39%	0.393	19%	0.191	S	C	.	.	H	α-helix	trans	-66.9	-31.6	177.8	-65.3	-178.8	-168.5	0	0	112.8	T545	T545-E547 VanDerWaalsContact C-N 3.28Å; T545-E547 PolarHBondContact O-N 3.13Å
548	R	91.5	Very high	93.1	Very high	11 Å²	11	40.2 Å²	40.2	4%	0.042	19%	0.193	C	C	.	.	H	α-helix	trans	-78.3	-47.9	176.8	-64.2	-179	168.7	163.9	-5	111	G511 M527 T543 T545 Y546 K550 L551 V552 F554	G511-R548 PolarHBondContact O-NH2 2.93Å; M527-R548 HydrophobicContact CE-CB 3.96Å; M527-R548 HydrophobicContact CE-CG 3.95Å; M527-R548 HydrophobicContact CG-CG 4.07Å; M527-R548 HydrophobicContact SD-CB 3.67Å; M527-R548 HydrophobicContact SD-CG 3.44Å; M527-R548 WeakPolarHBondContact SD-CG 3.45Å; T543-R548 PolarHBondContact O-NH1 2.91Å; T545-R548 WeakPolarHBondContact O-CB 3.3Å; T545-R548 PolarHBondContact O-N 2.85Å; T545-R548 WeakPolarHBondContact OG1-CG 3.11Å; Y546-R548 VanDerWaalsContact C-N 3.3Å; Y546-R548 PolarHBondContact O-N 3.39Å; R548-K550 PolarHBondContact O-N 3.3Å; R548-K550 VanDerWaalsContact O-N 3.15Å; R548-L551 PolarHBondContact O-N 3.24Å; R548-V552 HydrophobicContact CB-CG2 4.43Å; R548-V552 WeakPolarHBondContact O-CG2 3.43Å; R548-V552 PolarHBondContact O-N 3.36Å; R548-F554 HydrophobicContact CB-CE2 3.74Å; R548-F554 HydrophobicContact CB-CZ 3.9Å
549	E	91.5	Very high	93	Very high	116 Å²	116	41 Å²	41	54%	0.542	20%	0.197	S	C	.	.	H	α-helix	trans	-58.8	-26.2	179.9	-172.8	175.7	-156	0	0	113.2	T545 L551 V552 F554	T545-E549 PolarHBondContact O-N 3.27Å; E549-L551 PolarHBondContact O-N 3.5Å; E549-V552 WeakPolarHBondContact CA-O 3.37Å; E549-F554 HydrophobicContact CB-CD2 4.39Å
550	K	89.7	Confident	92.9	Very high	146 Å²	146	46.4 Å²	46.4	64%	0.635	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-22.8	171.8	-176.6	177	174.8	-173.3	0	114.1	Y546 R548	Y546-K550 PolarHBondContact O-N 3.03Å; R548-K550 PolarHBondContact O-N 3.3Å; R548-K550 VanDerWaalsContact O-N 3.15Å
551	L	89.5	Confident	92.9	Very high	61 Å²	61	46.5 Å²	46.5	32%	0.319	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.1	-29	-168.9	-59.9	176.7	0	0	0	113.9	Y523 M527 I531 R548 E549	Y523-L551 HydrophobicContact CD2-CD1 3.97Å; Y523-L551 HydrophobicContact CE1-CD1 4.21Å; Y523-L551 HydrophobicContact CE2-CD1 3.33Å; Y523-L551 VanDerWaalsContact CZ-CD1 3.47Å; M527-L551 HydrophobicContact CE-CB 4.35Å; I531-L551 HydrophobicContact CD1-CB 4Å; I531-L551 HydrophobicContact CD1-CD1 3.94Å; I531-L551 HydrophobicContact CG1-CB 4.3Å; R548-L551 PolarHBondContact O-N 3.24Å; E549-L551 PolarHBondContact O-N 3.5Å
552	V	93.1	Very high	92.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	-131.4	145.5	178.1	-57.4	0	0	0	0	109.9	M527 L530 I531 R548 E549 F554 F792	M527-V552 HydrophobicContact CE-CB 4.48Å; M527-V552 HydrophobicContact CE-CG1 3.82Å; M527-V552 HydrophobicContact CE-CG2 3.86Å; M527-V552 HydrophobicContact SD-CG1 4.31Å; M527-V552 HydrophobicContact SD-CG2 3.69Å; L530-V552 HydrophobicContact CB-CG1 3.72Å; L530-V552 HydrophobicContact CD1-CB 4.29Å; L530-V552 HydrophobicContact CD1-CG1 4.21Å; L530-V552 HydrophobicContact CD1-CG2 4.3Å; I531-V552 HydrophobicContact CG1-CG1 3.76Å; R548-V552 HydrophobicContact CB-CG2 4.43Å; R548-V552 WeakPolarHBondContact O-CG2 3.43Å; R548-V552 PolarHBondContact O-N 3.36Å; E549-V552 WeakPolarHBondContact CA-O 3.37Å; V552-F554 HydrophobicContact CG2-CD2 4.34Å; V552-F554 HydrophobicContact CG2-CE2 3.67Å; V552-F554 HydrophobicContact CG2-CZ 4.07Å; V552-F792 WeakPolarHBondContact CB-O 3.5Å
553	D	94.6	Very high	92.8	Very high	21 Å²	21	46.7 Å²	46.7	11%	0.112	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	147.2	177.5	-84.1	28.7	0	0	0	110.1	G791 F792 Q794 G795 R799	D553-G791 CarbonylContact O-C 3.55Å; D553-G791 WeakPolarHBondContact O-CA 3.29Å; D553-F792 HydrophobicContact CB-CB 4.27Å; D553-F792 PolarHBondContact N-O 3.21Å; D553-F792 PolarHBondContact O-N 3.43Å; D553-Q794 WeakPolarHBondContact OD1-CA 3.45Å; D553-G795 PolarHBondContact OD1-N 3.03Å; D553-G795 PolarHBondContact OD2-N 3.22Å; D553-G795 VanDerWaalsContact OD2-N 3.12Å; D553-R799 HydrophobicContact CB-CG 4.48Å; D553-R799 WeakPolarHBondContact OD2-CD 3.32Å; D553-R799 IonicContact OD2-CZ 2.64Å; D553-R799 IonicContact OD2-NE 3.18Å; D553-R799 IonicContact OD2-NH1 2.72Å; D553-R799 PolarHBondContact OD2-NH1 3.2Å
554	F	96.1	Very high	92.8	Very high	22 Å²	22	46.5 Å²	46.5	10%	0.096	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	153.9	174.6	-77.1	-88.7	0	0	0	112.4	F542 I544 R548 E549 V552 I790 R799	F542-F554 HydrophobicContact CD1-CD1 4.49Å; F542-F554 AromaticContact CD1-CE1 3.51Å; F542-F554 HydrophobicContact CD1-CE1 3.51Å; F542-F554 HydrophobicContact CD1-CZ 4.1Å; F542-F554 AromaticContact CE1-CE1 3.55Å; F542-F554 HydrophobicContact CE1-CE1 3.55Å; F542-F554 AromaticContact CE1-CZ 3.7Å; F542-F554 HydrophobicContact CE1-CZ 3.7Å; F542-F554 HydrophobicContact CG-CE1 4.36Å; F542-F554 HydrophobicContact CZ-CE1 4.44Å; F542-F554 HydrophobicContact CZ-CZ 4.22Å; I544-F554 HydrophobicContact CD1-CB 4.47Å; I544-F554 HydrophobicContact CD1-CD1 4.5Å; I544-F554 HydrophobicContact CG1-CB 4.4Å; I544-F554 HydrophobicContact CG1-CD1 3.68Å; I544-F554 HydrophobicContact CG1-CE1 4.01Å; I544-F554 HydrophobicContact CG1-CG 4.02Å; I544-F554 HydrophobicContact CG2-CD2 4.21Å; I544-F554 HydrophobicContact CG2-CE2 4.47Å; I544-F554 HydrophobicContact CG2-CG 4.29Å; R548-F554 HydrophobicContact CB-CE2 3.74Å; R548-F554 HydrophobicContact CB-CZ 3.9Å; E549-F554 HydrophobicContact CB-CD2 4.39Å; V552-F554 HydrophobicContact CG2-CD2 4.34Å; V552-F554 HydrophobicContact CG2-CE2 3.67Å; V552-F554 HydrophobicContact CG2-CZ 4.07Å; F554-I790 CarbonylContact C-O 3.57Å; F554-I790 WeakPolarHBondContact CA-O 3.49Å; F554-R799 WeakPolarHBondContact O-CG 3.5Å
555	S	95.9	Very high	92.8	Very high	7 Å²	7	44.8 Å²	44.8	5%	0.049	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-71	168.3	164.1	73.9	0	0	0	0	112.1	I790 S803 I806	S555-I790 PolarHBondContact N-O 3.01Å; S555-I790 PolarHBondContact OG-N 2.86Å; S555-S803 VanDerWaalsContact CA-OG 3.27Å; S555-S803 WeakPolarHBondContact CA-OG 3.31Å; S555-S803 WeakPolarHBondContact CB-OG 3.11Å; S555-I806 WeakPolarHBondContact OG-CD1 3.25Å
556	T	94.6	Very high	92.9	Very high	43 Å²	43	43.1 Å²	43.1	26%	0.264	21%	0.212	S	C	.	.	S	Bend	trans	-49.6	137.5	155.4	48.1	0	0	0	0	110.3	W558 S803 L807	T556-W558 PolarHBondContact O-N 3Å; T556-S803 PolarHBondContact N-OG 3.03Å; T556-S803 VanDerWaalsContact N-OG 3.13Å; T556-S803 WeakPolarHBondContact OG1-CA 3.47Å; T556-S803 WeakPolarHBondContact OG1-CB 3.26Å; T556-S803 PolarHBondContact OG1-O 2.92Å; T556-L807 HydrophobicContact CG2-CD1 4.33Å; T556-L807 HydrophobicContact CG2-CG 4.42Å
557	P	95.8	Very high	93	Very high	62 Å²	62	34.9 Å²	34.9	40%	0.403	18%	0.18	S	C	.	.	P	Polyproline II helix	trans	-66.2	132.7	-177.7	25.3	-33.4	0	0	0	111.2	I544 Y788	I544-P557 HydrophobicContact CD1-CB 4Å; P557-Y788 CarbonylContact C-O 3.6Å; P557-Y788 WeakPolarHBondContact CA-O 3.2Å
558	W	94.6	Very high	93.2	Very high	10 Å²	10	32.4 Å²	32.4	4%	0.038	17%	0.171	C	C	.	.	S	Bend	trans	-93.7	-15.5	-178.3	51.5	-98.6	0	0	0	113.2	F462 Y484 L488 A540 T556 Y788 I806 L815	F462-W558 AromaticContact CD1-CH2 3.91Å; F462-W558 HydrophobicContact CD1-CH2 3.91Å; F462-W558 AromaticContact CE1-CH2 3.86Å; F462-W558 HydrophobicContact CE1-CH2 3.86Å; F462-W558 HydrophobicContact CE1-CZ3 4.41Å; Y484-W558 HydrophobicContact CD1-CE3 4.26Å; Y484-W558 HydrophobicContact CD1-CH2 4.17Å; Y484-W558 AromaticContact CD1-CZ3 3.67Å; Y484-W558 HydrophobicContact CD1-CZ3 3.67Å; Y484-W558 HydrophobicContact CE1-CD2 4.43Å; Y484-W558 AromaticContact CE1-CE3 3.41Å; Y484-W558 HydrophobicContact CE1-CE3 3.41Å; Y484-W558 VanDerWaalsContact CE1-CE3 3.41Å; Y484-W558 HydrophobicContact CE1-CH2 4.12Å; Y484-W558 AromaticContact CE1-CZ3 3.23Å; Y484-W558 HydrophobicContact CE1-CZ3 3.23Å; L488-W558 HydrophobicContact CD2-CB 4.28Å; L488-W558 HydrophobicContact CD2-CD2 3.71Å; L488-W558 HydrophobicContact CD2-CE3 4.12Å; L488-W558 HydrophobicContact CD2-CG 3.78Å; A540-W558 WeakPolarHBondContact O-CZ2 3.47Å; T556-W558 PolarHBondContact O-N 3Å; W558-Y788 AromaticContact CH2-CD2 3.47Å; W558-Y788 HydrophobicContact CH2-CD2 3.47Å; W558-Y788 VanDerWaalsContact CH2-CD2 3.47Å; W558-Y788 HydrophobicContact CH2-CE2 4.38Å; W558-Y788 AromaticContact CH2-CG 3.95Å; W558-Y788 HydrophobicContact CH2-CG 3.95Å; W558-Y788 AromaticContact CZ2-CD2 3.96Å; W558-Y788 HydrophobicContact CZ2-CD2 3.96Å; W558-Y788 AromaticContact CZ2-CG 3.95Å; W558-Y788 HydrophobicContact CZ2-CG 3.95Å; W558-Y788 AromaticContact CZ3-CD2 3.87Å; W558-Y788 HydrophobicContact CZ3-CD2 3.87Å; W558-Y788 PolarHBondContact N-O 3.15Å; W558-Y788 PolarHBondContact NE1-O 2.83Å; W558-I806 HydrophobicContact CB-CD1 4.33Å; W558-I806 HydrophobicContact CB-CG1 4.44Å; W558-I806 HydrophobicContact CB-CG2 3.82Å; W558-L815 HydrophobicContact CB-CD1 4.48Å
559	M	94.3	Very high	92.9	Very high	17 Å²	17	35.4 Å²	35.4	8%	0.084	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	135.8	171.6	-174.8	172.5	-66.6	0	0	109.9	Y484 T764 G787 Y788 K819 W823	Y484-M559 HydrophobicContact CD2-CE 4.5Å; Y484-M559 HydrophobicContact CE1-CE 4.15Å; Y484-M559 HydrophobicContact CE2-CE 3.85Å; M559-T764 HydrophobicContact CG-CG2 4.27Å; M559-T764 HydrophobicContact SD-CG2 3.55Å; M559-T764 VanDerWaalsContact SD-CG2 3.55Å; M559-G787 VanDerWaalsContact O-CA 3.29Å; M559-G787 WeakPolarHBondContact O-CA 3.31Å; M559-Y788 HydrophobicContact CB-CD2 4.24Å; M559-Y788 PolarHBondContact O-N 2.85Å; M559-Y788 HydrophobicContact SD-CD2 4.48Å; M559-K819 HydrophobicContact CE-CB 4.18Å; M559-K819 HydrophobicContact CE-CD 4.22Å; M559-K819 HydrophobicContact CE-CG 3.83Å; M559-W823 HydrophobicContact CE-CH2 3.92Å; M559-W823 HydrophobicContact CE-CZ3 4.09Å; M559-W823 HydrophobicContact SD-CH2 4.12Å; M559-W823 HydrophobicContact SD-CZ2 4.23Å
560	T	94.1	Very high	92.2	Very high	113 Å²	113	31.3 Å²	31.3	69%	0.693	17%	0.166	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	145.5	172.6	48.2	0	0	0	0	110.7
561	L	93.7	Very high	91.3	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	-178	-175.1	60.6	130.7	0	0	0	110.6	E762 T764 K786 Y788	L561-E762 HydrophobicContact CD1-CB 3.65Å; L561-E762 HydrophobicContact CD1-CG 3.6Å; L561-E762 WeakPolarHBondContact CD1-OE1 3.1Å; L561-T764 HydrophobicContact CB-CG2 3.9Å; L561-K786 HydrophobicContact CD1-CB 3.92Å; L561-K786 HydrophobicContact CG-CB 3.86Å; L561-K786 PolarHBondContact N-O 2.87Å; L561-K786 PolarHBondContact O-N 2.86Å; L561-K786 VanDerWaalsContact O-O 3.05Å; L561-Y788 HydrophobicContact CD1-CE1 4.01Å; L561-Y788 HydrophobicContact CD2-CD1 3.68Å; L561-Y788 HydrophobicContact CD2-CD2 3.73Å; L561-Y788 HydrophobicContact CD2-CE1 3.78Å; L561-Y788 HydrophobicContact CD2-CE2 3.83Å; L561-Y788 HydrophobicContact CD2-CG 3.65Å
562	G	92.2	Very high	90.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.174	C	C	.	.			trans	-159.5	171.6	164.5	0	0	0	0	0	111.5	E762 S763 D784	G562-E762 WeakPolarHBondContact O-CA 3.08Å; G562-S763 PolarHBondContact N-OG 3.33Å; G562-S763 WeakPolarHBondContact O-CB 3.28Å; G562-S763 PolarHBondContact O-N 2.89Å; G562-S763 PolarHBondContact O-OG 3.46Å; G562-D784 WeakPolarHBondContact CA-O 3.12Å; G562-D784 WeakPolarHBondContact CA-OD1 3.17Å
563	G	91.6	Very high	88.6	Confident	3 Å²	3	39.8 Å²	39.8	3%	0.031	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	139.4	166.1	0	0	0	0	0	110.6	L782 L783 D784	G563-L782 CarbonylContact O-C 3.53Å; G563-L782 WeakPolarHBondContact O-CA 3.42Å; G563-L783 WeakPolarHBondContact O-CG 3.39Å; G563-L783 PolarHBondContact O-N 3.46Å; G563-D784 PolarHBondContact N-OD1 3.29Å
564	S	93.5	Very high	87.2	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	146.4	-170.7	-172.9	0	0	0	0	110.6	L761 N766 Q778	S564-L761 PolarHBondContact N-O 2.7Å; S564-L761 PolarHBondContact O-N 2.66Å; S564-L761 VanDerWaalsContact O-N 3.13Å; S564-N766 PolarHBondContact OG-ND2 2.87Å; S564-Q778 WeakPolarHBondContact OG-CG 3.21Å; S564-Q778 PolarHBondContact OG-NE2 2.68Å
565	I	94	Very high	85.9	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	119.8	-177.8	-57.2	162.6	0	0	0	108.8	I693 A696 L699 A758 N766 Q778 V779 L783	I565-I693 HydrophobicContact CG2-CD1 4.25Å; I565-A696 HydrophobicContact CD1-CB 4.21Å; I565-L699 HydrophobicContact CD1-CD1 3.81Å; I565-L699 HydrophobicContact CG1-CD1 4.25Å; I565-L699 HydrophobicContact CG2-CD1 4.08Å; I565-A758 HydrophobicContact CG2-CB 3.99Å; I565-N766 VanDerWaalsContact C-ND2 3.32Å; I565-N766 PolarHBondContact O-ND2 3.03Å; I565-Q778 CarbonylContact O-C 3.56Å; I565-Q778 WeakPolarHBondContact O-CA 3.37Å; I565-V779 HydrophobicContact CB-CB 4.2Å; I565-V779 HydrophobicContact CG2-CB 4.16Å; I565-V779 PolarHBondContact O-N 2.81Å; I565-L783 HydrophobicContact CD1-CD2 4.49Å
566	L	93.6	Very high	84.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	123.5	168.5	-179.6	78.5	0	0	0	109	I749 V752 F759 L761 N766 L776	L566-I749 HydrophobicContact CD2-CG1 3.98Å; L566-V752 HydrophobicContact CD2-CG2 4.34Å; L566-F759 HydrophobicContact CB-CB 4.37Å; L566-F759 HydrophobicContact CD2-CB 4.44Å; L566-F759 HydrophobicContact CD2-CD1 4.11Å; L566-F759 PolarHBondContact N-O 3.49Å; L566-F759 PolarHBondContact O-N 3.2Å; L566-L761 HydrophobicContact CB-CD2 3.55Å; L566-L761 HydrophobicContact CD2-CD2 4.42Å; L566-N766 WeakPolarHBondContact CD1-OD1 3.41Å; L566-L776 HydrophobicContact CD1-CB 3.93Å; L566-L776 HydrophobicContact CD1-CD1 4.12Å; L566-L776 HydrophobicContact CD1-CD2 4.32Å; L566-L776 HydrophobicContact CD1-CG 4.34Å; L566-L776 HydrophobicContact CD2-CD1 4.44Å; L566-L776 HydrophobicContact CD2-CD2 4.45Å; L566-L776 HydrophobicContact CG-CD2 4.34Å
567	F	92.8	Very high	84.1	Confident	12 Å²	12	51.3 Å²	51.3	5%	0.053	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	171.6	178.2	-165.1	-118.1	0	0	0	110.9	P692 I693 I705 V752 Y757 A758 L776 T777 V779	F567-P692 HydrophobicContact CE1-CG 3.63Å; F567-P692 HydrophobicContact CZ-CG 4.05Å; F567-I693 HydrophobicContact CB-CD1 4.21Å; F567-I693 HydrophobicContact CD1-CD1 4.14Å; F567-I693 HydrophobicContact CD1-CG1 4.26Å; F567-I693 HydrophobicContact CD2-CD1 4.07Å; F567-I693 HydrophobicContact CE1-CG1 4.47Å; F567-I693 HydrophobicContact CG-CD1 3.87Å; F567-I693 HydrophobicContact CG-CG1 4.49Å; F567-I705 HydrophobicContact CE2-CD1 4.36Å; F567-I705 HydrophobicContact CE2-CG2 3.94Å; F567-I705 HydrophobicContact CZ-CD1 4.1Å; F567-V752 VanDerWaalsContact C-CG1 3.46Å; F567-Y757 VanDerWaalsContact CD2-O 3.31Å; F567-Y757 WeakPolarHBondContact CD2-O 3.05Å; F567-Y757 WeakPolarHBondContact CE2-O 3.49Å; F567-A758 HydrophobicContact CD2-CB 3.89Å; F567-A758 HydrophobicContact CE2-CB 4.5Å; F567-L776 WeakPolarHBondContact O-CA 3.13Å; F567-T777 PolarHBondContact N-O 3.34Å; F567-T777 PolarHBondContact O-N 3.34Å; F567-V779 HydrophobicContact CB-CG2 3.73Å; F567-V779 HydrophobicContact CG-CG2 4.5Å
568	T	90.4	Very high	83.4	Confident	32 Å²	32	53.8 Å²	53.8	20%	0.196	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	140	169.5	39.1	0	0	0	0	110.2	V752 R775	T568-V752 HydrophobicContact CG2-CG1 4.08Å; T568-V752 WeakPolarHBondContact CG2-O 3.45Å; T568-R775 WeakPolarHBondContact CA-O 3.32Å
569	R	85.2	Confident	82.7	Confident	73 Å²	73	53.7 Å²	53.7	28%	0.275	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-59.6	125.8	172.9	-171.2	170	-60.5	176.9	9.3	108.6	K571 C774 R775 L776	R569-K571 PolarHBondContact O-N 2.76Å; R569-C774 PolarHBondContact NE-O 3.24Å; R569-C774 VanDerWaalsContact NE-O 3.15Å; R569-C774 PolarHBondContact NH1-O 3.3Å; R569-C774 PolarHBondContact NH2-O 2.57Å; R569-C774 VanDerWaalsContact NH2-O 3.14Å; R569-R775 PolarHBondContact N-O 2.92Å; R569-L776 PolarHBondContact NE-O 3.12Å; R569-L776 PolarHBondContact NH2-O 2.92Å
570	P	76.9	Confident	82.1	Confident	31 Å²	31	54.5 Å²	54.5	20%	0.201	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-60.4	123.9	-180	23.9	-33.1	0	0	0	109.4	M689	P570-M689 HydrophobicContact CG-CB 4.46Å
571	K	70.9	Confident	81.8	Confident	193 Å²	193	53 Å²	53	84%	0.839	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-71.9	138.1	171.9	-60.6	-179.4	-177.2	178.8	0	108.1	R569 Q573	R569-K571 PolarHBondContact O-N 2.76Å; K571-Q573 PolarHBondContact O-N 2.86Å
572	S	64.5	Low	81.4	Confident	43 Å²	43	57.9 Å²	57.9	30%	0.301	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-48.2	126	173.1	-53	0	0	0	0	110.1	K574 E687	S572-K574 PolarHBondContact O-N 2.77Å; S572-E687 WeakPolarHBondContact CB-OE2 3.21Å; S572-E687 PolarHBondContact OG-OE2 3.02Å
573	Q	62.4	Low	81.2	Confident	148 Å²	148	58.4 Å²	58.4	69%	0.692	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-66.6	131.6	179	-66.1	-170.4	6.1	0	0	108.8	K571	K571-Q573 PolarHBondContact O-N 2.86Å
574	K	65.1	Low	81.1	Confident	149 Å²	149	59 Å²	59	65%	0.648	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-56.4	129.6	174.8	-78.3	-178.8	170.5	-80.9	0	109	S572 S576 E848	S572-K574 PolarHBondContact O-N 2.77Å; K574-S576 PolarHBondContact O-N 3.47Å; K574-E848 IonicContact NZ-OE1 3.12Å; K574-E848 PolarHBondContact NZ-OE1 2.84Å; K574-E848 IonicContact NZ-OE2 3.58Å; K574-E848 PolarHBondContact NZ-OE2 3.31Å
575	P	67.2	Low	81.1	Confident	43 Å²	43	61.5 Å²	61.5	28%	0.279	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-61.3	137	-177	25.1	-33.6	0	0	0	110	E848 Q849	P575-E848 HydrophobicContact CG-CB 4.21Å; P575-Q849 HydrophobicContact CB-CG 4.23Å; P575-Q849 HydrophobicContact CG-CB 4.4Å; P575-Q849 HydrophobicContact CG-CG 3.62Å
576	S	74.5	Confident	80.9	Confident	58 Å²	58	65.9 Å²	65.9	41%	0.406	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-64.5	149.2	174.6	73.7	0	0	0	0	110.2	K574 F578 S579	K574-S576 PolarHBondContact O-N 3.47Å; S576-F578 PolarHBondContact O-N 2.62Å; S576-S579 VanDerWaalsContact O-CB 3.26Å; S576-S579 WeakPolarHBondContact O-CB 3.19Å; S576-S579 PolarHBondContact O-N 2.93Å
577	L	79.8	Confident	81	Confident	86 Å²	86	71.1 Å²	71.1	45%	0.45	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-31.8	180	-68.4	167.1	0	0	0	112.7	S579 G852 I855	L577-S579 VanDerWaalsContact C-N 3.31Å; L577-S579 PolarHBondContact O-N 3.12Å; L577-G852 WeakPolarHBondContact O-CA 3.21Å; L577-G852 PolarHBondContact O-N 3.21Å; L577-I855 HydrophobicContact CD1-CD1 3.85Å; L577-I855 HydrophobicContact CD2-CD1 4.16Å; L577-I855 HydrophobicContact CG-CD1 4.45Å
578	F	80.2	Confident	81	Confident	113 Å²	113	73 Å²	73	50%	0.496	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	17.5	178.7	-57.1	-70.9	0	0	0	114.2	S576 F580 L581	S576-F578 PolarHBondContact O-N 2.62Å; F578-F580 HydrophobicContact CD1-CE1 4.21Å; F578-F580 HydrophobicContact CD1-CZ 4.48Å; F578-F580 PolarHBondContact O-N 3.32Å; F578-F580 VanDerWaalsContact O-N 3.09Å; F578-L581 PolarHBondContact O-N 2.76Å
579	S	79.3	Confident	81.1	Confident	8 Å²	8	76.3 Å²	76.3	6%	0.056	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-55.8	-30.1	-177.7	-158	0	0	0	0	113.6	S576 L577 L581 Q582 F683	S576-S579 VanDerWaalsContact O-CB 3.26Å; S576-S579 WeakPolarHBondContact O-CB 3.19Å; S576-S579 PolarHBondContact O-N 2.93Å; L577-S579 VanDerWaalsContact C-N 3.31Å; L577-S579 PolarHBondContact O-N 3.12Å; S579-L581 PolarHBondContact O-N 3.41Å; S579-Q582 WeakPolarHBondContact O-CB 3.39Å; S579-Q582 PolarHBondContact O-N 2.94Å; S579-Q582 VanDerWaalsContact O-N 3.11Å; S579-F683 WeakPolarHBondContact OG-CE1 3.49Å
580	F	83.2	Confident	81.6	Confident	34 Å²	34	78 Å²	78	15%	0.149	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-63.9	-15.9	178.4	70.8	-88.8	0	0	0	114.4	F578 P583 Y676 V853 V856	F578-F580 HydrophobicContact CD1-CE1 4.21Å; F578-F580 HydrophobicContact CD1-CZ 4.48Å; F578-F580 PolarHBondContact O-N 3.32Å; F578-F580 VanDerWaalsContact O-N 3.09Å; F580-P583 WeakPolarHBondContact O-CD 3.21Å; F580-Y676 PolarHBondContact O-OH 2.85Å; F580-V853 HydrophobicContact CB-CG2 4.12Å; F580-V853 HydrophobicContact CD1-CG2 3.7Å; F580-V853 HydrophobicContact CD2-CG2 4.22Å; F580-V853 HydrophobicContact CE1-CG2 4.17Å; F580-V853 HydrophobicContact CG-CG2 3.74Å; F580-V856 HydrophobicContact CZ-CG2 4.07Å
581	L	86.8	Confident	82.4	Confident	81 Å²	81	84 Å²	84	42%	0.424	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-85.7	-18.5	175	-65.9	176.9	0	0	0	113.4	F578 S579 L584 W589	F578-L581 PolarHBondContact O-N 2.76Å; S579-L581 PolarHBondContact O-N 3.41Å; L581-L584 VanDerWaalsContact O-O 3.07Å; L581-W589 HydrophobicContact CD2-CZ2 4.26Å; L581-W589 PolarHBondContact O-NE1 3.05Å; L581-W589 VanDerWaalsContact O-NE1 3.13Å
582	Q	85.9	Confident	83.5	Confident	108 Å²	108	75.6 Å²	75.6	51%	0.505	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-24.2	-175.2	-58	-172.3	-2.9	0	0	116.7	S579 L584 F683	S579-Q582 WeakPolarHBondContact O-CB 3.39Å; S579-Q582 PolarHBondContact O-N 2.94Å; S579-Q582 VanDerWaalsContact O-N 3.11Å; Q582-L584 PolarHBondContact O-N 3.33Å; Q582-L584 VanDerWaalsContact O-N 3.13Å; Q582-F683 HydrophobicContact CB-CE2 4.17Å; Q582-F683 HydrophobicContact CB-CZ 4.49Å
583	P	87.8	Confident	84.8	Confident	11 Å²	11	75 Å²	75	7%	0.071	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.6	178.5	-28.6	37.2	0	0	0	116	F580 Y676 N679 L680	F580-P583 WeakPolarHBondContact O-CD 3.21Å; P583-Y676 HydrophobicContact CB-CD2 4.23Å; P583-Y676 HydrophobicContact CB-CE2 4.24Å; P583-Y676 HydrophobicContact CG-CE2 4.28Å; P583-N679 HydrophobicContact CB-CB 3.81Å; P583-N679 VanDerWaalsContact O-CB 3.27Å; P583-N679 WeakPolarHBondContact O-CB 3.23Å; P583-N679 PolarHBondContact O-ND2 2.8Å; P583-L680 HydrophobicContact CB-CB 4.24Å; P583-L680 HydrophobicContact CG-CB 3.88Å; P583-L680 HydrophobicContact CG-CD1 3.76Å; P583-L680 HydrophobicContact CG-CG 4.42Å
584	L	89.9	Confident	86.3	Confident	15 Å²	15	74.6 Å²	74.6	8%	0.079	38%	0.379	C	S	.	.	S	Bend	trans	-125.8	136.5	171	-65.7	177.5	0	0	0	108.6	L581 Q582 V588 W589 Y676	L581-L584 VanDerWaalsContact O-O 3.07Å; Q582-L584 PolarHBondContact O-N 3.33Å; Q582-L584 VanDerWaalsContact O-N 3.13Å; L584-V588 HydrophobicContact CB-CB 4.39Å; L584-V588 HydrophobicContact CB-CG1 4.43Å; L584-V588 HydrophobicContact CD1-CG1 4.32Å; L584-V588 HydrophobicContact CD2-CG1 4.14Å; L584-W589 HydrophobicContact CB-CZ2 4.45Å; L584-W589 HydrophobicContact CD1-CH2 4.5Å; L584-W589 HydrophobicContact CD1-CZ2 4.27Å; L584-W589 PolarHBondContact O-NE1 3.43Å; L584-Y676 HydrophobicContact CD1-CD2 4.11Å; L584-Y676 HydrophobicContact CG-CD2 4.2Å
585	S	91.9	Very high	87.7	Confident	52 Å²	52	69.9 Å²	69.9	36%	0.364	36%	0.363	S	S	.	.			trans	-66.3	154.9	178.6	74.5	0	0	0	0	111.2	Q587 V588 W589	S585-Q587 VanDerWaalsContact CB-OE1 3.25Å; S585-Q587 PolarHBondContact O-N 2.92Å; S585-Q587 PolarHBondContact OG-OE1 3.3Å; S585-V588 PolarHBondContact O-N 3.18Å; S585-W589 PolarHBondContact O-N 3.25Å
586	P	91.6	Very high	88.9	Confident	94 Å²	94	69.9 Å²	69.9	61%	0.61	36%	0.357	S	S	*	.	H	α-helix	trans	-53.7	-30.6	177.5	-27.9	36.1	0	0	0	113.7	L590	P586-L590 WeakPolarHBondContact O-CG 3.49Å; P586-L590 PolarHBondContact O-N 3.41Å
587	Q	94.3	Very high	89.8	Confident	110 Å²	110	71 Å²	71	51%	0.514	36%	0.358	S	S	.	.	H	α-helix	trans	-66.1	-41.9	175.7	-59.7	83	-4	0	0	112.1	S585 L590 Y591	S585-Q587 VanDerWaalsContact CB-OE1 3.25Å; S585-Q587 PolarHBondContact O-N 2.92Å; S585-Q587 PolarHBondContact OG-OE1 3.3Å; Q587-L590 PolarHBondContact O-N 3.31Å; Q587-Y591 HydrophobicContact CB-CE2 4.39Å; Q587-Y591 VanDerWaalsContact O-CD2 3.23Å; Q587-Y591 WeakPolarHBondContact O-CD2 3.27Å; Q587-Y591 PolarHBondContact O-N 3.47Å; Q587-Y591 VanDerWaalsContact O-N 3.11Å
588	V	93.2	Very high	90.5	Very high	51 Å²	51	69.2 Å²	69.2	31%	0.309	36%	0.356	S	S	.	.	H	α-helix	trans	-68.5	-40	178.7	179	0	0	0	0	111	L584 S585 L590 Y591 V592	L584-V588 HydrophobicContact CB-CB 4.39Å; L584-V588 HydrophobicContact CB-CG1 4.43Å; L584-V588 HydrophobicContact CD1-CG1 4.32Å; L584-V588 HydrophobicContact CD2-CG1 4.14Å; S585-V588 PolarHBondContact O-N 3.18Å; V588-L590 VanDerWaalsContact C-N 3.27Å; V588-L590 PolarHBondContact O-N 3.24Å; V588-Y591 PolarHBondContact O-N 3.02Å; V588-Y591 VanDerWaalsContact O-N 3.14Å; V588-V592 HydrophobicContact CG1-CG2 4.35Å; V588-V592 WeakPolarHBondContact O-CG2 3.49Å; V588-V592 PolarHBondContact O-N 3.5Å
589	W	93.3	Very high	91.1	Very high	102 Å²	102	65 Å²	65	39%	0.386	34%	0.34	S	S	.	.	H	α-helix	trans	-56.4	-40.7	173.2	-76.4	113.1	0	0	0	112.4	L581 L584 S585 G593 Y676	L581-W589 HydrophobicContact CD2-CZ2 4.26Å; L581-W589 PolarHBondContact O-NE1 3.05Å; L581-W589 VanDerWaalsContact O-NE1 3.13Å; L584-W589 HydrophobicContact CB-CZ2 4.45Å; L584-W589 HydrophobicContact CD1-CH2 4.5Å; L584-W589 HydrophobicContact CD1-CZ2 4.27Å; L584-W589 PolarHBondContact O-NE1 3.43Å; S585-W589 PolarHBondContact O-N 3.25Å; W589-G593 PolarHBondContact O-N 3.08Å; W589-G593 VanDerWaalsContact O-N 3.1Å; W589-Y676 HydrophobicContact CH2-CD2 4.35Å; W589-Y676 HydrophobicContact CH2-CE2 4.29Å; W589-Y676 HydrophobicContact CZ2-CD2 4.2Å; W589-Y676 HydrophobicContact CZ2-CE2 4.03Å
590	L	94.2	Very high	91.7	Very high	109 Å²	109	64.7 Å²	64.7	57%	0.571	34%	0.337	S	S	*	.	H	α-helix	trans	-64.3	-45	174.4	-68.9	168.2	0	0	0	112.1	P586 Q587 V588 V592 G593 F594	P586-L590 WeakPolarHBondContact O-CG 3.49Å; P586-L590 PolarHBondContact O-N 3.41Å; Q587-L590 PolarHBondContact O-N 3.31Å; V588-L590 VanDerWaalsContact C-N 3.27Å; V588-L590 PolarHBondContact O-N 3.24Å; L590-V592 PolarHBondContact O-N 2.83Å; L590-G593 PolarHBondContact O-N 3.14Å; L590-F594 HydrophobicContact CB-CE2 4.42Å; L590-F594 WeakPolarHBondContact O-CD2 3.37Å; L590-F594 PolarHBondContact O-N 3.36Å
591	Y	95	Very high	92.2	Very high	155 Å²	155	67.5 Å²	67.5	61%	0.608	35%	0.354	S	S	*	.	H	α-helix	trans	-65	-37.2	178.5	-62.4	-42.1	0	0	0	113.4	Q587 V588 G593 F594 T595	Q587-Y591 HydrophobicContact CB-CE2 4.39Å; Q587-Y591 VanDerWaalsContact O-CD2 3.23Å; Q587-Y591 WeakPolarHBondContact O-CD2 3.27Å; Q587-Y591 PolarHBondContact O-N 3.47Å; Q587-Y591 VanDerWaalsContact O-N 3.11Å; V588-Y591 PolarHBondContact O-N 3.02Å; V588-Y591 VanDerWaalsContact O-N 3.14Å; Y591-G593 VanDerWaalsContact C-N 3.34Å; Y591-F594 PolarHBondContact O-N 3.49Å; Y591-T595 WeakPolarHBondContact O-CB 3.12Å; Y591-T595 PolarHBondContact O-N 2.96Å; Y591-T595 PolarHBondContact O-OG1 3.42Å
592	V	92.5	Very high	92.4	Very high	17 Å²	17	67 Å²	67	10%	0.103	36%	0.356	C	S	.	.	H	α-helix	trans	-62.2	-43.4	172.1	173	0	0	0	0	110.3	V588 L590 T595 Y596 I672	V588-V592 HydrophobicContact CG1-CG2 4.35Å; V588-V592 WeakPolarHBondContact O-CG2 3.49Å; V588-V592 PolarHBondContact O-N 3.5Å; L590-V592 PolarHBondContact O-N 2.83Å; V592-T595 PolarHBondContact O-N 3.37Å; V592-Y596 WeakPolarHBondContact O-CB 3.26Å; V592-Y596 PolarHBondContact O-N 2.89Å; V592-I672 HydrophobicContact CG1-CG2 4.46Å; V592-I672 HydrophobicContact CG2-CD1 4.15Å; V592-I672 HydrophobicContact CG2-CG1 4.48Å; V592-I672 HydrophobicContact CG2-CG2 3.98Å
593	G	92.7	Very high	92.7	Very high	31 Å²	31	61.8 Å²	61.8	32%	0.32	33%	0.332	S	S	.	.	H	α-helix	trans	-58.4	-48.8	174.5	0	0	0	0	0	113.5	W589 L590 Y591 Y596 L597	W589-G593 PolarHBondContact O-N 3.08Å; W589-G593 VanDerWaalsContact O-N 3.1Å; L590-G593 PolarHBondContact O-N 3.14Å; Y591-G593 VanDerWaalsContact C-N 3.34Å; G593-Y596 PolarHBondContact O-N 3.48Å; G593-L597 WeakPolarHBondContact O-CG 3.42Å; G593-L597 PolarHBondContact O-N 2.89Å; G593-L597 VanDerWaalsContact O-N 3.13Å
594	F	94.6	Very high	92.9	Very high	139 Å²	139	64.1 Å²	64.1	61%	0.61	34%	0.341	S	S	*	.	H	α-helix	trans	-63.6	-42.1	176.9	-72.5	-61.1	0	0	0	112.7	L590 Y591 L597 A598	L590-F594 HydrophobicContact CB-CE2 4.42Å; L590-F594 WeakPolarHBondContact O-CD2 3.37Å; L590-F594 PolarHBondContact O-N 3.36Å; Y591-F594 PolarHBondContact O-N 3.49Å; F594-L597 PolarHBondContact O-N 3.41Å; F594-A598 PolarHBondContact O-N 3.01Å
595	T	93.1	Very high	92.9	Very high	50 Å²	50	67 Å²	67	31%	0.307	36%	0.359	S	S	.	.	H	α-helix	trans	-64.9	-42.5	179.5	-52.5	0	0	0	0	111.3	Y591 V592 L597 A598 V599 W665 F668	Y591-T595 WeakPolarHBondContact O-CB 3.12Å; Y591-T595 PolarHBondContact O-N 2.96Å; Y591-T595 PolarHBondContact O-OG1 3.42Å; V592-T595 PolarHBondContact O-N 3.37Å; T595-L597 PolarHBondContact O-N 2.86Å; T595-A598 PolarHBondContact O-N 3.06Å; T595-V599 HydrophobicContact CG2-CG2 4.48Å; T595-V599 WeakPolarHBondContact O-CG2 3.42Å; T595-V599 PolarHBondContact O-N 3.49Å; T595-W665 HydrophobicContact CG2-CZ3 4.37Å; T595-F668 HydrophobicContact CG2-CD1 4.5Å; T595-F668 HydrophobicContact CG2-CE1 3.88Å; T595-F668 HydrophobicContact CG2-CE2 4.26Å; T595-F668 HydrophobicContact CG2-CZ 3.74Å
596	Y	93.7	Very high	92.8	Very high	43 Å²	43	65.7 Å²	65.7	17%	0.169	35%	0.351	C	S	.	.	H	α-helix	trans	-56.6	-49.2	173.2	160	-104.5	0	0	0	112.2	V592 G593 A598 V599 C600 F637 N640 V641 L644 W665	V592-Y596 WeakPolarHBondContact O-CB 3.26Å; V592-Y596 PolarHBondContact O-N 2.89Å; G593-Y596 PolarHBondContact O-N 3.48Å; Y596-A598 VanDerWaalsContact C-N 3.34Å; Y596-A598 PolarHBondContact O-N 3.02Å; Y596-V599 PolarHBondContact O-N 2.73Å; Y596-C600 WeakPolarHBondContact CE2-SG 3.41Å; Y596-C600 PolarHBondContact O-N 2.68Å; Y596-C600 PolarHBondContact O-SG 2.87Å; Y596-F637 HydrophobicContact CE1-CD1 4.15Å; Y596-F637 AromaticContact CZ-CD1 3.78Å; Y596-F637 WeakPolarHBondContact OH-CB 3.46Å; Y596-F637 VanDerWaalsContact OH-CD1 3.27Å; Y596-F637 WeakPolarHBondContact OH-CD1 3.16Å; Y596-F637 PolarHBondContact OH-O 3.1Å; Y596-N640 HydrophobicContact CD2-CB 4.28Å; Y596-N640 HydrophobicContact CE2-CB 4.07Å; Y596-V641 HydrophobicContact CE2-CG2 3.54Å; Y596-V641 VanDerWaalsContact OH-CG2 3.27Å; Y596-V641 WeakPolarHBondContact OH-CG2 3.4Å; Y596-L644 HydrophobicContact CD2-CD1 4.05Å; Y596-L644 HydrophobicContact CG-CD1 4.44Å; Y596-W665 HydrophobicContact CD2-CH2 4.31Å; Y596-W665 HydrophobicContact CD2-CZ2 4.05Å
597	L	93.7	Very high	92.7	Very high	81 Å²	81	61.2 Å²	61.2	42%	0.424	32%	0.322	S	S	.	.	H	α-helix	trans	-60.2	-43.3	178.4	-68.6	174.5	0	0	0	111.8	G593 F594 T595 C600 L601 F637	G593-L597 WeakPolarHBondContact O-CG 3.42Å; G593-L597 PolarHBondContact O-N 2.89Å; G593-L597 VanDerWaalsContact O-N 3.13Å; F594-L597 PolarHBondContact O-N 3.41Å; T595-L597 PolarHBondContact O-N 2.86Å; L597-C600 PolarHBondContact O-N 2.73Å; L597-L601 WeakPolarHBondContact O-CG 3.45Å; L597-L601 PolarHBondContact O-N 3.02Å; L597-F637 HydrophobicContact CD2-CE1 3.77Å; L597-F637 HydrophobicContact CD2-CZ 4.32Å
598	A	93.8	Very high	92.4	Very high	50 Å²	50	60.5 Å²	60.5	41%	0.413	31%	0.314	S	S	.	.	H	α-helix	trans	-62.4	-46.4	177.6	0	0	0	0	0	112.3	F594 T595 Y596 C600 L601 C602	F594-A598 PolarHBondContact O-N 3.01Å; T595-A598 PolarHBondContact O-N 3.06Å; Y596-A598 VanDerWaalsContact C-N 3.34Å; Y596-A598 PolarHBondContact O-N 3.02Å; A598-C600 VanDerWaalsContact C-N 3.33Å; A598-C600 PolarHBondContact O-N 3.34Å; A598-L601 PolarHBondContact O-N 3.42Å; A598-C602 PolarHBondContact O-N 3.18Å; A598-C602 PolarHBondContact O-SG 2.94Å; A598-C602 VanDerWaalsContact O-SG 3.35Å
599	V	92.7	Very high	92.1	Very high	25 Å²	25	64.6 Å²	64.6	15%	0.152	33%	0.334	C	S	.	.	H	α-helix	trans	-66.1	-34.7	179.7	173.9	0	0	0	0	111.9	T595 Y596 L601 C602 L603 W665	T595-V599 HydrophobicContact CG2-CG2 4.48Å; T595-V599 WeakPolarHBondContact O-CG2 3.42Å; T595-V599 PolarHBondContact O-N 3.49Å; Y596-V599 PolarHBondContact O-N 2.73Å; V599-L601 PolarHBondContact O-N 3.35Å; V599-C602 PolarHBondContact O-N 3.36Å; V599-L603 WeakPolarHBondContact O-CB 3.21Å; V599-L603 PolarHBondContact O-N 3.5Å; V599-W665 HydrophobicContact CB-CD2 4.33Å; V599-W665 HydrophobicContact CB-CE3 3.9Å; V599-W665 HydrophobicContact CB-CZ3 4.14Å; V599-W665 HydrophobicContact CG1-CB 4Å; V599-W665 HydrophobicContact CG1-CD2 3.73Å; V599-W665 HydrophobicContact CG1-CE3 3.73Å; V599-W665 HydrophobicContact CG1-CG 3.86Å; V599-W665 HydrophobicContact CG1-CZ3 4.42Å; V599-W665 HydrophobicContact CG2-CE3 3.71Å; V599-W665 HydrophobicContact CG2-CZ3 3.94Å
600	C	93	Very high	91.8	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.1	-41.5	174.4	-66.3	0	0	0	0	112.7	Y596 L597 A598 F604 F637 N640	Y596-C600 WeakPolarHBondContact CE2-SG 3.41Å; Y596-C600 PolarHBondContact O-N 2.68Å; Y596-C600 PolarHBondContact O-SG 2.87Å; L597-C600 PolarHBondContact O-N 2.73Å; A598-C600 VanDerWaalsContact C-N 3.33Å; A598-C600 PolarHBondContact O-N 3.34Å; C600-F604 WeakPolarHBondContact O-CB 3.46Å; C600-F604 PolarHBondContact O-N 2.99Å; C600-F637 HydrophobicContact CB-CD1 3.46Å; C600-F637 VanDerWaalsContact CB-CD1 3.46Å; C600-F637 HydrophobicContact CB-CE1 3.57Å; C600-F637 HydrophobicContact CB-CG 4.4Å; C600-F637 VanDerWaalsContact SG-CD1 3.52Å; C600-N640 VanDerWaalsContact SG-CB 3.52Å
601	L	92.2	Very high	91.1	Very high	93 Å²	93	59.2 Å²	59.2	49%	0.487	32%	0.319	S	S	.	.	H	α-helix	trans	-66.3	-45	174.5	-68.3	168.2	0	0	0	111.2	L597 A598 V599 L603 F604 V605 L633	L597-L601 WeakPolarHBondContact O-CG 3.45Å; L597-L601 PolarHBondContact O-N 3.02Å; A598-L601 PolarHBondContact O-N 3.42Å; V599-L601 PolarHBondContact O-N 3.35Å; L601-L603 PolarHBondContact O-N 3.03Å; L601-F604 PolarHBondContact O-N 2.76Å; L601-V605 WeakPolarHBondContact O-CG2 3.25Å; L601-V605 PolarHBondContact O-N 3.29Å; L601-L633 HydrophobicContact CD2-CD1 3.96Å
602	C	92.1	Very high	90.4	Very high	70 Å²	70	58.7 Å²	58.7	47%	0.473	32%	0.322	S	S	.	.	H	α-helix	trans	-60	-42.5	176	-70.7	0	0	0	0	112.4	A598 V599 V605 A606 L661	A598-C602 PolarHBondContact O-N 3.18Å; A598-C602 PolarHBondContact O-SG 2.94Å; A598-C602 VanDerWaalsContact O-SG 3.35Å; V599-C602 PolarHBondContact O-N 3.36Å; C602-V605 PolarHBondContact O-N 3.13Å; C602-A606 WeakPolarHBondContact O-CB 3.42Å; C602-A606 PolarHBondContact O-N 3.2Å; C602-L661 HydrophobicContact CB-CD2 3.96Å
603	L	91.3	Very high	90.1	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-68	-42.1	178.2	-175.6	64.1	0	0	0	111.8	V599 L601 A606 A607 F631 Y639 N640 T658 L661 T662	V599-L603 WeakPolarHBondContact O-CB 3.21Å; V599-L603 PolarHBondContact O-N 3.5Å; L601-L603 PolarHBondContact O-N 3.03Å; L603-A606 PolarHBondContact O-N 3.14Å; L603-A607 WeakPolarHBondContact O-CB 3.45Å; L603-A607 PolarHBondContact O-N 3.43Å; L603-F631 HydrophobicContact CD2-CD1 4.27Å; L603-F631 HydrophobicContact CD2-CE1 4.06Å; L603-Y639 HydrophobicContact CD2-CD1 3.54Å; L603-Y639 HydrophobicContact CD2-CE1 4.04Å; L603-Y639 HydrophobicContact CD2-CG 4.3Å; L603-N640 WeakPolarHBondContact CD2-ND2 3.37Å; L603-T658 HydrophobicContact CD1-CG2 4.22Å; L603-L661 HydrophobicContact CB-CD2 4.01Å; L603-L661 HydrophobicContact CD1-CD2 4.16Å; L603-T662 HydrophobicContact CD1-CG2 3.71Å; L603-T662 HydrophobicContact CD2-CG2 4.16Å
604	F	91.4	Very high	89.6	Confident	59 Å²	59	60.5 Å²	60.5	26%	0.259	32%	0.317	S	S	.	.	H	α-helix	trans	-58.8	-46.8	174.5	173.1	-108.9	0	0	0	111.6	C600 L601 R608 L633	C600-F604 WeakPolarHBondContact O-CB 3.46Å; C600-F604 PolarHBondContact O-N 2.99Å; L601-F604 PolarHBondContact O-N 2.76Å; F604-R608 HydrophobicContact CD2-CG 4.41Å; F604-R608 HydrophobicContact CE2-CG 4.13Å; F604-R608 HydrophobicContact CZ-CG 4.32Å; F604-R608 WeakPolarHBondContact O-CB 3.28Å; F604-R608 WeakPolarHBondContact O-CG 3.34Å; F604-R608 PolarHBondContact O-N 3.1Å; F604-L633 HydrophobicContact CB-CD1 4.3Å; F604-L633 HydrophobicContact CD1-CD1 4.49Å; F604-L633 HydrophobicContact CD2-CB 4.21Å; F604-L633 HydrophobicContact CE2-CB 4.35Å; F604-L633 HydrophobicContact CG-CB 4.43Å; F604-L633 HydrophobicContact CG-CD1 4.31Å
605	V	90.8	Very high	88.7	Confident	77 Å²	77	56.6 Å²	56.6	47%	0.467	31%	0.305	S	S	.	.	H	α-helix	trans	-66.1	-48.3	177.6	172.3	0	0	0	0	111.4	L601 C602 A607 R608 L609	L601-V605 WeakPolarHBondContact O-CG2 3.25Å; L601-V605 PolarHBondContact O-N 3.29Å; C602-V605 PolarHBondContact O-N 3.13Å; V605-A607 PolarHBondContact O-N 3.15Å; V605-R608 PolarHBondContact O-N 2.79Å; V605-L609 HydrophobicContact CG1-CD1 3.78Å; V605-L609 HydrophobicContact CG1-CG 4.41Å; V605-L609 WeakPolarHBondContact O-CG 3.39Å; V605-L609 PolarHBondContact O-N 2.79Å
606	A	90.5	Very high	87.6	Confident	23 Å²	23	56.4 Å²	56.4	19%	0.19	31%	0.308	C	S	.	.	H	α-helix	trans	-59.9	-45.9	-179.6	0	0	0	0	0	112.1	C602 L603 R608 L609 S610 T658 L661	C602-A606 WeakPolarHBondContact O-CB 3.42Å; C602-A606 PolarHBondContact O-N 3.2Å; L603-A606 PolarHBondContact O-N 3.14Å; A606-R608 VanDerWaalsContact C-N 3.3Å; A606-R608 PolarHBondContact O-N 3.13Å; A606-L609 PolarHBondContact O-N 3.18Å; A606-S610 WeakPolarHBondContact O-CB 3.04Å; A606-S610 PolarHBondContact O-N 2.87Å; A606-S610 PolarHBondContact O-OG 3.39Å; A606-S610 VanDerWaalsContact O-OG 3.08Å; A606-T658 HydrophobicContact CB-CG2 4.43Å; A606-L661 HydrophobicContact CB-CD2 4.25Å
607	A	88.3	Confident	86.4	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-32.4	178.7	0	0	0	0	0	112.9	L603 V605 S610 E613 N629 F631 T658	L603-A607 WeakPolarHBondContact O-CB 3.45Å; L603-A607 PolarHBondContact O-N 3.43Å; V605-A607 PolarHBondContact O-N 3.15Å; A607-S610 PolarHBondContact O-OG 3.25Å; A607-E613 HydrophobicContact CB-CG 4.22Å; A607-N629 PolarHBondContact O-ND2 2.95Å; A607-F631 HydrophobicContact CB-CB 3.68Å; A607-F631 HydrophobicContact CB-CD2 3.61Å; A607-F631 HydrophobicContact CB-CG 3.9Å; A607-T658 HydrophobicContact CB-CG2 3.79Å
608	R	88.5	Confident	85.1	Confident	95 Å²	95	55.6 Å²	55.6	36%	0.358	31%	0.307	S	S	.	.	H	α-helix	trans	-70.3	-41.2	175.3	-71.9	-76.3	161.3	157.9	-5.5	112.1	F604 V605 A606 W614 F631	F604-R608 HydrophobicContact CD2-CG 4.41Å; F604-R608 HydrophobicContact CE2-CG 4.13Å; F604-R608 HydrophobicContact CZ-CG 4.32Å; F604-R608 WeakPolarHBondContact O-CB 3.28Å; F604-R608 WeakPolarHBondContact O-CG 3.34Å; F604-R608 PolarHBondContact O-N 3.1Å; V605-R608 PolarHBondContact O-N 2.79Å; A606-R608 VanDerWaalsContact C-N 3.3Å; A606-R608 PolarHBondContact O-N 3.13Å; R608-W614 PolarHBondContact O-NE1 2.94Å; R608-W614 VanDerWaalsContact O-NE1 3.12Å; R608-F631 PolarHBondContact NE-O 3.01Å; R608-F631 PolarHBondContact NH2-O 3.31Å; R608-F631 VanDerWaalsContact NH2-O 3.11Å
609	L	86.5	Confident	83.8	Confident	137 Å²	137	59 Å²	59	72%	0.717	33%	0.325	S	S	*	.	H	α-helix	trans	-73.7	-33	-179.9	-67.9	172.7	0	0	0	113.3	V605 A606 P611	V605-L609 HydrophobicContact CG1-CD1 3.78Å; V605-L609 HydrophobicContact CG1-CG 4.41Å; V605-L609 WeakPolarHBondContact O-CG 3.39Å; V605-L609 PolarHBondContact O-N 2.79Å; A606-L609 PolarHBondContact O-N 3.18Å; L609-P611 VanDerWaalsContact O-CD 3.31Å; L609-P611 WeakPolarHBondContact O-CD 3.35Å
610	S	86.5	Confident	82.7	Confident	9 Å²	9	63.3 Å²	63.3	6%	0.063	36%	0.355	C	S	.	.			trans	-76.5	116.6	-176.6	57.3	0	0	0	0	112.7	A606 A607 H612 E613 S657	A606-S610 WeakPolarHBondContact O-CB 3.04Å; A606-S610 PolarHBondContact O-N 2.87Å; A606-S610 PolarHBondContact O-OG 3.39Å; A606-S610 VanDerWaalsContact O-OG 3.08Å; A607-S610 PolarHBondContact O-OG 3.25Å; S610-H612 PolarHBondContact O-N 3.1Å; S610-H612 VanDerWaalsContact O-N 3.14Å; S610-E613 PolarHBondContact O-N 2.99Å; S610-E613 VanDerWaalsContact OG-CG 3.28Å; S610-E613 WeakPolarHBondContact OG-CG 3.19Å; S610-S657 WeakPolarHBondContact CB-OG 3.49Å
611	P	80.6	Confident	81.4	Confident	89 Å²	89	66.3 Å²	66.3	58%	0.578	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-61.9	-26.9	-176.6	-25.5	36.2	0	0	0	114.4	L609 E613 W614	L609-P611 VanDerWaalsContact O-CD 3.31Å; L609-P611 WeakPolarHBondContact O-CD 3.35Å; P611-E613 VanDerWaalsContact C-N 3.34Å; P611-E613 PolarHBondContact O-N 2.81Å; P611-W614 PolarHBondContact O-N 3.1Å
612	H	80.6	Confident	79.8	Confident	145 Å²	145	70.8 Å²	70.8	67%	0.671	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-77.9	-7.5	-176.2	-57.2	-70.9	0	0	0	115	S610 H654 A655	S610-H612 PolarHBondContact O-N 3.1Å; S610-H612 VanDerWaalsContact O-N 3.14Å; H612-H654 VanDerWaalsContact O-CB 3.28Å; H612-H654 WeakPolarHBondContact O-CB 3.14Å; H612-A655 HydrophobicContact CB-CB 3.95Å
613	E	85	Confident	78.4	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-83.7	-9.4	170.6	-72.6	-64.2	160.7	0	0	113.6	A607 S610 P611 T615 Q630 P653 H654 A655 T658	A607-E613 HydrophobicContact CB-CG 4.22Å; S610-E613 PolarHBondContact O-N 2.99Å; S610-E613 VanDerWaalsContact OG-CG 3.28Å; S610-E613 WeakPolarHBondContact OG-CG 3.19Å; P611-E613 VanDerWaalsContact C-N 3.34Å; P611-E613 PolarHBondContact O-N 2.81Å; E613-T615 PolarHBondContact O-N 2.76Å; E613-Q630 PolarHBondContact OE2-NE2 2.93Å; E613-P653 VanDerWaalsContact OE1-CA 3.29Å; E613-P653 WeakPolarHBondContact OE1-CA 3.48Å; E613-P653 WeakPolarHBondContact OE1-CB 3.32Å; E613-H654 VanDerWaalsContact CD-N 3.34Å; E613-H654 PolarHBondContact OE1-N 2.98Å; E613-H654 IonicContact OE2-CD2 2.76Å; E613-H654 PolarHBondContact OE2-N 2.9Å; E613-A655 HydrophobicContact CG-CB 3.95Å; E613-A655 PolarHBondContact OE1-N 3.43Å; E613-T658 HydrophobicContact CG-CG2 3.93Å; E613-T658 WeakPolarHBondContact OE1-CB 3.44Å; E613-T658 PolarHBondContact OE1-OG1 3.07Å
614	W	83.5	Confident	77.1	Confident	86 Å²	86	72 Å²	72	33%	0.326	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	87.5	-174.7	-69.1	86.7	0	0	0	110.5	R608 P611 R627 N629	R608-W614 PolarHBondContact O-NE1 2.94Å; R608-W614 VanDerWaalsContact O-NE1 3.12Å; P611-W614 PolarHBondContact O-N 3.1Å; W614-R627 HydrophobicContact CB-CB 4.05Å; W614-R627 HydrophobicContact CE3-CB 4.27Å; W614-N629 HydrophobicContact CD2-CB 4.03Å; W614-N629 HydrophobicContact CE3-CB 3.97Å; W614-N629 HydrophobicContact CH2-CB 4.26Å; W614-N629 HydrophobicContact CZ2-CB 4.29Å; W614-N629 HydrophobicContact CZ3-CB 4.09Å; W614-N629 PolarHBondContact NE1-ND2 2.7Å
615	T	75.4	Confident	75.8	Confident	56 Å²	56	77.1 Å²	77.1	34%	0.344	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	154	-175.7	54.2	0	0	0	0	112.8	E613 R627 K628	E613-T615 PolarHBondContact O-N 2.76Å; T615-R627 CarbonylContact O-C 3.5Å; T615-R627 VanDerWaalsContact O-CA 3.26Å; T615-R627 WeakPolarHBondContact O-CA 3.38Å; T615-K628 PolarHBondContact N-O 2.93Å; T615-K628 PolarHBondContact O-N 3.18Å
616	A	70	Confident	74.6	Confident	46 Å²	46	77.7 Å²	77.7	38%	0.38	45%	0.445	S	S	.	.			trans	-72.1	148.1	177.3	0	0	0	0	0	111.7	H618	A616-H618 VanDerWaalsContact C-N 3.31Å; A616-H618 PolarHBondContact O-N 2.83Å
617	T	68.9	Low	73.5	Confident	42 Å²	42	84 Å²	84	26%	0.258	46%	0.464	S	S	.	.	S	Bend	trans	-64.9	-26.2	-173.2	11.4	0	0	0	0	115.8	T626 K628	T617-T626 PolarHBondContact OG1-O 2.74Å; T617-T626 PolarHBondContact OG1-OG1 3.02Å; T617-K628 HydrophobicContact CG2-CD 3.56Å; T617-K628 HydrophobicContact CG2-CG 3.96Å
618	H	65.8	Low	73	Confident	66 Å²	66	90.6 Å²	90.6	31%	0.306	49%	0.493	S	S	.	.	S	Bend	trans	-140.9	137.6	-179.3	-104.3	-78.3	0	0	0	109.7	A616 C620 E621 I909	A616-H618 VanDerWaalsContact C-N 3.31Å; A616-H618 PolarHBondContact O-N 2.83Å; H618-C620 PolarHBondContact O-N 2.87Å; H618-E621 HydrophobicContact CB-CB 3.95Å; H618-E621 PolarHBondContact O-N 2.78Å; H618-I909 PolarHBondContact CE1-O 3.13Å; H618-I909 VanDerWaalsContact CE1-O 3.31Å
619	P	67.3	Low	72.7	Confident	122 Å²	122	86.9 Å²	86.9	79%	0.792	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-9.5	176.7	-25.2	35	0	0	0	115.5
620	C	69.3	Low	72.7	Confident	115 Å²	115	82.1 Å²	82.1	78%	0.777	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	3.1	179.6	-51.2	0	0	0	0	113.1	H618	H618-C620 PolarHBondContact O-N 2.87Å
621	E	64.1	Low	72.6	Confident	62 Å²	62	81.7 Å²	81.7	29%	0.29	45%	0.451	S	S	.	.			trans	-129.7	51.6	-167	-159.1	172.7	-138.6	0	0	110.4	H618 G623 G624	H618-E621 HydrophobicContact CB-CB 3.95Å; H618-E621 PolarHBondContact O-N 2.78Å; E621-G623 PolarHBondContact O-N 2.89Å; E621-G624 PolarHBondContact O-N 2.87Å
622	E	60.2	Low	72.9	Confident	187 Å²	187	80.1 Å²	80.1	87%	0.874	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-20.7	-172.8	-60.2	-175.1	140.2	0	0	114.7
623	G	62.4	Low	73.3	Confident	77 Å²	77	76.4 Å²	76.4	79%	0.794	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	10.2	178.2	0	0	0	0	0	115.6	E621	E621-G623 PolarHBondContact O-N 2.89Å
624	G	63.1	Low	73.5	Confident	19 Å²	19	82.5 Å²	82.5	20%	0.196	46%	0.456	C	S	.	.			trans	-73.1	126.3	-179.8	0	0	0	0	0	113.4	E621 T626	E621-G624 PolarHBondContact O-N 2.87Å; G624-T626 PolarHBondContact O-N 2.62Å; G624-T626 VanDerWaalsContact O-N 3.17Å
625	D	64	Low	73.8	Confident	167 Å²	167	80.6 Å²	80.6	89%	0.893	45%	0.453	S	S	*	.	S	Bend	trans	-58.8	-26	176.6	-73.2	-41.6	0	0	0	113.5	R627	D625-R627 VanDerWaalsContact C-N 3.27Å; D625-R627 PolarHBondContact O-N 3.21Å
626	T	66.4	Low	74.5	Confident	88 Å²	88	78 Å²	78	54%	0.54	44%	0.436	S	S	.	.			trans	-78.4	66.7	-175.8	53.2	0	0	0	0	113.1	T617 G624	T617-T626 PolarHBondContact OG1-O 2.74Å; T617-T626 PolarHBondContact OG1-OG1 3.02Å; G624-T626 PolarHBondContact O-N 2.62Å; G624-T626 VanDerWaalsContact O-N 3.17Å
627	R	67	Low	75.6	Confident	157 Å²	157	78.6 Å²	78.6	59%	0.592	43%	0.431	S	S	*	.			trans	-65.9	133.1	168.8	-59.3	-176.4	-174.6	-171.7	2.9	110.7	W614 T615 D625	W614-R627 HydrophobicContact CB-CB 4.05Å; W614-R627 HydrophobicContact CE3-CB 4.27Å; T615-R627 CarbonylContact O-C 3.5Å; T615-R627 VanDerWaalsContact O-CA 3.26Å; T615-R627 WeakPolarHBondContact O-CA 3.38Å; D625-R627 VanDerWaalsContact C-N 3.27Å; D625-R627 PolarHBondContact O-N 3.21Å
628	K	76.9	Confident	76.6	Confident	138 Å²	138	83.4 Å²	83.4	60%	0.6	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.3	148.6	173	-75	-179.7	-178.3	169.6	0	110.2	T615 T617	T615-K628 PolarHBondContact N-O 2.93Å; T615-K628 PolarHBondContact O-N 3.18Å; T617-K628 HydrophobicContact CG2-CD 3.56Å; T617-K628 HydrophobicContact CG2-CG 3.96Å
629	N	83.9	Confident	77.7	Confident	16 Å²	16	80.6 Å²	80.6	9%	0.086	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	121.7	171.6	-169.4	-51	0	0	0	108	A607 W614 F631	A607-N629 PolarHBondContact O-ND2 2.95Å; W614-N629 HydrophobicContact CD2-CB 4.03Å; W614-N629 HydrophobicContact CE3-CB 3.97Å; W614-N629 HydrophobicContact CH2-CB 4.26Å; W614-N629 HydrophobicContact CZ2-CB 4.29Å; W614-N629 HydrophobicContact CZ3-CB 4.09Å; W614-N629 PolarHBondContact NE1-ND2 2.7Å; N629-F631 PolarHBondContact O-N 3.5Å; N629-F631 PolarHBondContact OD1-N 2.69Å
630	Q	85.5	Confident	78.8	Confident	37 Å²	37	74.9 Å²	74.9	17%	0.173	40%	0.395	C	S	.	.	S	Bend	trans	-66.1	-23.5	-177.1	65.6	-176.5	-37.5	0	0	113.1	E613 T632 N635 L651 A652 H654	E613-Q630 PolarHBondContact OE2-NE2 2.93Å; Q630-T632 PolarHBondContact O-N 3.45Å; Q630-N635 WeakPolarHBondContact O-CB 3.34Å; Q630-N635 PolarHBondContact O-ND2 3.26Å; Q630-L651 HydrophobicContact CB-CD2 3.89Å; Q630-L651 HydrophobicContact CG-CD2 4.38Å; Q630-A652 PolarHBondContact NE2-O 3.15Å; Q630-A652 VanDerWaalsContact OE1-N 3.16Å; Q630-H654 PolarHBondContact NE2-CD2 3.16Å
631	F	85	Confident	79.9	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	37%	0.372	C	S	.	.			trans	-91.3	90.4	179.6	-63.7	-72.7	0	0	0	111	L603 A607 R608 N629 Y639 P653	L603-F631 HydrophobicContact CD2-CD1 4.27Å; L603-F631 HydrophobicContact CD2-CE1 4.06Å; A607-F631 HydrophobicContact CB-CB 3.68Å; A607-F631 HydrophobicContact CB-CD2 3.61Å; A607-F631 HydrophobicContact CB-CG 3.9Å; R608-F631 PolarHBondContact NE-O 3.01Å; R608-F631 PolarHBondContact NH2-O 3.31Å; R608-F631 VanDerWaalsContact NH2-O 3.11Å; N629-F631 PolarHBondContact O-N 3.5Å; N629-F631 PolarHBondContact OD1-N 2.69Å; F631-Y639 HydrophobicContact CE1-CD1 4.38Å; F631-Y639 AromaticContact CE1-CD2 3.93Å; F631-Y639 HydrophobicContact CE1-CD2 3.93Å; F631-Y639 AromaticContact CE1-CG 3.86Å; F631-Y639 HydrophobicContact CE1-CG 3.86Å; F631-Y639 HydrophobicContact CZ-CD2 4.3Å; F631-Y639 HydrophobicContact CZ-CE2 4.47Å; F631-P653 HydrophobicContact CE2-CB 4.34Å; F631-P653 HydrophobicContact CZ-CB 4.4Å
632	T	87	Confident	81.1	Confident	56 Å²	56	69.3 Å²	69.3	34%	0.344	36%	0.362	S	S	.	.			trans	-78.3	163.4	152.8	72.2	0	0	0	0	109.1	Q630 L634 N635 S636	Q630-T632 PolarHBondContact O-N 3.45Å; T632-L634 VanDerWaalsContact C-N 3.25Å; T632-L634 PolarHBondContact O-N 3.38Å; T632-N635 CarbonylContact O-C 3.58Å; T632-N635 PolarHBondContact O-N 2.75Å; T632-N635 VanDerWaalsContact O-N 3.11Å; T632-N635 WeakPolarHBondContact OG1-CB 3.37Å; T632-N635 PolarHBondContact OG1-N 3.4Å; T632-N635 PolarHBondContact OG1-OD1 3.03Å; T632-S636 PolarHBondContact O-N 2.87Å; T632-S636 PolarHBondContact O-OG 3.46Å
633	L	88.1	Confident	82.4	Confident	67 Å²	67	61 Å²	61	35%	0.351	33%	0.325	S	S	.	.	H	α-helix	trans	-57.5	-38.9	176.7	-179.8	62.4	0	0	0	112.3	L601 F604 S636 F637	L601-L633 HydrophobicContact CD2-CD1 3.96Å; F604-L633 HydrophobicContact CB-CD1 4.3Å; F604-L633 HydrophobicContact CD1-CD1 4.49Å; F604-L633 HydrophobicContact CD2-CB 4.21Å; F604-L633 HydrophobicContact CE2-CB 4.35Å; F604-L633 HydrophobicContact CG-CB 4.43Å; F604-L633 HydrophobicContact CG-CD1 4.31Å; L633-S636 PolarHBondContact O-N 3.31Å; L633-F637 HydrophobicContact CD1-CE2 3.95Å; L633-F637 HydrophobicContact CD1-CZ 4.1Å; L633-F637 HydrophobicContact CD2-CE2 4.17Å; L633-F637 HydrophobicContact CG-CD2 4.19Å; L633-F637 HydrophobicContact CG-CE2 3.69Å; L633-F637 HydrophobicContact CG-CZ 4.3Å; L633-F637 VanDerWaalsContact O-CD2 3.25Å; L633-F637 WeakPolarHBondContact O-CD2 3.44Å; L633-F637 PolarHBondContact O-N 3.37Å
634	L	89.9	Confident	83.6	Confident	128 Å²	128	59.6 Å²	59.6	67%	0.67	30%	0.299	S	S	*	.	H	α-helix	trans	-68.4	-39.1	176.1	-171.5	147.8	0	0	0	112	T632 S636 F637 Y638	T632-L634 VanDerWaalsContact C-N 3.25Å; T632-L634 PolarHBondContact O-N 3.38Å; L634-S636 VanDerWaalsContact C-N 3.32Å; L634-F637 PolarHBondContact O-N 3.31Å; L634-Y638 WeakPolarHBondContact O-CB 3.21Å; L634-Y638 PolarHBondContact O-N 3.43Å
635	N	90	Very high	84.9	Confident	47 Å²	47	63.4 Å²	63.4	25%	0.251	32%	0.315	S	S	.	.	H	α-helix	trans	-68.6	-32.3	174.7	-66.7	11.3	0	0	0	111.5	Q630 T632 Y638 Y639 L651	Q630-N635 WeakPolarHBondContact O-CB 3.34Å; Q630-N635 PolarHBondContact O-ND2 3.26Å; T632-N635 CarbonylContact O-C 3.58Å; T632-N635 PolarHBondContact O-N 2.75Å; T632-N635 VanDerWaalsContact O-N 3.11Å; T632-N635 WeakPolarHBondContact OG1-CB 3.37Å; T632-N635 PolarHBondContact OG1-N 3.4Å; T632-N635 PolarHBondContact OG1-OD1 3.03Å; N635-Y638 PolarHBondContact O-N 3.02Å; N635-Y639 WeakPolarHBondContact O-CB 3.44Å; N635-Y639 PolarHBondContact O-N 3.33Å; N635-L651 HydrophobicContact CB-CD1 3.91Å
636	S	89.9	Confident	86	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-67.6	-39.4	171.6	-63.3	0	0	0	0	112	T632 L633 L634 N640	T632-S636 PolarHBondContact O-N 2.87Å; T632-S636 PolarHBondContact O-OG 3.46Å; L633-S636 PolarHBondContact O-N 3.31Å; L634-S636 VanDerWaalsContact C-N 3.32Å; S636-N640 WeakPolarHBondContact O-CB 3.18Å; S636-N640 PolarHBondContact O-N 3.17Å; S636-N640 VanDerWaalsContact O-N 3.14Å; S636-N640 PolarHBondContact O-ND2 3.21Å
637	F	91.9	Very high	87	Confident	59 Å²	59	63.1 Å²	63.1	26%	0.259	31%	0.306	S	S	.	.	H	α-helix	trans	-60.6	-52.6	169.6	-73.5	-50.2	0	0	0	111.1	Y596 L597 C600 L633 L634 Y639 N640 V641	Y596-F637 HydrophobicContact CE1-CD1 4.15Å; Y596-F637 AromaticContact CZ-CD1 3.78Å; Y596-F637 WeakPolarHBondContact OH-CB 3.46Å; Y596-F637 VanDerWaalsContact OH-CD1 3.27Å; Y596-F637 WeakPolarHBondContact OH-CD1 3.16Å; Y596-F637 PolarHBondContact OH-O 3.1Å; L597-F637 HydrophobicContact CD2-CE1 3.77Å; L597-F637 HydrophobicContact CD2-CZ 4.32Å; C600-F637 HydrophobicContact CB-CD1 3.46Å; C600-F637 VanDerWaalsContact CB-CD1 3.46Å; C600-F637 HydrophobicContact CB-CE1 3.57Å; C600-F637 HydrophobicContact CB-CG 4.4Å; C600-F637 VanDerWaalsContact SG-CD1 3.52Å; L633-F637 HydrophobicContact CD1-CE2 3.95Å; L633-F637 HydrophobicContact CD1-CZ 4.1Å; L633-F637 HydrophobicContact CD2-CE2 4.17Å; L633-F637 HydrophobicContact CG-CD2 4.19Å; L633-F637 HydrophobicContact CG-CE2 3.69Å; L633-F637 HydrophobicContact CG-CZ 4.3Å; L633-F637 VanDerWaalsContact O-CD2 3.25Å; L633-F637 WeakPolarHBondContact O-CD2 3.44Å; L633-F637 PolarHBondContact O-N 3.37Å; L634-F637 PolarHBondContact O-N 3.31Å; F637-Y639 PolarHBondContact O-N 3.33Å; F637-N640 PolarHBondContact O-N 2.83Å; F637-V641 WeakPolarHBondContact O-CG2 3.13Å; F637-V641 PolarHBondContact O-N 3.25Å
638	Y	90	Very high	87.8	Confident	143 Å²	143	59.3 Å²	59.3	56%	0.561	32%	0.315	S	S	*	.	H	α-helix	trans	-58.1	-46	-179.8	-178.7	-114.4	0	0	0	113.2	L634 N635 V641 S642 T649 L651	L634-Y638 WeakPolarHBondContact O-CB 3.21Å; L634-Y638 PolarHBondContact O-N 3.43Å; N635-Y638 PolarHBondContact O-N 3.02Å; Y638-V641 PolarHBondContact O-N 2.87Å; Y638-S642 PolarHBondContact O-N 3.09Å; Y638-T649 HydrophobicContact CD1-CG2 4.03Å; Y638-T649 HydrophobicContact CE1-CG2 3.63Å; Y638-L651 HydrophobicContact CD1-CD1 4.1Å
639	Y	90.4	Very high	88.3	Confident	8 Å²	8	54.2 Å²	54.2	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-60.9	-45.7	177.3	-179.5	-85.6	0	0	0	112.6	L603 F631 N635 F637 S642 T649 L651 T662	L603-Y639 HydrophobicContact CD2-CD1 3.54Å; L603-Y639 HydrophobicContact CD2-CE1 4.04Å; L603-Y639 HydrophobicContact CD2-CG 4.3Å; F631-Y639 HydrophobicContact CE1-CD1 4.38Å; F631-Y639 AromaticContact CE1-CD2 3.93Å; F631-Y639 HydrophobicContact CE1-CD2 3.93Å; F631-Y639 AromaticContact CE1-CG 3.86Å; F631-Y639 HydrophobicContact CE1-CG 3.86Å; F631-Y639 HydrophobicContact CZ-CD2 4.3Å; F631-Y639 HydrophobicContact CZ-CE2 4.47Å; N635-Y639 WeakPolarHBondContact O-CB 3.44Å; N635-Y639 PolarHBondContact O-N 3.33Å; F637-Y639 PolarHBondContact O-N 3.33Å; Y639-S642 PolarHBondContact O-N 2.87Å; Y639-S642 PolarHBondContact O-OG 2.88Å; Y639-T649 WeakPolarHBondContact CD2-OG1 3.46Å; Y639-L651 HydrophobicContact CD2-CB 4.02Å; Y639-L651 WeakPolarHBondContact CE2-O 3.32Å; Y639-T662 HydrophobicContact CD1-CG2 4.36Å; Y639-T662 HydrophobicContact CE1-CG2 3.36Å
640	N	90.4	Very high	88.3	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-74.9	-28.8	-178.8	-70.8	-62.1	0	0	0	112.4	Y596 C600 L603 S636 F637 W665	Y596-N640 HydrophobicContact CD2-CB 4.28Å; Y596-N640 HydrophobicContact CE2-CB 4.07Å; C600-N640 VanDerWaalsContact SG-CB 3.52Å; L603-N640 WeakPolarHBondContact CD2-ND2 3.37Å; S636-N640 WeakPolarHBondContact O-CB 3.18Å; S636-N640 PolarHBondContact O-N 3.17Å; S636-N640 VanDerWaalsContact O-N 3.14Å; S636-N640 PolarHBondContact O-ND2 3.21Å; F637-N640 PolarHBondContact O-N 2.83Å; N640-W665 HydrophobicContact CB-CZ2 4.2Å; N640-W665 PolarHBondContact O-NE1 3.13Å; N640-W665 PolarHBondContact OD1-NE1 2.88Å
641	V	90.9	Very high	88.3	Confident	50 Å²	50	62.9 Å²	62.9	30%	0.303	34%	0.337	S	S	.	.	H	α-helix	trans	-63.1	-40.5	168.7	168	0	0	0	0	111.2	Y596 F637 Y638 A643 L644 L645	Y596-V641 HydrophobicContact CE2-CG2 3.54Å; Y596-V641 VanDerWaalsContact OH-CG2 3.27Å; Y596-V641 WeakPolarHBondContact OH-CG2 3.4Å; F637-V641 WeakPolarHBondContact O-CG2 3.13Å; F637-V641 PolarHBondContact O-N 3.25Å; Y638-V641 PolarHBondContact O-N 2.87Å; V641-A643 VanDerWaalsContact C-N 3.26Å; V641-A643 PolarHBondContact O-N 3.39Å; V641-L644 WeakPolarHBondContact O-CA 3.46Å; V641-L644 WeakPolarHBondContact O-CB 3.46Å; V641-L644 PolarHBondContact O-N 2.78Å; V641-L645 HydrophobicContact CG1-CD1 3.65Å; V641-L645 HydrophobicContact CG1-CG 3.99Å; V641-L645 WeakPolarHBondContact O-CG 3.27Å; V641-L645 PolarHBondContact O-N 3.34Å
642	S	89.8	Confident	88.3	Confident	11 Å²	11	65.4 Å²	65.4	8%	0.077	36%	0.357	C	S	.	.	H	α-helix	trans	-59.6	-39.3	-176.9	97.7	0	0	0	0	111.7	Y638 Y639 L644 L645 N646 Q647	Y638-S642 PolarHBondContact O-N 3.09Å; Y639-S642 PolarHBondContact O-N 2.87Å; Y639-S642 PolarHBondContact O-OG 2.88Å; S642-L644 PolarHBondContact O-N 3.07Å; S642-L645 CarbonylContact O-C 3.57Å; S642-L645 PolarHBondContact O-N 2.63Å; S642-L645 VanDerWaalsContact O-N 3.08Å; S642-N646 PolarHBondContact O-N 2.95Å; S642-N646 VanDerWaalsContact O-N 3.08Å; S642-Q647 CarbonylContact C-O 3.6Å; S642-Q647 VanDerWaalsContact C-O 3.29Å; S642-Q647 WeakPolarHBondContact CB-O 3.43Å; S642-Q647 PolarHBondContact O-N 2.84Å; S642-Q647 VanDerWaalsContact O-O 3.14Å; S642-Q647 PolarHBondContact OG-O 2.97Å
643	A	87.6	Confident	88.4	Confident	13 Å²	13	63.4 Å²	63.4	11%	0.107	35%	0.345	C	S	.	.	H	α-helix	trans	-63.2	-36.7	173.7	0	0	0	0	0	113.2	V641 L645 N646 A669	V641-A643 VanDerWaalsContact C-N 3.26Å; V641-A643 PolarHBondContact O-N 3.39Å; A643-L645 VanDerWaalsContact C-N 3.27Å; A643-L645 PolarHBondContact O-N 3.44Å; A643-N646 PolarHBondContact O-N 2.81Å; A643-A669 HydrophobicContact CB-CB 4.45Å
644	L	88.3	Confident	88.2	Confident	46 Å²	46	64.1 Å²	64.1	24%	0.241	35%	0.347	C	S	.	.	H	α-helix	trans	-70.5	-22.3	172.8	-69.6	172.5	0	0	0	113.1	Y596 V641 S642 W665 A669 I673	Y596-L644 HydrophobicContact CD2-CD1 4.05Å; Y596-L644 HydrophobicContact CG-CD1 4.44Å; V641-L644 WeakPolarHBondContact O-CA 3.46Å; V641-L644 WeakPolarHBondContact O-CB 3.46Å; V641-L644 PolarHBondContact O-N 2.78Å; S642-L644 PolarHBondContact O-N 3.07Å; L644-W665 HydrophobicContact CD1-CH2 4.05Å; L644-W665 HydrophobicContact CD1-CZ2 3.69Å; L644-W665 HydrophobicContact CD2-CH2 4.2Å; L644-W665 HydrophobicContact CD2-CZ2 4.01Å; L644-W665 HydrophobicContact CG-CH2 4.24Å; L644-W665 HydrophobicContact CG-CZ2 3.65Å; L644-A669 HydrophobicContact CD2-CB 3.99Å; L644-I673 WeakPolarHBondContact O-CD1 3.43Å
645	L	89.3	Confident	88.2	Confident	100 Å²	100	58.1 Å²	58.1	52%	0.524	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	1.9	176.5	-63.5	179.9	0	0	0	113.6	V641 S642 A643 Q647	V641-L645 HydrophobicContact CG1-CD1 3.65Å; V641-L645 HydrophobicContact CG1-CG 3.99Å; V641-L645 WeakPolarHBondContact O-CG 3.27Å; V641-L645 PolarHBondContact O-N 3.34Å; S642-L645 CarbonylContact O-C 3.57Å; S642-L645 PolarHBondContact O-N 2.63Å; S642-L645 VanDerWaalsContact O-N 3.08Å; A643-L645 VanDerWaalsContact C-N 3.27Å; A643-L645 PolarHBondContact O-N 3.44Å; L645-Q647 HydrophobicContact CB-CB 4.45Å; L645-Q647 HydrophobicContact CB-CG 4.26Å; L645-Q647 PolarHBondContact O-N 2.9Å
646	N	87.1	Confident	88.1	Confident	125 Å²	125	61.4 Å²	61.4	67%	0.668	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	37.2	-168.8	-69.8	-38.4	0	0	0	113.7	S642 A643	S642-N646 PolarHBondContact O-N 2.95Å; S642-N646 VanDerWaalsContact O-N 3.08Å; A643-N646 PolarHBondContact O-N 2.81Å
647	Q	88.2	Confident	88.2	Confident	124 Å²	124	64.4 Å²	64.4	58%	0.579	36%	0.358	S	S	*	.			trans	-116.7	140.5	179.2	-69.6	175.8	31.1	0	0	111.2	S642 L645	S642-Q647 CarbonylContact C-O 3.6Å; S642-Q647 VanDerWaalsContact C-O 3.29Å; S642-Q647 WeakPolarHBondContact CB-O 3.43Å; S642-Q647 PolarHBondContact O-N 2.84Å; S642-Q647 VanDerWaalsContact O-O 3.14Å; S642-Q647 PolarHBondContact OG-O 2.97Å; L645-Q647 HydrophobicContact CB-CB 4.45Å; L645-Q647 HydrophobicContact CB-CG 4.26Å; L645-Q647 PolarHBondContact O-N 2.9Å
648	G	84.3	Confident	88.1	Confident	77 Å²	77	61.6 Å²	61.6	79%	0.794	35%	0.346	S	S	*	.			trans	-80.4	157.2	171.9	0	0	0	0	0	112.4
649	T	86.4	Confident	88.1	Confident	31 Å²	31	61.3 Å²	61.3	19%	0.19	34%	0.344	C	S	.	.			trans	-120.9	155.4	171.1	50.6	0	0	0	0	111	Y638 Y639 L651	Y638-T649 HydrophobicContact CD1-CG2 4.03Å; Y638-T649 HydrophobicContact CE1-CG2 3.63Å; Y639-T649 WeakPolarHBondContact CD2-OG1 3.46Å; T649-L651 PolarHBondContact O-N 2.99Å; T649-L651 PolarHBondContact OG1-O 3.32Å
650	E	85.1	Confident	88.2	Confident	206 Å²	206	66.8 Å²	66.8	96%	0.963	37%	0.373	S	S	*	.	S	Bend	trans	-66	-23.1	168.5	-59.7	-178.2	164.6	0	0	112.3	A652	E650-A652 PolarHBondContact O-N 3.16Å
651	L	84.5	Confident	88.3	Confident	29 Å²	29	68.9 Å²	68.9	15%	0.152	38%	0.384	C	S	.	.			trans	-66.1	123.6	167.9	-61.6	166.9	0	0	0	109.6	Q630 N635 Y638 Y639 T649	Q630-L651 HydrophobicContact CB-CD2 3.89Å; Q630-L651 HydrophobicContact CG-CD2 4.38Å; N635-L651 HydrophobicContact CB-CD1 3.91Å; Y638-L651 HydrophobicContact CD1-CD1 4.1Å; Y639-L651 HydrophobicContact CD2-CB 4.02Å; Y639-L651 WeakPolarHBondContact CE2-O 3.32Å; T649-L651 PolarHBondContact O-N 2.99Å; T649-L651 PolarHBondContact OG1-O 3.32Å
652	A	85.3	Confident	88.3	Confident	52 Å²	52	66.7 Å²	66.7	43%	0.43	37%	0.371	S	S	.	.			trans	-141.3	119.4	-176.6	0	0	0	0	0	111.2	Q630 E650 H654	Q630-A652 PolarHBondContact NE2-O 3.15Å; Q630-A652 VanDerWaalsContact OE1-N 3.16Å; E650-A652 PolarHBondContact O-N 3.16Å; A652-H654 PolarHBondContact O-N 3.44Å
653	P	88.6	Confident	88.3	Confident	15 Å²	15	67.8 Å²	67.8	10%	0.097	38%	0.384	C	S	.	.			trans	-63.2	131.3	-174.8	24.8	-33.7	0	0	0	112.3	E613 F631 T658 R659 T662	E613-P653 VanDerWaalsContact OE1-CA 3.29Å; E613-P653 WeakPolarHBondContact OE1-CA 3.48Å; E613-P653 WeakPolarHBondContact OE1-CB 3.32Å; F631-P653 HydrophobicContact CE2-CB 4.34Å; F631-P653 HydrophobicContact CZ-CB 4.4Å; P653-T658 WeakPolarHBondContact CB-OG1 3.1Å; P653-R659 HydrophobicContact CB-CG 4.06Å; P653-R659 HydrophobicContact CG-CG 3.98Å; P653-R659 PolarHBondContact O-NE 3.19Å; P653-R659 PolarHBondContact O-NH2 3.43Å; P653-R659 VanDerWaalsContact O-NH2 3.16Å; P653-T662 HydrophobicContact CG-CG2 4.23Å
654	H	85	Confident	88.6	Confident	82 Å²	82	71.4 Å²	71.4	38%	0.38	41%	0.405	S	S	.	.			trans	-90.4	-35.5	177.9	-62.7	-69.3	0	0	0	112.7	H612 E613 Q630 A652	H612-H654 VanDerWaalsContact O-CB 3.28Å; H612-H654 WeakPolarHBondContact O-CB 3.14Å; E613-H654 VanDerWaalsContact CD-N 3.34Å; E613-H654 PolarHBondContact OE1-N 2.98Å; E613-H654 IonicContact OE2-CD2 2.76Å; E613-H654 PolarHBondContact OE2-N 2.9Å; Q630-H654 PolarHBondContact NE2-CD2 3.16Å; A652-H654 PolarHBondContact O-N 3.44Å
655	A	89.1	Confident	88.8	Confident	2 Å²	2	69.5 Å²	69.5	2%	0.017	39%	0.394	C	S	.	.	S	Bend	trans	-84	151.7	-174.7	0	0	0	0	0	113.2	H612 E613 S657 T658 R659	H612-A655 HydrophobicContact CB-CB 3.95Å; E613-A655 HydrophobicContact CG-CB 3.95Å; E613-A655 PolarHBondContact OE1-N 3.43Å; A655-S657 VanDerWaalsContact C-N 3.32Å; A655-S657 PolarHBondContact O-N 2.9Å; A655-T658 WeakPolarHBondContact CB-OG1 3.45Å; A655-T658 PolarHBondContact N-OG1 3.12Å; A655-T658 PolarHBondContact O-OG1 2.92Å; A655-R659 VanDerWaalsContact O-CB 3.32Å; A655-R659 WeakPolarHBondContact O-CB 3.3Å; A655-R659 WeakPolarHBondContact O-CD 3.41Å; A655-R659 WeakPolarHBondContact O-CG 3.46Å; A655-R659 PolarHBondContact O-N 2.96Å
656	T	89.1	Confident	88.9	Confident	116 Å²	116	71.7 Å²	71.7	71%	0.712	40%	0.395	S	S	*	.	H	α-helix	trans	-65.4	-34.7	178.3	-44.4	0	0	0	0	112.5	L660	T656-L660 WeakPolarHBondContact O-CB 3.49Å; T656-L660 PolarHBondContact O-N 2.89Å
657	S	90.3	Very high	89.2	Confident	62 Å²	62	72.1 Å²	72.1	43%	0.434	39%	0.392	S	S	.	.	H	α-helix	trans	-69.9	-43.2	179.5	50.6	0	0	0	0	113	S610 A655 L660 L661	S610-S657 WeakPolarHBondContact CB-OG 3.49Å; A655-S657 VanDerWaalsContact C-N 3.32Å; A655-S657 PolarHBondContact O-N 2.9Å; S657-L660 PolarHBondContact O-N 2.92Å; S657-L661 PolarHBondContact O-N 2.78Å; S657-L661 VanDerWaalsContact O-N 3.15Å
658	T	90.4	Very high	89.4	Confident	0 Å²	0	69 Å²	69	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-65.7	-47.6	173.3	46.8	0	0	0	0	110	L603 A606 A607 E613 P653 A655 L660 L661 T662	L603-T658 HydrophobicContact CD1-CG2 4.22Å; A606-T658 HydrophobicContact CB-CG2 4.43Å; A607-T658 HydrophobicContact CB-CG2 3.79Å; E613-T658 HydrophobicContact CG-CG2 3.93Å; E613-T658 WeakPolarHBondContact OE1-CB 3.44Å; E613-T658 PolarHBondContact OE1-OG1 3.07Å; P653-T658 WeakPolarHBondContact CB-OG1 3.1Å; A655-T658 WeakPolarHBondContact CB-OG1 3.45Å; A655-T658 PolarHBondContact N-OG1 3.12Å; A655-T658 PolarHBondContact O-OG1 2.92Å; T658-L660 VanDerWaalsContact C-N 3.28Å; T658-L660 PolarHBondContact O-N 2.93Å; T658-L661 PolarHBondContact O-N 2.9Å; T658-L661 VanDerWaalsContact O-N 3.11Å; T658-T662 WeakPolarHBondContact O-CG2 3.45Å; T658-T662 PolarHBondContact O-N 3.01Å; T658-T662 PolarHBondContact O-OG1 2.84Å
659	R	91.2	Very high	89.8	Confident	137 Å²	137	65.5 Å²	65.5	52%	0.517	34%	0.339	S	S	.	.	H	α-helix	trans	-53.6	-40.4	175.1	-75.3	170.3	-179.2	-176.2	-0.3	113.6	P653 A655 T662 G663	P653-R659 HydrophobicContact CB-CG 4.06Å; P653-R659 HydrophobicContact CG-CG 3.98Å; P653-R659 PolarHBondContact O-NE 3.19Å; P653-R659 PolarHBondContact O-NH2 3.43Å; P653-R659 VanDerWaalsContact O-NH2 3.16Å; A655-R659 VanDerWaalsContact O-CB 3.32Å; A655-R659 WeakPolarHBondContact O-CB 3.3Å; A655-R659 WeakPolarHBondContact O-CD 3.41Å; A655-R659 WeakPolarHBondContact O-CG 3.46Å; A655-R659 PolarHBondContact O-N 2.96Å; R659-T662 WeakPolarHBondContact CA-OG1 3.39Å; R659-T662 PolarHBondContact O-OG1 3.36Å; R659-G663 PolarHBondContact O-N 2.79Å
660	L	91.9	Very high	90.1	Very high	123 Å²	123	69.1 Å²	69.1	64%	0.644	36%	0.357	S	S	*	.	H	α-helix	trans	-67	-47.3	176.4	-178.6	61.5	0	0	0	111.5	T656 S657 T658 T662 G663 V664	T656-L660 WeakPolarHBondContact O-CB 3.49Å; T656-L660 PolarHBondContact O-N 2.89Å; S657-L660 PolarHBondContact O-N 2.92Å; T658-L660 VanDerWaalsContact C-N 3.28Å; T658-L660 PolarHBondContact O-N 2.93Å; L660-T662 VanDerWaalsContact C-N 3.35Å; L660-T662 PolarHBondContact O-N 3.37Å; L660-G663 PolarHBondContact O-N 3.45Å; L660-V664 WeakPolarHBondContact O-CG2 3.39Å; L660-V664 PolarHBondContact O-N 3.32Å
661	L	91.8	Very high	90.5	Very high	46 Å²	46	62.8 Å²	62.8	24%	0.241	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-41	177.5	-178.1	65.5	0	0	0	111.9	C602 L603 A606 S657 T658 G663 V664 W665	C602-L661 HydrophobicContact CB-CD2 3.96Å; L603-L661 HydrophobicContact CB-CD2 4.01Å; L603-L661 HydrophobicContact CD1-CD2 4.16Å; A606-L661 HydrophobicContact CB-CD2 4.25Å; S657-L661 PolarHBondContact O-N 2.78Å; S657-L661 VanDerWaalsContact O-N 3.15Å; T658-L661 PolarHBondContact O-N 2.9Å; T658-L661 VanDerWaalsContact O-N 3.11Å; L661-G663 VanDerWaalsContact C-N 3.35Å; L661-V664 PolarHBondContact O-N 3.16Å; L661-W665 PolarHBondContact O-N 2.78Å
662	T	90.2	Very high	90.9	Very high	4 Å²	4	63.1 Å²	63.1	3%	0.025	33%	0.331	C	S	.	.	H	α-helix	trans	-68.5	-34.2	175.6	59	0	0	0	0	111.6	L603 Y639 P653 T658 R659 L660 W665 W666	L603-T662 HydrophobicContact CD1-CG2 3.71Å; L603-T662 HydrophobicContact CD2-CG2 4.16Å; Y639-T662 HydrophobicContact CD1-CG2 4.36Å; Y639-T662 HydrophobicContact CE1-CG2 3.36Å; P653-T662 HydrophobicContact CG-CG2 4.23Å; T658-T662 WeakPolarHBondContact O-CG2 3.45Å; T658-T662 PolarHBondContact O-N 3.01Å; T658-T662 PolarHBondContact O-OG1 2.84Å; R659-T662 WeakPolarHBondContact CA-OG1 3.39Å; R659-T662 PolarHBondContact O-OG1 3.36Å; L660-T662 VanDerWaalsContact C-N 3.35Å; L660-T662 PolarHBondContact O-N 3.37Å; T662-W665 PolarHBondContact O-N 3.15Å; T662-W666 WeakPolarHBondContact O-CB 3.35Å; T662-W666 PolarHBondContact O-N 2.64Å
663	G	90.9	Very high	91.2	Very high	34 Å²	34	62.2 Å²	62.2	35%	0.351	32%	0.318	S	S	.	.	H	α-helix	trans	-63.4	-42.1	172.2	0	0	0	0	0	113.1	R659 L660 L661 W666 F667	R659-G663 PolarHBondContact O-N 2.79Å; L660-G663 PolarHBondContact O-N 3.45Å; L661-G663 VanDerWaalsContact C-N 3.35Å; G663-W666 PolarHBondContact O-N 2.74Å; G663-F667 PolarHBondContact O-N 3.12Å
664	V	93.2	Very high	91.4	Very high	89 Å²	89	63.7 Å²	63.7	54%	0.539	33%	0.332	S	S	.	.	H	α-helix	trans	-66	-40.2	173.3	174.8	0	0	0	0	111.2	L660 L661 F667 F668	L660-V664 WeakPolarHBondContact O-CG2 3.39Å; L660-V664 PolarHBondContact O-N 3.32Å; L661-V664 PolarHBondContact O-N 3.16Å; V664-F667 PolarHBondContact O-N 2.64Å; V664-F668 PolarHBondContact O-N 3.47Å
665	W	93.1	Very high	91.8	Very high	5 Å²	5	62.6 Å²	62.6	2%	0.019	33%	0.331	C	S	.	.	H	α-helix	trans	-63.8	-42.5	174.2	178.6	-119.5	0	0	0	112.5	T595 Y596 V599 N640 L644 L661 T662 F667 F668 A669	T595-W665 HydrophobicContact CG2-CZ3 4.37Å; Y596-W665 HydrophobicContact CD2-CH2 4.31Å; Y596-W665 HydrophobicContact CD2-CZ2 4.05Å; V599-W665 HydrophobicContact CB-CD2 4.33Å; V599-W665 HydrophobicContact CB-CE3 3.9Å; V599-W665 HydrophobicContact CB-CZ3 4.14Å; V599-W665 HydrophobicContact CG1-CB 4Å; V599-W665 HydrophobicContact CG1-CD2 3.73Å; V599-W665 HydrophobicContact CG1-CE3 3.73Å; V599-W665 HydrophobicContact CG1-CG 3.86Å; V599-W665 HydrophobicContact CG1-CZ3 4.42Å; V599-W665 HydrophobicContact CG2-CE3 3.71Å; V599-W665 HydrophobicContact CG2-CZ3 3.94Å; N640-W665 HydrophobicContact CB-CZ2 4.2Å; N640-W665 PolarHBondContact O-NE1 3.13Å; N640-W665 PolarHBondContact OD1-NE1 2.88Å; L644-W665 HydrophobicContact CD1-CH2 4.05Å; L644-W665 HydrophobicContact CD1-CZ2 3.69Å; L644-W665 HydrophobicContact CD2-CH2 4.2Å; L644-W665 HydrophobicContact CD2-CZ2 4.01Å; L644-W665 HydrophobicContact CG-CH2 4.24Å; L644-W665 HydrophobicContact CG-CZ2 3.65Å; L661-W665 PolarHBondContact O-N 2.78Å; T662-W665 PolarHBondContact O-N 3.15Å; W665-F667 VanDerWaalsContact C-N 3.32Å; W665-F667 PolarHBondContact O-N 2.93Å; W665-F668 HydrophobicContact CE3-CB 4.49Å; W665-F668 AromaticContact CE3-CD1 3.72Å; W665-F668 HydrophobicContact CE3-CD1 3.72Å; W665-F668 HydrophobicContact CE3-CE1 4.44Å; W665-F668 HydrophobicContact CE3-CG 4.46Å; W665-F668 HydrophobicContact CH2-CD1 4.14Å; W665-F668 HydrophobicContact CH2-CE1 4.19Å; W665-F668 AromaticContact CZ3-CD1 3.35Å; W665-F668 HydrophobicContact CZ3-CD1 3.35Å; W665-F668 AromaticContact CZ3-CE1 3.63Å; W665-F668 HydrophobicContact CZ3-CE1 3.63Å; W665-F668 HydrophobicContact CZ3-CG 4.41Å; W665-F668 PolarHBondContact O-N 3.1Å; W665-A669 VanDerWaalsContact O-CB 3.3Å; W665-A669 WeakPolarHBondContact O-CB 3.42Å; W665-A669 PolarHBondContact O-N 2.98Å
666	W	91.7	Very high	91.9	Very high	146 Å²	146	65 Å²	65	55%	0.553	34%	0.34	S	S	*	.	H	α-helix	trans	-61.5	-40.3	174.8	-68.6	-2.5	0	0	0	111.4	T662 G663 A669 L670	T662-W666 WeakPolarHBondContact O-CB 3.35Å; T662-W666 PolarHBondContact O-N 2.64Å; G663-W666 PolarHBondContact O-N 2.74Å; W666-A669 PolarHBondContact O-N 2.76Å; W666-L670 WeakPolarHBondContact O-CB 3.42Å; W666-L670 PolarHBondContact O-N 2.89Å
667	F	93.1	Very high	92.1	Very high	135 Å²	135	63 Å²	63	59%	0.592	33%	0.328	S	S	*	.	H	α-helix	trans	-64.3	-43.7	175	-174.1	-111.7	0	0	0	112.3	G663 V664 W665 L670 I671	G663-F667 PolarHBondContact O-N 3.12Å; V664-F667 PolarHBondContact O-N 2.64Å; W665-F667 VanDerWaalsContact C-N 3.32Å; W665-F667 PolarHBondContact O-N 2.93Å; F667-L670 PolarHBondContact O-N 3.08Å; F667-I671 HydrophobicContact CD1-CD1 3.87Å; F667-I671 HydrophobicContact CE1-CD1 3.49Å; F667-I671 VanDerWaalsContact CE1-CD1 3.49Å; F667-I671 HydrophobicContact CE2-CD1 4.27Å; F667-I671 HydrophobicContact CG-CD1 4.41Å; F667-I671 HydrophobicContact CZ-CD1 3.72Å; F667-I671 WeakPolarHBondContact O-CG1 3.49Å; F667-I671 PolarHBondContact O-N 2.73Å
668	F	93.2	Very high	92.1	Very high	59 Å²	59	62.6 Å²	62.6	26%	0.259	33%	0.328	S	S	.	.	H	α-helix	trans	-64.2	-46.6	174.4	175.1	-95.6	0	0	0	112.4	T595 V664 W665 L670 I671 I672	T595-F668 HydrophobicContact CG2-CD1 4.5Å; T595-F668 HydrophobicContact CG2-CE1 3.88Å; T595-F668 HydrophobicContact CG2-CE2 4.26Å; T595-F668 HydrophobicContact CG2-CZ 3.74Å; V664-F668 PolarHBondContact O-N 3.47Å; W665-F668 HydrophobicContact CE3-CB 4.49Å; W665-F668 AromaticContact CE3-CD1 3.72Å; W665-F668 HydrophobicContact CE3-CD1 3.72Å; W665-F668 HydrophobicContact CE3-CE1 4.44Å; W665-F668 HydrophobicContact CE3-CG 4.46Å; W665-F668 HydrophobicContact CH2-CD1 4.14Å; W665-F668 HydrophobicContact CH2-CE1 4.19Å; W665-F668 AromaticContact CZ3-CD1 3.35Å; W665-F668 HydrophobicContact CZ3-CD1 3.35Å; W665-F668 AromaticContact CZ3-CE1 3.63Å; W665-F668 HydrophobicContact CZ3-CE1 3.63Å; W665-F668 HydrophobicContact CZ3-CG 4.41Å; W665-F668 PolarHBondContact O-N 3.1Å; F668-L670 VanDerWaalsContact C-N 3.33Å; F668-L670 PolarHBondContact O-N 2.65Å; F668-I671 PolarHBondContact O-N 3Å; F668-I672 HydrophobicContact CD1-CG1 4.17Å; F668-I672 HydrophobicContact CD2-CG1 4.3Å; F668-I672 HydrophobicContact CE1-CG1 3.7Å; F668-I672 HydrophobicContact CE2-CD1 4.07Å; F668-I672 HydrophobicContact CE2-CG1 3.84Å; F668-I672 HydrophobicContact CG-CG1 4.46Å; F668-I672 HydrophobicContact CZ-CD1 3.92Å; F668-I672 HydrophobicContact CZ-CG1 3.52Å; F668-I672 WeakPolarHBondContact O-CG1 3.26Å; F668-I672 PolarHBondContact O-N 3.45Å
669	A	92.4	Very high	92.2	Very high	2 Å²	2	65.9 Å²	65.9	2%	0.017	35%	0.346	C	S	.	.	H	α-helix	trans	-60.3	-43.7	177.3	0	0	0	0	0	111.1	A643 L644 W665 W666 I671 I672 I673	A643-A669 HydrophobicContact CB-CB 4.45Å; L644-A669 HydrophobicContact CD2-CB 3.99Å; W665-A669 VanDerWaalsContact O-CB 3.3Å; W665-A669 WeakPolarHBondContact O-CB 3.42Å; W665-A669 PolarHBondContact O-N 2.98Å; W666-A669 PolarHBondContact O-N 2.76Å; A669-I671 PolarHBondContact O-N 2.7Å; A669-I672 PolarHBondContact O-N 2.73Å; A669-I673 WeakPolarHBondContact O-CB 3.38Å; A669-I673 WeakPolarHBondContact O-CD1 3.3Å; A669-I673 WeakPolarHBondContact O-CG1 3.43Å; A669-I673 PolarHBondContact O-N 3.01Å
670	L	91.9	Very high	91.9	Very high	107 Å²	107	61.4 Å²	61.4	56%	0.56	33%	0.332	S	S	*	.	H	α-helix	trans	-57.7	-47.8	174	-172	164.1	0	0	0	111.1	W666 F667 F668 A674	W666-L670 WeakPolarHBondContact O-CB 3.42Å; W666-L670 PolarHBondContact O-N 2.89Å; F667-L670 PolarHBondContact O-N 3.08Å; F668-L670 VanDerWaalsContact C-N 3.33Å; F668-L670 PolarHBondContact O-N 2.65Å; L670-A674 WeakPolarHBondContact O-CB 3.3Å; L670-A674 PolarHBondContact O-N 3.13Å
671	I	93.4	Very high	91.5	Very high	74 Å²	74	58.1 Å²	58.1	38%	0.379	32%	0.322	S	S	.	.	H	α-helix	trans	-61.4	-47.2	177	-71.4	167.8	0	0	0	111.7	F667 F668 A669 A674 T675	F667-I671 HydrophobicContact CD1-CD1 3.87Å; F667-I671 HydrophobicContact CE1-CD1 3.49Å; F667-I671 VanDerWaalsContact CE1-CD1 3.49Å; F667-I671 HydrophobicContact CE2-CD1 4.27Å; F667-I671 HydrophobicContact CG-CD1 4.41Å; F667-I671 HydrophobicContact CZ-CD1 3.72Å; F667-I671 WeakPolarHBondContact O-CG1 3.49Å; F667-I671 PolarHBondContact O-N 2.73Å; F668-I671 PolarHBondContact O-N 3Å; A669-I671 PolarHBondContact O-N 2.7Å; I671-A674 PolarHBondContact O-N 3.07Å; I671-T675 WeakPolarHBondContact O-CB 3.13Å; I671-T675 PolarHBondContact O-N 3.3Å; I671-T675 PolarHBondContact O-OG1 2.56Å
672	I	92.7	Very high	91.1	Very high	35 Å²	35	58.4 Å²	58.4	18%	0.179	33%	0.332	C	S	.	.	H	α-helix	trans	-65.7	-43	-178.9	-68.1	-62.9	0	0	0	111.4	V592 F668 A669 T675 Y676	V592-I672 HydrophobicContact CG1-CG2 4.46Å; V592-I672 HydrophobicContact CG2-CD1 4.15Å; V592-I672 HydrophobicContact CG2-CG1 4.48Å; V592-I672 HydrophobicContact CG2-CG2 3.98Å; F668-I672 HydrophobicContact CD1-CG1 4.17Å; F668-I672 HydrophobicContact CD2-CG1 4.3Å; F668-I672 HydrophobicContact CE1-CG1 3.7Å; F668-I672 HydrophobicContact CE2-CD1 4.07Å; F668-I672 HydrophobicContact CE2-CG1 3.84Å; F668-I672 HydrophobicContact CG-CG1 4.46Å; F668-I672 HydrophobicContact CZ-CD1 3.92Å; F668-I672 HydrophobicContact CZ-CG1 3.52Å; F668-I672 WeakPolarHBondContact O-CG1 3.26Å; F668-I672 PolarHBondContact O-N 3.45Å; A669-I672 PolarHBondContact O-N 2.73Å; I672-T675 PolarHBondContact O-N 3.33Å; I672-Y676 WeakPolarHBondContact O-CB 3.35Å; I672-Y676 PolarHBondContact O-N 3.4Å
673	I	91.7	Very high	90.6	Very high	33 Å²	33	61.2 Å²	61.2	17%	0.169	34%	0.344	C	S	.	.	H	α-helix	trans	-65.9	-44.8	176.9	-64.3	164	0	0	0	110.1	L644 A669 T675 Y676 T677	L644-I673 WeakPolarHBondContact O-CD1 3.43Å; A669-I673 WeakPolarHBondContact O-CB 3.38Å; A669-I673 WeakPolarHBondContact O-CD1 3.3Å; A669-I673 WeakPolarHBondContact O-CG1 3.43Å; A669-I673 PolarHBondContact O-N 3.01Å; I673-T675 VanDerWaalsContact C-N 3.33Å; I673-T675 PolarHBondContact O-N 3.37Å; I673-Y676 PolarHBondContact O-N 3.23Å; I673-T677 HydrophobicContact CG2-CG2 4.4Å; I673-T677 WeakPolarHBondContact O-CG2 3.38Å; I673-T677 PolarHBondContact O-N 3.44Å; I673-T677 PolarHBondContact O-OG1 3.02Å
674	A	92.2	Very high	89.8	Confident	47 Å²	47	62.2 Å²	62.2	39%	0.388	34%	0.341	S	S	.	.	H	α-helix	trans	-62.7	-37.5	176.6	0	0	0	0	0	112.5	L670 I671 T677 A678	L670-A674 WeakPolarHBondContact O-CB 3.3Å; L670-A674 PolarHBondContact O-N 3.13Å; I671-A674 PolarHBondContact O-N 3.07Å; A674-T677 WeakPolarHBondContact CA-OG1 3.2Å; A674-T677 PolarHBondContact O-OG1 3.28Å; A674-T677 VanDerWaalsContact O-OG1 3.13Å; A674-A678 WeakPolarHBondContact O-CB 3.39Å; A674-A678 PolarHBondContact O-N 3.14Å
675	T	93.5	Very high	88.9	Confident	59 Å²	59	62.4 Å²	62.4	36%	0.362	34%	0.342	S	S	.	.	H	α-helix	trans	-68.3	-42.5	174.8	-53.8	0	0	0	0	111	I671 I672 I673 A678 N679	I671-T675 WeakPolarHBondContact O-CB 3.13Å; I671-T675 PolarHBondContact O-N 3.3Å; I671-T675 PolarHBondContact O-OG1 2.56Å; I672-T675 PolarHBondContact O-N 3.33Å; I673-T675 VanDerWaalsContact C-N 3.33Å; I673-T675 PolarHBondContact O-N 3.37Å; T675-A678 PolarHBondContact O-N 3.2Å; T675-N679 WeakPolarHBondContact O-CB 3.35Å; T675-N679 PolarHBondContact O-N 2.89Å; T675-N679 PolarHBondContact O-OD1 3.42Å
676	Y	92.9	Very high	87.7	Confident	53 Å²	53	66 Å²	66	21%	0.208	36%	0.364	C	S	.	.	H	α-helix	trans	-62.9	-44.4	174.5	171.4	-97.9	0	0	0	111.9	F580 P583 L584 W589 I672 I673 L680	F580-Y676 PolarHBondContact O-OH 2.85Å; P583-Y676 HydrophobicContact CB-CD2 4.23Å; P583-Y676 HydrophobicContact CB-CE2 4.24Å; P583-Y676 HydrophobicContact CG-CE2 4.28Å; L584-Y676 HydrophobicContact CD1-CD2 4.11Å; L584-Y676 HydrophobicContact CG-CD2 4.2Å; W589-Y676 HydrophobicContact CH2-CD2 4.35Å; W589-Y676 HydrophobicContact CH2-CE2 4.29Å; W589-Y676 HydrophobicContact CZ2-CD2 4.2Å; W589-Y676 HydrophobicContact CZ2-CE2 4.03Å; I672-Y676 WeakPolarHBondContact O-CB 3.35Å; I672-Y676 PolarHBondContact O-N 3.4Å; I673-Y676 PolarHBondContact O-N 3.23Å; Y676-L680 HydrophobicContact CE1-CD2 3.96Å; Y676-L680 WeakPolarHBondContact O-CB 3.12Å; Y676-L680 PolarHBondContact O-N 2.96Å
677	T	91.6	Very high	86.4	Confident	73 Å²	73	63.4 Å²	63.4	45%	0.448	36%	0.358	S	S	.	.	H	α-helix	trans	-70.1	-35.2	178.2	55.6	0	0	0	0	112.4	I673 A674 A681	I673-T677 HydrophobicContact CG2-CG2 4.4Å; I673-T677 WeakPolarHBondContact O-CG2 3.38Å; I673-T677 PolarHBondContact O-N 3.44Å; I673-T677 PolarHBondContact O-OG1 3.02Å; A674-T677 WeakPolarHBondContact CA-OG1 3.2Å; A674-T677 PolarHBondContact O-OG1 3.28Å; A674-T677 VanDerWaalsContact O-OG1 3.13Å; T677-A681 VanDerWaalsContact O-CB 3.28Å; T677-A681 WeakPolarHBondContact O-CB 3.38Å; T677-A681 PolarHBondContact O-N 3.04Å
678	A	91.7	Very high	85	Confident	54 Å²	54	61.8 Å²	61.8	45%	0.446	36%	0.356	S	S	.	.	H	α-helix	trans	-64.5	-48.6	172.8	0	0	0	0	0	111.8	A674 T675 L680 A681 A682	A674-A678 WeakPolarHBondContact O-CB 3.39Å; A674-A678 PolarHBondContact O-N 3.14Å; T675-A678 PolarHBondContact O-N 3.2Å; A678-L680 VanDerWaalsContact C-N 3.34Å; A678-L680 PolarHBondContact O-N 2.68Å; A678-A681 PolarHBondContact O-N 3.07Å; A678-A682 WeakPolarHBondContact O-CB 3.28Å; A678-A682 PolarHBondContact O-N 3.21Å
679	N	91.8	Very high	83.6	Confident	68 Å²	68	64 Å²	64	36%	0.364	37%	0.368	S	S	.	.	H	α-helix	trans	-66.7	-35.8	177.2	-72.2	6.9	0	0	0	112.1	P583 T675 A682 F683	P583-N679 HydrophobicContact CB-CB 3.81Å; P583-N679 VanDerWaalsContact O-CB 3.27Å; P583-N679 WeakPolarHBondContact O-CB 3.23Å; P583-N679 PolarHBondContact O-ND2 2.8Å; T675-N679 WeakPolarHBondContact O-CB 3.35Å; T675-N679 PolarHBondContact O-N 2.89Å; T675-N679 PolarHBondContact O-OD1 3.42Å; N679-A682 PolarHBondContact O-N 2.87Å; N679-F683 VanDerWaalsContact O-CB 3.31Å; N679-F683 WeakPolarHBondContact O-CB 3.17Å; N679-F683 PolarHBondContact O-N 2.95Å
680	L	85.7	Confident	82.5	Confident	43 Å²	43	71.3 Å²	71.3	23%	0.225	40%	0.4	C	S	.	.	H	α-helix	trans	-66.4	-43.3	174.9	177.6	62.7	0	0	0	110.5	P583 Y676 A678 F683 L684	P583-L680 HydrophobicContact CB-CB 4.24Å; P583-L680 HydrophobicContact CG-CB 3.88Å; P583-L680 HydrophobicContact CG-CD1 3.76Å; P583-L680 HydrophobicContact CG-CG 4.42Å; Y676-L680 HydrophobicContact CE1-CD2 3.96Å; Y676-L680 WeakPolarHBondContact O-CB 3.12Å; Y676-L680 PolarHBondContact O-N 2.96Å; A678-L680 VanDerWaalsContact C-N 3.34Å; A678-L680 PolarHBondContact O-N 2.68Å; L680-F683 PolarHBondContact O-N 3.11Å; L680-L684 HydrophobicContact CD1-CD1 3.84Å; L680-L684 HydrophobicContact CD1-CG 4.12Å; L680-L684 HydrophobicContact CG-CD1 3.87Å; L680-L684 WeakPolarHBondContact O-CB 3.11Å; L680-L684 WeakPolarHBondContact O-CG 3.46Å; L680-L684 PolarHBondContact O-N 3.38Å
681	A	83.2	Confident	81.7	Confident	54 Å²	54	67.9 Å²	67.9	45%	0.446	39%	0.385	S	S	.	.	H	α-helix	trans	-60.5	-47	173.5	0	0	0	0	0	111.5	T677 A678 F683 L684 T685	T677-A681 VanDerWaalsContact O-CB 3.28Å; T677-A681 WeakPolarHBondContact O-CB 3.38Å; T677-A681 PolarHBondContact O-N 3.04Å; A678-A681 PolarHBondContact O-N 3.07Å; A681-F683 VanDerWaalsContact C-N 3.34Å; A681-F683 PolarHBondContact O-N 3.15Å; A681-L684 PolarHBondContact O-N 2.97Å; A681-L684 VanDerWaalsContact O-N 3.17Å; A681-T685 WeakPolarHBondContact O-CG2 3.39Å; A681-T685 PolarHBondContact O-N 3.44Å; A681-T685 PolarHBondContact O-OG1 3.14Å
682	A	83.2	Confident	81.1	Confident	53 Å²	53	68.4 Å²	68.4	44%	0.438	39%	0.393	S	S	.	.	H	α-helix	trans	-64.5	-33.7	177.5	0	0	0	0	0	113.5	A678 N679 T685 V686	A678-A682 WeakPolarHBondContact O-CB 3.28Å; A678-A682 PolarHBondContact O-N 3.21Å; N679-A682 PolarHBondContact O-N 2.87Å; A682-T685 PolarHBondContact O-OG1 2.94Å; A682-T685 VanDerWaalsContact O-OG1 3.12Å; A682-V686 WeakPolarHBondContact O-CG2 3.38Å
683	F	79.1	Confident	80.8	Confident	63 Å²	63	66.9 Å²	66.9	28%	0.276	39%	0.385	S	S	.	.	H	α-helix	trans	-70.5	-37.2	173.2	-172.3	-82.4	0	0	0	111.6	S579 Q582 N679 L680 A681 T685 V686	S579-F683 WeakPolarHBondContact OG-CE1 3.49Å; Q582-F683 HydrophobicContact CB-CE2 4.17Å; Q582-F683 HydrophobicContact CB-CZ 4.49Å; N679-F683 VanDerWaalsContact O-CB 3.31Å; N679-F683 WeakPolarHBondContact O-CB 3.17Å; N679-F683 PolarHBondContact O-N 2.95Å; L680-F683 PolarHBondContact O-N 3.11Å; A681-F683 VanDerWaalsContact C-N 3.34Å; A681-F683 PolarHBondContact O-N 3.15Å; F683-T685 VanDerWaalsContact C-N 3.34Å; F683-V686 PolarHBondContact O-N 2.89Å
684	L	75.5	Confident	80.5	Confident	54 Å²	54	72.2 Å²	72.2	28%	0.283	41%	0.409	S	S	.	.	H	α-helix	trans	-76.5	-16.7	179.3	-68.9	171.5	0	0	0	113.7	L680 A681 L845 Q849	L680-L684 HydrophobicContact CD1-CD1 3.84Å; L680-L684 HydrophobicContact CD1-CG 4.12Å; L680-L684 HydrophobicContact CG-CD1 3.87Å; L680-L684 WeakPolarHBondContact O-CB 3.11Å; L680-L684 WeakPolarHBondContact O-CG 3.46Å; L680-L684 PolarHBondContact O-N 3.38Å; A681-L684 PolarHBondContact O-N 2.97Å; A681-L684 VanDerWaalsContact O-N 3.17Å; L684-L845 HydrophobicContact CD1-CD1 3.7Å; L684-L845 HydrophobicContact CD2-CD1 3.65Å; L684-L845 HydrophobicContact CG-CD1 4.14Å; L684-Q849 HydrophobicContact CD2-CB 4.45Å
685	T	73.6	Confident	80.4	Confident	94 Å²	94	71.7 Å²	71.7	58%	0.577	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-10.5	171.2	54.6	0	0	0	0	114.3	A681 A682 F683	A681-T685 WeakPolarHBondContact O-CG2 3.39Å; A681-T685 PolarHBondContact O-N 3.44Å; A681-T685 PolarHBondContact O-OG1 3.14Å; A682-T685 PolarHBondContact O-OG1 2.94Å; A682-T685 VanDerWaalsContact O-OG1 3.12Å; F683-T685 VanDerWaalsContact C-N 3.34Å
686	V	67.1	Low	80.2	Confident	79 Å²	79	69.4 Å²	69.4	48%	0.479	39%	0.39	S	S	.	.			trans	-119.6	97	-174.3	-177.9	0	0	0	0	112.1	A682 F683 N688	A682-V686 WeakPolarHBondContact O-CG2 3.38Å; F683-V686 PolarHBondContact O-N 2.89Å; V686-N688 PolarHBondContact O-N 3.25Å; V686-N688 VanDerWaalsContact O-N 3.13Å; V686-N688 PolarHBondContact O-ND2 2.78Å
687	E	64.9	Low	80.1	Confident	92 Å²	92	72.4 Å²	72.4	43%	0.43	41%	0.406	S	S	.	.			trans	-72.2	101	169.1	-71.3	-167.8	-155.2	0	0	111.4	S572 M689 S843	S572-E687 WeakPolarHBondContact CB-OE2 3.21Å; S572-E687 PolarHBondContact OG-OE2 3.02Å; E687-M689 PolarHBondContact O-N 3.32Å; E687-S843 VanDerWaalsContact OE1-CB 3.3Å; E687-S843 WeakPolarHBondContact OE1-CB 3.36Å; E687-S843 PolarHBondContact OE1-OG 2.86Å
688	N	62.8	Low	80.1	Confident	102 Å²	102	72 Å²	72	55%	0.545	40%	0.401	S	S	.	.			trans	-72.4	90.2	-179.5	-81.2	-75.8	0	0	0	112.8	V686 K690	V686-N688 PolarHBondContact O-N 3.25Å; V686-N688 VanDerWaalsContact O-N 3.13Å; V686-N688 PolarHBondContact O-ND2 2.78Å; N688-K690 PolarHBondContact O-N 2.68Å
689	M	65.4	Low	80	Confident	105 Å²	105	69.4 Å²	69.4	52%	0.517	38%	0.38	S	S	.	.			trans	-77.9	93.7	173.1	-60.8	-176.6	-170	0	0	111.7	P570 E687	P570-M689 HydrophobicContact CG-CB 4.46Å; E687-M689 PolarHBondContact O-N 3.32Å
690	K	68.5	Low	80	Confident	156 Å²	156	66.5 Å²	66.5	68%	0.678	37%	0.365	S	S	*	.			trans	-86.4	125.8	170.7	-67.4	-164.8	174.5	-166.6	0	111.6	N688	N688-K690 PolarHBondContact O-N 2.68Å
691	S	76.3	Confident	80.2	Confident	35 Å²	35	70.1 Å²	70.1	25%	0.245	39%	0.385	C	S	.	.			trans	-74.1	146	170.1	-169.3	0	0	0	0	110.6	I693	S691-I693 VanDerWaalsContact C-N 3.27Å; S691-I693 VanDerWaalsContact CB-O 3.28Å; S691-I693 WeakPolarHBondContact CB-O 3.29Å; S691-I693 PolarHBondContact OG-N 3.33Å; S691-I693 PolarHBondContact OG-O 2.83Å
692	P	80.8	Confident	80.5	Confident	85 Å²	85	69.8 Å²	69.8	55%	0.552	37%	0.374	S	S	*	.	S	Bend	trans	-80.7	-7.3	171.9	33.7	-35.7	0	0	0	113.5	F567 I705	F567-P692 HydrophobicContact CE1-CG 3.63Å; F567-P692 HydrophobicContact CZ-CG 4.05Å; P692-I705 HydrophobicContact CB-CD1 4.38Å; P692-I705 HydrophobicContact CG-CD1 4.27Å
693	I	86	Confident	80.6	Confident	3 Å²	3	73.5 Å²	73.5	2%	0.015	38%	0.382	C	S	.	.			trans	-143	137.4	177.3	45.5	165.3	0	0	0	109.3	I565 F567 S691 D698 L699 I705 A758 V779	I565-I693 HydrophobicContact CG2-CD1 4.25Å; F567-I693 HydrophobicContact CB-CD1 4.21Å; F567-I693 HydrophobicContact CD1-CD1 4.14Å; F567-I693 HydrophobicContact CD1-CG1 4.26Å; F567-I693 HydrophobicContact CD2-CD1 4.07Å; F567-I693 HydrophobicContact CE1-CG1 4.47Å; F567-I693 HydrophobicContact CG-CD1 3.87Å; F567-I693 HydrophobicContact CG-CG1 4.49Å; S691-I693 VanDerWaalsContact C-N 3.27Å; S691-I693 VanDerWaalsContact CB-O 3.28Å; S691-I693 WeakPolarHBondContact CB-O 3.29Å; S691-I693 PolarHBondContact OG-N 3.33Å; S691-I693 PolarHBondContact OG-O 2.83Å; I693-D698 HydrophobicContact CG2-CB 4.12Å; I693-L699 HydrophobicContact CD1-CD1 4.48Å; I693-L699 HydrophobicContact CD1-CD2 4.19Å; I693-L699 HydrophobicContact CD1-CG 4.38Å; I693-L699 HydrophobicContact CG2-CD2 3.92Å; I693-L699 HydrophobicContact CG2-CG 4.12Å; I693-I705 HydrophobicContact CG2-CD1 4.04Å; I693-A758 HydrophobicContact CD1-CB 4.41Å; I693-V779 HydrophobicContact CB-CG1 4.3Å; I693-V779 HydrophobicContact CD1-CB 4.32Å; I693-V779 HydrophobicContact CD1-CG1 4.03Å; I693-V779 HydrophobicContact CD1-CG2 4.14Å; I693-V779 HydrophobicContact CG1-CG1 3.95Å; I693-V779 HydrophobicContact CG1-CG2 4.28Å; I693-V779 VanDerWaalsContact O-CG1 3.23Å; I693-V779 WeakPolarHBondContact O-CG1 3.38Å
694	E	85.9	Confident	81.1	Confident	144 Å²	144	78.9 Å²	78.9	67%	0.673	41%	0.405	S	S	*	.	S	Bend	trans	-122.3	-26.8	175.9	-63.5	-174.7	178.3	0	0	111.3	D698 G780	E694-D698 PolarHBondContact N-OD2 3.32Å; E694-G780 WeakPolarHBondContact O-CA 3.26Å
695	S	88.7	Confident	81.8	Confident	36 Å²	36	76.9 Å²	76.9	25%	0.252	40%	0.395	S	S	.	.	S	Bend	trans	-130	168.9	-177.8	76.9	0	0	0	0	113.3	E697 D698	S695-E697 VanDerWaalsContact C-N 3.3Å; S695-E697 PolarHBondContact OG-N 3.46Å; S695-D698 PolarHBondContact N-OD2 3.07Å; S695-D698 PolarHBondContact OG-N 3.39Å; S695-D698 PolarHBondContact OG-OD1 3.46Å; S695-D698 PolarHBondContact OG-OD2 3.31Å
696	A	89.6	Confident	82.7	Confident	11 Å²	11	75.7 Å²	75.7	9%	0.091	38%	0.382	C	S	.	.	H	α-helix	trans	-73.6	-21.8	167.4	0	0	0	0	0	113	I565 D698 L699 A700 F727 M730 L783	I565-A696 HydrophobicContact CD1-CB 4.21Å; A696-D698 VanDerWaalsContact C-N 3.35Å; A696-L699 PolarHBondContact O-N 2.97Å; A696-A700 WeakPolarHBondContact O-CB 3.17Å; A696-A700 PolarHBondContact O-N 2.92Å; A696-F727 HydrophobicContact CB-CE1 4.41Å; A696-M730 HydrophobicContact CB-CE 4.42Å; A696-M730 HydrophobicContact CB-SD 4.2Å; A696-L783 HydrophobicContact CB-CD2 3.62Å
697	E	91.1	Very high	84	Confident	117 Å²	117	72.1 Å²	72.1	55%	0.547	36%	0.36	S	S	.	.	H	α-helix	trans	-70.3	-34.9	176.7	-66.4	179.7	177.7	0	0	111	S695 A700 N701 T726	S695-E697 VanDerWaalsContact C-N 3.3Å; S695-E697 PolarHBondContact OG-N 3.46Å; E697-A700 PolarHBondContact O-N 3.48Å; E697-N701 VanDerWaalsContact O-CB 3.32Å; E697-N701 WeakPolarHBondContact O-CB 3.09Å; E697-N701 VanDerWaalsContact O-CG 3.3Å; E697-N701 PolarHBondContact O-N 2.76Å; E697-N701 PolarHBondContact O-ND2 3.31Å; E697-T726 HydrophobicContact CB-CG2 4.48Å; E697-T726 HydrophobicContact CG-CG2 3.75Å
698	D	90.8	Very high	85.3	Confident	64 Å²	64	67.7 Å²	67.7	34%	0.342	34%	0.339	S	S	.	.	H	α-helix	trans	-57.1	-55.6	170.6	-54	-30	0	0	0	109.7	I693 E694 S695 A696 A700 N701 Q702	I693-D698 HydrophobicContact CG2-CB 4.12Å; E694-D698 PolarHBondContact N-OD2 3.32Å; S695-D698 PolarHBondContact N-OD2 3.07Å; S695-D698 PolarHBondContact OG-N 3.39Å; S695-D698 PolarHBondContact OG-OD1 3.46Å; S695-D698 PolarHBondContact OG-OD2 3.31Å; A696-D698 VanDerWaalsContact C-N 3.35Å; D698-A700 VanDerWaalsContact C-N 3.32Å; D698-A700 PolarHBondContact O-N 2.92Å; D698-N701 PolarHBondContact O-N 3.23Å; D698-Q702 WeakPolarHBondContact O-CG 3.46Å; D698-Q702 PolarHBondContact O-N 3.22Å
699	L	90.9	Very high	86.7	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-55.5	-45	178.1	-77.9	177.3	0	0	0	111.9	I565 I693 A696 N701 Q702 I705 Y707 A758	I565-L699 HydrophobicContact CD1-CD1 3.81Å; I565-L699 HydrophobicContact CG1-CD1 4.25Å; I565-L699 HydrophobicContact CG2-CD1 4.08Å; I693-L699 HydrophobicContact CD1-CD1 4.48Å; I693-L699 HydrophobicContact CD1-CD2 4.19Å; I693-L699 HydrophobicContact CD1-CG 4.38Å; I693-L699 HydrophobicContact CG2-CD2 3.92Å; I693-L699 HydrophobicContact CG2-CG 4.12Å; A696-L699 PolarHBondContact O-N 2.97Å; L699-N701 PolarHBondContact O-N 3.33Å; L699-Q702 PolarHBondContact O-N 3.11Å; L699-Q702 PolarHBondContact O-NE2 3.29Å; L699-I705 HydrophobicContact CD2-CB 4.29Å; L699-I705 HydrophobicContact CD2-CG2 3.96Å; L699-Y707 HydrophobicContact CB-CD1 4.05Å; L699-Y707 HydrophobicContact CB-CE1 4.27Å; L699-Y707 HydrophobicContact CD2-CD1 4.12Å; L699-Y707 WeakPolarHBondContact O-CE1 3.32Å; L699-A758 HydrophobicContact CD1-CB 4.12Å; L699-A758 HydrophobicContact CD2-CB 4.13Å
700	A	90.6	Very high	87.9	Confident	6 Å²	6	60.2 Å²	60.2	5%	0.05	30%	0.301	C	S	.	.	H	α-helix	trans	-67.5	-21.4	179.8	0	0	0	0	0	113.5	A696 E697 D698 T726 K729 M730	A696-A700 WeakPolarHBondContact O-CB 3.17Å; A696-A700 PolarHBondContact O-N 2.92Å; E697-A700 PolarHBondContact O-N 3.48Å; D698-A700 VanDerWaalsContact C-N 3.32Å; D698-A700 PolarHBondContact O-N 2.92Å; A700-T726 HydrophobicContact CB-CG2 3.76Å; A700-K729 HydrophobicContact CB-CD 4.49Å; A700-K729 WeakPolarHBondContact O-CD 3.36Å; A700-K729 WeakPolarHBondContact O-CE 3.47Å; A700-K729 PolarHBondContact O-NZ 3.13Å; A700-M730 HydrophobicContact CB-CG 3.77Å; A700-M730 HydrophobicContact CB-SD 4.23Å
701	N	90.8	Very high	88.6	Confident	120 Å²	120	58.3 Å²	58.3	64%	0.642	29%	0.292	S	S	*	.	H	α-helix	trans	-101	-1.5	-177.6	-71.7	-36.8	0	0	0	114.7	E697 D698 L699 K729	E697-N701 VanDerWaalsContact O-CB 3.32Å; E697-N701 WeakPolarHBondContact O-CB 3.09Å; E697-N701 VanDerWaalsContact O-CG 3.3Å; E697-N701 PolarHBondContact O-N 2.76Å; E697-N701 PolarHBondContact O-ND2 3.31Å; D698-N701 PolarHBondContact O-N 3.23Å; L699-N701 PolarHBondContact O-N 3.33Å; N701-K729 PolarHBondContact OD1-NZ 2.98Å
702	Q	88.6	Confident	88.7	Confident	47 Å²	47	59.2 Å²	59.2	22%	0.22	30%	0.299	C	S	.	.			trans	-125.4	158.9	176.4	64.3	81	59.6	0	0	111.8	D698 L699 I705	D698-Q702 WeakPolarHBondContact O-CG 3.46Å; D698-Q702 PolarHBondContact O-N 3.22Å; L699-Q702 PolarHBondContact O-N 3.11Å; L699-Q702 PolarHBondContact O-NE2 3.29Å; Q702-I705 PolarHBondContact NE2-O 3.18Å
703	E	86	Confident	88.7	Confident	131 Å²	131	55.9 Å²	55.9	61%	0.612	28%	0.28	S	S	*	.	S	Bend	trans	-118.5	3.5	176.7	-64.2	-167.4	139.5	0	0	113.3	F733 K736	E703-F733 HydrophobicContact CG-CE2 4.44Å; E703-K736 IonicContact OE1-NZ 2.62Å; E703-K736 PolarHBondContact OE1-NZ 3.05Å
704	K	88.4	Confident	88.6	Confident	175 Å²	175	56.5 Å²	56.5	76%	0.761	28%	0.284	S	S	*	.	S	Bend	trans	-78.9	-40.6	-173.1	-178	-177.6	175.7	-174.7	0	113.2
705	I	90.8	Very high	88.8	Confident	13 Å²	13	50.4 Å²	50.4	7%	0.067	26%	0.258	C	S	.	.	S	Bend	trans	-95.6	114.8	172.7	-60.1	171.6	0	0	0	106.1	F567 P692 I693 L699 Q702 N756 A758	F567-I705 HydrophobicContact CE2-CD1 4.36Å; F567-I705 HydrophobicContact CE2-CG2 3.94Å; F567-I705 HydrophobicContact CZ-CD1 4.1Å; P692-I705 HydrophobicContact CB-CD1 4.38Å; P692-I705 HydrophobicContact CG-CD1 4.27Å; I693-I705 HydrophobicContact CG2-CD1 4.04Å; L699-I705 HydrophobicContact CD2-CB 4.29Å; L699-I705 HydrophobicContact CD2-CG2 3.96Å; Q702-I705 PolarHBondContact NE2-O 3.18Å; I705-N756 CarbonylContact C-O 3.58Å; I705-N756 WeakPolarHBondContact CA-O 3.28Å; I705-A758 HydrophobicContact CG2-CB 4.08Å
706	K	92.7	Very high	88.8	Confident	69 Å²	69	50.4 Å²	50.4	30%	0.3	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	148.6	172.1	-78.4	-169.8	168.6	-169.3	0	109.4	F733 D739 N756 Y757 A758	K706-F733 HydrophobicContact CG-CZ 4.46Å; K706-D739 IonicContact NZ-OD1 3.2Å; K706-D739 PolarHBondContact NZ-OD1 2.66Å; K706-D739 IonicContact NZ-OD2 3.67Å; K706-D739 PolarHBondContact NZ-OD2 3.04Å; K706-N756 PolarHBondContact N-O 2.8Å; K706-Y757 HydrophobicContact CB-CD2 3.96Å; K706-Y757 CarbonylContact O-C 3.58Å; K706-Y757 VanDerWaalsContact O-CA 3.26Å; K706-Y757 WeakPolarHBondContact O-CA 3.36Å; K706-Y757 VanDerWaalsContact O-CD2 3.3Å; K706-Y757 WeakPolarHBondContact O-CD2 3.31Å; K706-A758 PolarHBondContact O-N 2.92Å
707	Y	93.8	Very high	88.6	Confident	3 Å²	3	52 Å²	52	1%	0.012	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	151.9	174.1	55.6	-91.4	0	0	0	111.3	L699 M730 F733 M734 A740 A758 I760	L699-Y707 HydrophobicContact CB-CD1 4.05Å; L699-Y707 HydrophobicContact CB-CE1 4.27Å; L699-Y707 HydrophobicContact CD2-CD1 4.12Å; L699-Y707 WeakPolarHBondContact O-CE1 3.32Å; Y707-M730 HydrophobicContact CD2-CE 3.95Å; Y707-M730 HydrophobicContact CE2-CB 3.73Å; Y707-M730 HydrophobicContact CE2-CE 3.92Å; Y707-M730 HydrophobicContact CE2-CG 3.75Å; Y707-F733 HydrophobicContact CD1-CD1 4.43Å; Y707-F733 HydrophobicContact CD1-CE1 4.17Å; Y707-F733 HydrophobicContact CD2-CD1 4.18Å; Y707-F733 HydrophobicContact CD2-CE1 4.49Å; Y707-F733 AromaticContact CE1-CD1 3.91Å; Y707-F733 HydrophobicContact CE1-CD1 3.91Å; Y707-F733 AromaticContact CE1-CE1 3.95Å; Y707-F733 HydrophobicContact CE1-CE1 3.95Å; Y707-F733 HydrophobicContact CE1-CG 4.23Å; Y707-F733 HydrophobicContact CE1-CZ 4.27Å; Y707-F733 HydrophobicContact CE2-CB 4.25Å; Y707-F733 AromaticContact CE2-CD1 3.62Å; Y707-F733 HydrophobicContact CE2-CD1 3.62Å; Y707-F733 HydrophobicContact CE2-CE1 4.27Å; Y707-F733 HydrophobicContact CE2-CG 4.12Å; Y707-F733 HydrophobicContact CG-CE1 4.44Å; Y707-F733 AromaticContact CZ-CD1 3.49Å; Y707-F733 VanDerWaalsContact CZ-CD1 3.49Å; Y707-F733 AromaticContact CZ-CG 3.67Å; Y707-F733 WeakPolarHBondContact OH-CB 3.49Å; Y707-F733 WeakPolarHBondContact OH-CG 3.35Å; Y707-M734 HydrophobicContact CD2-CE 4.46Å; Y707-M734 HydrophobicContact CE2-CE 4.42Å; Y707-A740 WeakPolarHBondContact O-CB 3.46Å; Y707-A758 WeakPolarHBondContact CA-O 3.42Å; Y707-A758 WeakPolarHBondContact CB-O 3.47Å; Y707-I760 HydrophobicContact CD2-CD1 4.17Å
708	G	93	Very high	88.6	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	168.1	-179.5	0	0	0	0	0	113.9	A758 F759 I760	G708-A758 PolarHBondContact N-O 3.08Å; G708-F759 WeakPolarHBondContact O-CD2 3.3Å; G708-I760 PolarHBondContact O-N 3.33Å
709	T	92.8	Very high	88.6	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.006	23%	0.23	C	C	.	.			trans	-106.3	-177.5	173.2	60.9	0	0	0	0	111	R716 F719 M734 T741 V742 I760	T709-R716 WeakPolarHBondContact OG1-CD 3.33Å; T709-F719 HydrophobicContact CG2-CD2 3.84Å; T709-F719 HydrophobicContact CG2-CE2 3.8Å; T709-M734 HydrophobicContact CG2-SD 4.11Å; T709-T741 WeakPolarHBondContact O-CA 3.43Å; T709-V742 PolarHBondContact O-N 3.26Å; T709-I760 HydrophobicContact CG2-CB 4.03Å; T709-I760 HydrophobicContact CG2-CG2 4.38Å
710	L	89.1	Confident	88.4	Confident	49 Å²	49	54.8 Å²	54.8	26%	0.257	26%	0.262	S	S	.	.	B	Isolated β-bridge	trans	-54.2	150.7	154.6	-67.4	168.5	0	0	0	110.9	S712 V742 T744 F759	L710-S712 VanDerWaalsContact C-N 3.32Å; L710-S712 WeakPolarHBondContact CB-O 3.24Å; L710-S712 PolarHBondContact O-N 3.21Å; L710-V742 CarbonylContact C-O 3.59Å; L710-V742 WeakPolarHBondContact CA-O 3.39Å; L710-V742 HydrophobicContact CD2-CG2 4.38Å; L710-T744 VanDerWaalsContact CD2-C 3.47Å; L710-F759 HydrophobicContact CD2-CZ 4.26Å; L710-F759 HydrophobicContact CG-CZ 4.21Å
711	K	84.2	Confident	88.2	Confident	115 Å²	115	59.1 Å²	59.1	50%	0.5	29%	0.288	S	S	.	.	S	Bend	trans	-67.1	-29.2	177.9	-80.4	166.4	-174.1	166	0	113.7	T741 V742	K711-T741 WeakPolarHBondContact CE-O 3.19Å; K711-T741 VanDerWaalsContact CG-OG1 3.3Å; K711-T741 WeakPolarHBondContact CG-OG1 3.33Å; K711-V742 WeakPolarHBondContact CG-O 3.26Å; K711-V742 PolarHBondContact N-O 3.4Å
712	S	78.3	Confident	88.1	Confident	54 Å²	54	54.3 Å²	54.3	38%	0.378	26%	0.264	S	S	.	.	S	Bend	trans	-129.8	149.4	174.8	52.9	0	0	0	0	110.3	L710	L710-S712 VanDerWaalsContact C-N 3.32Å; L710-S712 WeakPolarHBondContact CB-O 3.24Å; L710-S712 PolarHBondContact O-N 3.21Å
713	G	80	Confident	88.2	Confident	15 Å²	15	57.5 Å²	57.5	16%	0.155	29%	0.291	C	S	.	.	S	Bend	trans	121.3	167.1	176.2	0	0	0	0	0	114.5	S715 R716 D717	G713-S715 PolarHBondContact O-N 2.91Å; G713-R716 WeakPolarHBondContact O-CB 3.32Å; G713-R716 PolarHBondContact O-N 3.42Å; G713-D717 PolarHBondContact O-N 2.93Å
714	S	85.5	Confident	88.5	Confident	16 Å²	16	55.8 Å²	55.8	11%	0.112	29%	0.286	C	S	.	.	H	α-helix	trans	-50.8	-33.4	-170.8	51.6	0	0	0	0	115	T543 F718	T543-S714 PolarHBondContact OG1-OG 3.04Å; S714-F718 VanDerWaalsContact O-CB 3.25Å; S714-F718 WeakPolarHBondContact O-CB 3.48Å; S714-F718 PolarHBondContact O-N 3.33Å
715	S	88.8	Confident	88.6	Confident	17 Å²	17	52.4 Å²	52.4	12%	0.119	28%	0.282	C	S	.	.	H	α-helix	trans	-71.2	-35.6	175.8	-62.8	0	0	0	0	113.3	G713 F719	G713-S715 PolarHBondContact O-N 2.91Å; S715-F719 WeakPolarHBondContact O-CD2 3.31Å; S715-F719 PolarHBondContact O-N 3.44Å
716	R	88.4	Confident	88.7	Confident	35 Å²	35	53.4 Å²	53.4	13%	0.132	29%	0.289	C	S	.	.	H	α-helix	trans	-72.1	-43.9	177.5	-177.3	54.9	166.6	116.9	-4.8	111	T709 G713 F718 F719 R720 D735	T709-R716 WeakPolarHBondContact OG1-CD 3.33Å; G713-R716 WeakPolarHBondContact O-CB 3.32Å; G713-R716 PolarHBondContact O-N 3.42Å; R716-F718 VanDerWaalsContact C-N 3.33Å; R716-F718 PolarHBondContact O-N 3.31Å; R716-F719 PolarHBondContact O-N 3.47Å; R716-R720 PolarHBondContact O-N 2.95Å; R716-D735 IonicContact CZ-OD1 2.68Å; R716-D735 IonicContact NH1-OD1 3.62Å; R716-D735 PolarHBondContact NH1-OD1 3.03Å; R716-D735 IonicContact NH2-OD1 3.25Å; R716-D735 PolarHBondContact NH2-OD1 2.04Å
717	D	86.2	Confident	88.8	Confident	46 Å²	46	51.3 Å²	51.3	25%	0.246	28%	0.28	C	S	.	.	H	α-helix	trans	-64.4	-39.2	178.6	-55.7	-36.8	0	0	0	110.6	G713 F719 R720 T721	G713-D717 PolarHBondContact O-N 2.93Å; D717-F719 PolarHBondContact O-N 3.38Å; D717-R720 PolarHBondContact O-N 2.94Å; D717-R720 VanDerWaalsContact O-N 3.13Å; D717-T721 PolarHBondContact O-N 3.19Å; D717-T721 PolarHBondContact O-OG1 3.49Å
718	F	90.3	Very high	88.7	Confident	53 Å²	53	56.1 Å²	56.1	23%	0.232	30%	0.301	C	S	.	.	H	α-helix	trans	-54	-52	172.7	172.5	-98	0	0	0	113	S714 R716 R720 T721 S722 F727 D784	S714-F718 VanDerWaalsContact O-CB 3.25Å; S714-F718 WeakPolarHBondContact O-CB 3.48Å; S714-F718 PolarHBondContact O-N 3.33Å; R716-F718 VanDerWaalsContact C-N 3.33Å; R716-F718 PolarHBondContact O-N 3.31Å; F718-R720 PolarHBondContact O-N 3.13Å; F718-T721 PolarHBondContact O-N 3.1Å; F718-S722 VanDerWaalsContact O-CB 3.26Å; F718-S722 WeakPolarHBondContact O-CB 3.5Å; F718-S722 PolarHBondContact O-N 2.93Å; F718-F727 AromaticContact CE1-CD2 3.83Å; F718-F727 HydrophobicContact CE1-CD2 3.83Å; F718-F727 HydrophobicContact CE1-CE2 4.23Å; F718-F727 HydrophobicContact CE1-CG 4.18Å; F718-F727 AromaticContact CZ-CD2 3.67Å; F718-F727 HydrophobicContact CZ-CD2 3.67Å; F718-F727 AromaticContact CZ-CE2 3.9Å; F718-F727 HydrophobicContact CZ-CE2 3.9Å; F718-F727 HydrophobicContact CZ-CG 4.46Å; F718-D784 HydrophobicContact CE2-CB 4.17Å; F718-D784 HydrophobicContact CZ-CB 4.11Å
719	F	91.1	Very high	88.8	Confident	6 Å²	6	60.5 Å²	60.5	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-67.2	-23.4	179.2	-72.3	-68.2	0	0	0	113.5	T709 S715 R716 D717 F727 M730 M734 I760 L783	T709-F719 HydrophobicContact CG2-CD2 3.84Å; T709-F719 HydrophobicContact CG2-CE2 3.8Å; S715-F719 WeakPolarHBondContact O-CD2 3.31Å; S715-F719 PolarHBondContact O-N 3.44Å; R716-F719 PolarHBondContact O-N 3.47Å; D717-F719 PolarHBondContact O-N 3.38Å; F719-F727 HydrophobicContact CD1-CB 3.96Å; F719-F727 HydrophobicContact CE1-CB 4.11Å; F719-F727 AromaticContact CE1-CD1 3.98Å; F719-F727 HydrophobicContact CE1-CD1 3.98Å; F719-F727 HydrophobicContact CE1-CG 4.19Å; F719-M730 HydrophobicContact CD1-CB 4.09Å; F719-M730 HydrophobicContact CE1-CB 4.21Å; F719-M730 HydrophobicContact CE1-CE 4.23Å; F719-M730 HydrophobicContact CE1-SD 4.15Å; F719-M730 HydrophobicContact CZ-CE 4.39Å; F719-M734 HydrophobicContact CB-CE 3.9Å; F719-M734 HydrophobicContact CD1-CE 4.04Å; F719-M734 HydrophobicContact CD2-CE 3.56Å; F719-M734 HydrophobicContact CE1-CE 4.5Å; F719-M734 HydrophobicContact CE2-CE 4.08Å; F719-M734 HydrophobicContact CG-CE 3.56Å; F719-I760 HydrophobicContact CE2-CB 4.49Å; F719-I760 HydrophobicContact CE2-CD1 4.17Å; F719-I760 HydrophobicContact CE2-CG2 3.84Å; F719-I760 HydrophobicContact CZ-CD1 3.98Å; F719-I760 HydrophobicContact CZ-CG2 4.02Å; F719-L783 HydrophobicContact CZ-CD1 4.09Å
720	R	86.7	Confident	88.8	Confident	179 Å²	179	60.4 Å²	60.4	68%	0.675	32%	0.319	S	S	*	.	H	α-helix	trans	-80.8	-33.1	178.2	-158.1	177.4	-167	-167.6	-0.4	112.9	R716 D717 F718	R716-R720 PolarHBondContact O-N 2.95Å; D717-R720 PolarHBondContact O-N 2.94Å; D717-R720 VanDerWaalsContact O-N 3.13Å; F718-R720 PolarHBondContact O-N 3.13Å
721	T	86.6	Confident	88.9	Confident	97 Å²	97	58.2 Å²	58.2	60%	0.595	31%	0.308	S	S	*	.	H	α-helix	trans	-100.3	-9.4	-177	-55.5	0	0	0	0	113.1	D717 F718	D717-T721 PolarHBondContact O-N 3.19Å; D717-T721 PolarHBondContact O-OG1 3.49Å; F718-T721 PolarHBondContact O-N 3.1Å
722	S	89	Confident	89.3	Confident	20 Å²	20	57.5 Å²	57.5	14%	0.14	31%	0.307	C	S	.	.			trans	-65.2	134	-177.5	-163.9	0	0	0	0	113.7	F718 L724	F718-S722 VanDerWaalsContact O-CB 3.26Å; F718-S722 WeakPolarHBondContact O-CB 3.5Å; F718-S722 PolarHBondContact O-N 2.93Å; S722-L724 PolarHBondContact OG-N 2.75Å
723	S	90	Very high	90	Very high	113 Å²	113	55.7 Å²	55.7	79%	0.79	29%	0.292	S	S	*	.			trans	-87.8	-10.8	173.7	55.4	0	0	0	0	114
724	L	91.9	Very high	90.6	Very high	96 Å²	96	55 Å²	55	50%	0.503	29%	0.285	S	S	.	.	S	Bend	trans	-75.5	131.9	-178.7	-70.1	172	0	0	0	110.6	S722 T726 F727 K728	S722-L724 PolarHBondContact OG-N 2.75Å; L724-T726 PolarHBondContact O-N 3.26Å; L724-F727 HydrophobicContact CB-CB 4.49Å; L724-F727 HydrophobicContact CB-CD2 4.01Å; L724-F727 HydrophobicContact CD1-CD2 3.73Å; L724-F727 HydrophobicContact CD1-CE2 3.75Å; L724-F727 HydrophobicContact CG-CD2 4.5Å; L724-F727 PolarHBondContact O-N 3.14Å; L724-K728 WeakPolarHBondContact O-CB 3.43Å; L724-K728 PolarHBondContact O-N 3.2Å
725	P	92.2	Very high	90.9	Very high	104 Å²	104	57.8 Å²	57.8	68%	0.675	30%	0.299	S	S	*	.	H	α-helix	trans	-61.4	-40.5	-169.1	22.7	-33.5	0	0	0	113.2	K729	P725-K729 VanDerWaalsContact O-CB 3.29Å; P725-K729 WeakPolarHBondContact O-CB 3.14Å; P725-K729 PolarHBondContact O-N 3.44Å
726	T	92.6	Very high	91	Very high	34 Å²	34	62.8 Å²	62.8	21%	0.209	32%	0.318	C	S	.	.	H	α-helix	trans	-59.9	-51.4	176	-49	0	0	0	0	111.4	E697 A700 L724 K729 M730	E697-T726 HydrophobicContact CB-CG2 4.48Å; E697-T726 HydrophobicContact CG-CG2 3.75Å; A700-T726 HydrophobicContact CB-CG2 3.76Å; L724-T726 PolarHBondContact O-N 3.26Å; T726-K729 PolarHBondContact O-N 2.98Å; T726-M730 HydrophobicContact CG2-SD 4.42Å; T726-M730 VanDerWaalsContact O-CG 3.32Å; T726-M730 WeakPolarHBondContact O-CG 3.41Å; T726-M730 PolarHBondContact O-N 3.13Å
727	F	93.7	Very high	91	Very high	25 Å²	25	64.3 Å²	64.3	11%	0.11	32%	0.324	C	S	.	.	H	α-helix	trans	-72.4	-33.8	-177.3	-59	-27.2	0	0	0	112.5	A696 F718 F719 L724 M730 G731 L783	A696-F727 HydrophobicContact CB-CE1 4.41Å; F718-F727 AromaticContact CE1-CD2 3.83Å; F718-F727 HydrophobicContact CE1-CD2 3.83Å; F718-F727 HydrophobicContact CE1-CE2 4.23Å; F718-F727 HydrophobicContact CE1-CG 4.18Å; F718-F727 AromaticContact CZ-CD2 3.67Å; F718-F727 HydrophobicContact CZ-CD2 3.67Å; F718-F727 AromaticContact CZ-CE2 3.9Å; F718-F727 HydrophobicContact CZ-CE2 3.9Å; F718-F727 HydrophobicContact CZ-CG 4.46Å; F719-F727 HydrophobicContact CD1-CB 3.96Å; F719-F727 HydrophobicContact CE1-CB 4.11Å; F719-F727 AromaticContact CE1-CD1 3.98Å; F719-F727 HydrophobicContact CE1-CD1 3.98Å; F719-F727 HydrophobicContact CE1-CG 4.19Å; L724-F727 HydrophobicContact CB-CB 4.49Å; L724-F727 HydrophobicContact CB-CD2 4.01Å; L724-F727 HydrophobicContact CD1-CD2 3.73Å; L724-F727 HydrophobicContact CD1-CE2 3.75Å; L724-F727 HydrophobicContact CG-CD2 4.5Å; L724-F727 PolarHBondContact O-N 3.14Å; F727-M730 HydrophobicContact CD1-SD 4.08Å; F727-M730 WeakPolarHBondContact O-CB 3.31Å; F727-M730 PolarHBondContact O-N 2.9Å; F727-G731 PolarHBondContact O-N 3.27Å; F727-L783 HydrophobicContact CE1-CB 4.41Å; F727-L783 WeakPolarHBondContact CE2-O 3.46Å; F727-L783 HydrophobicContact CZ-CB 4.12Å; F727-L783 WeakPolarHBondContact CZ-O 3.38Å
728	K	93.2	Very high	91	Very high	104 Å²	104	66.1 Å²	66.1	45%	0.452	34%	0.339	S	S	.	.	H	α-helix	trans	-62.6	-44.8	171.4	-173.7	172.7	-175.1	-83.1	0	111.5	L724 M730 G731 E732	L724-K728 WeakPolarHBondContact O-CB 3.43Å; L724-K728 PolarHBondContact O-N 3.2Å; K728-M730 VanDerWaalsContact C-N 3.29Å; K728-M730 PolarHBondContact O-N 3.06Å; K728-G731 PolarHBondContact O-N 3.35Å; K728-G731 VanDerWaalsContact O-N 3.13Å; K728-E732 IonicContact NZ-OE1 2.72Å; K728-E732 PolarHBondContact NZ-OE1 3.13Å; K728-E732 WeakPolarHBondContact O-CB 3.35Å; K728-E732 WeakPolarHBondContact O-CG 3.36Å; K728-E732 PolarHBondContact O-N 2.93Å
729	K	93.2	Very high	90.9	Very high	91 Å²	91	67.2 Å²	67.2	40%	0.396	35%	0.347	S	S	.	.	H	α-helix	trans	-60	-38.4	174	-169.6	-172.5	-174	-162.1	0	111.9	A700 N701 P725 T726 F733	A700-K729 HydrophobicContact CB-CD 4.49Å; A700-K729 WeakPolarHBondContact O-CD 3.36Å; A700-K729 WeakPolarHBondContact O-CE 3.47Å; A700-K729 PolarHBondContact O-NZ 3.13Å; N701-K729 PolarHBondContact OD1-NZ 2.98Å; P725-K729 VanDerWaalsContact O-CB 3.29Å; P725-K729 WeakPolarHBondContact O-CB 3.14Å; P725-K729 PolarHBondContact O-N 3.44Å; T726-K729 PolarHBondContact O-N 2.98Å; K729-F733 WeakPolarHBondContact O-CB 3.38Å; K729-F733 PolarHBondContact O-N 2.85Å
730	M	93.2	Very high	90.8	Very high	0 Å²	0	67 Å²	67	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-67.8	-38.4	173.4	-67.9	173.9	77.9	0	0	112.7	A696 A700 Y707 F719 T726 F727 K728 F733 M734 I760	A696-M730 HydrophobicContact CB-CE 4.42Å; A696-M730 HydrophobicContact CB-SD 4.2Å; A700-M730 HydrophobicContact CB-CG 3.77Å; A700-M730 HydrophobicContact CB-SD 4.23Å; Y707-M730 HydrophobicContact CD2-CE 3.95Å; Y707-M730 HydrophobicContact CE2-CB 3.73Å; Y707-M730 HydrophobicContact CE2-CE 3.92Å; Y707-M730 HydrophobicContact CE2-CG 3.75Å; F719-M730 HydrophobicContact CD1-CB 4.09Å; F719-M730 HydrophobicContact CE1-CB 4.21Å; F719-M730 HydrophobicContact CE1-CE 4.23Å; F719-M730 HydrophobicContact CE1-SD 4.15Å; F719-M730 HydrophobicContact CZ-CE 4.39Å; T726-M730 HydrophobicContact CG2-SD 4.42Å; T726-M730 VanDerWaalsContact O-CG 3.32Å; T726-M730 WeakPolarHBondContact O-CG 3.41Å; T726-M730 PolarHBondContact O-N 3.13Å; F727-M730 HydrophobicContact CD1-SD 4.08Å; F727-M730 WeakPolarHBondContact O-CB 3.31Å; F727-M730 PolarHBondContact O-N 2.9Å; K728-M730 VanDerWaalsContact C-N 3.29Å; K728-M730 PolarHBondContact O-N 3.06Å; M730-F733 PolarHBondContact O-N 3.36Å; M730-M734 HydrophobicContact CB-CE 4.11Å; M730-M734 WeakPolarHBondContact O-CE 3.46Å; M730-M734 PolarHBondContact O-N 3.03Å; M730-I760 HydrophobicContact CE-CD1 3.47Å; M730-I760 VanDerWaalsContact CE-CD1 3.47Å
731	G	92.3	Very high	91	Very high	3 Å²	3	58.8 Å²	58.8	3%	0.031	32%	0.316	C	S	.	.	H	α-helix	trans	-63	-47.9	172.4	0	0	0	0	0	112.4	F727 K728 F733 M734 D735	F727-G731 PolarHBondContact O-N 3.27Å; K728-G731 PolarHBondContact O-N 3.35Å; K728-G731 VanDerWaalsContact O-N 3.13Å; G731-F733 VanDerWaalsContact C-N 3.29Å; G731-F733 PolarHBondContact O-N 3.43Å; G731-M734 CarbonylContact O-C 3.29Å; G731-M734 PolarHBondContact O-N 2.96Å; G731-M734 VanDerWaalsContact O-N 3.1Å; G731-D735 PolarHBondContact O-N 3.46Å
732	E	92.5	Very high	91.2	Very high	99 Å²	99	54.2 Å²	54.2	46%	0.463	29%	0.287	S	S	.	.	H	α-helix	trans	-59.9	-36.4	174.5	-71.9	170.5	-179.4	0	0	112	K728 D735 K736	K728-E732 IonicContact NZ-OE1 2.72Å; K728-E732 PolarHBondContact NZ-OE1 3.13Å; K728-E732 WeakPolarHBondContact O-CB 3.35Å; K728-E732 WeakPolarHBondContact O-CG 3.36Å; K728-E732 PolarHBondContact O-N 2.93Å; E732-D735 PolarHBondContact O-N 3.42Å; E732-K736 WeakPolarHBondContact O-CB 3.4Å; E732-K736 PolarHBondContact O-N 2.88Å
733	F	93.5	Very high	91.1	Very high	17 Å²	17	56.8 Å²	56.8	8%	0.075	31%	0.305	C	S	.	.	H	α-helix	trans	-64.9	-44	171.7	-179.6	-86.7	0	0	0	112.4	E703 K706 Y707 K729 M730 G731 D735 K736 Y737 A740	E703-F733 HydrophobicContact CG-CE2 4.44Å; K706-F733 HydrophobicContact CG-CZ 4.46Å; Y707-F733 HydrophobicContact CD1-CD1 4.43Å; Y707-F733 HydrophobicContact CD1-CE1 4.17Å; Y707-F733 HydrophobicContact CD2-CD1 4.18Å; Y707-F733 HydrophobicContact CD2-CE1 4.49Å; Y707-F733 AromaticContact CE1-CD1 3.91Å; Y707-F733 HydrophobicContact CE1-CD1 3.91Å; Y707-F733 AromaticContact CE1-CE1 3.95Å; Y707-F733 HydrophobicContact CE1-CE1 3.95Å; Y707-F733 HydrophobicContact CE1-CG 4.23Å; Y707-F733 HydrophobicContact CE1-CZ 4.27Å; Y707-F733 HydrophobicContact CE2-CB 4.25Å; Y707-F733 AromaticContact CE2-CD1 3.62Å; Y707-F733 HydrophobicContact CE2-CD1 3.62Å; Y707-F733 HydrophobicContact CE2-CE1 4.27Å; Y707-F733 HydrophobicContact CE2-CG 4.12Å; Y707-F733 HydrophobicContact CG-CE1 4.44Å; Y707-F733 AromaticContact CZ-CD1 3.49Å; Y707-F733 VanDerWaalsContact CZ-CD1 3.49Å; Y707-F733 AromaticContact CZ-CG 3.67Å; Y707-F733 WeakPolarHBondContact OH-CB 3.49Å; Y707-F733 WeakPolarHBondContact OH-CG 3.35Å; K729-F733 WeakPolarHBondContact O-CB 3.38Å; K729-F733 PolarHBondContact O-N 2.85Å; M730-F733 PolarHBondContact O-N 3.36Å; G731-F733 VanDerWaalsContact C-N 3.29Å; G731-F733 PolarHBondContact O-N 3.43Å; F733-D735 VanDerWaalsContact C-N 3.32Å; F733-D735 PolarHBondContact O-N 3.46Å; F733-K736 PolarHBondContact O-N 3.43Å; F733-Y737 HydrophobicContact CD1-CD2 4.3Å; F733-Y737 AromaticContact CD2-CD2 3.76Å; F733-Y737 HydrophobicContact CD2-CD2 3.76Å; F733-Y737 AromaticContact CD2-CE2 3.89Å; F733-Y737 HydrophobicContact CD2-CE2 3.89Å; F733-Y737 HydrophobicContact CE1-CD2 4.12Å; F733-Y737 AromaticContact CE2-CD2 3.57Å; F733-Y737 HydrophobicContact CE2-CD2 3.57Å; F733-Y737 AromaticContact CE2-CE2 3.62Å; F733-Y737 HydrophobicContact CE2-CE2 3.62Å; F733-Y737 HydrophobicContact CG-CD2 4.13Å; F733-Y737 AromaticContact CZ-CD2 3.76Å; F733-Y737 HydrophobicContact CZ-CD2 3.76Å; F733-Y737 HydrophobicContact CZ-CE2 4.2Å; F733-Y737 WeakPolarHBondContact O-CD2 3.23Å; F733-Y737 PolarHBondContact O-N 3.12Å; F733-A740 HydrophobicContact CE1-CB 4.46Å
734	M	92.8	Very high	90.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-69.6	-26.4	176.9	-75.2	179.6	-93.2	0	0	113.5	Y707 T709 F719 M730 G731 Y737 T741	Y707-M734 HydrophobicContact CD2-CE 4.46Å; Y707-M734 HydrophobicContact CE2-CE 4.42Å; T709-M734 HydrophobicContact CG2-SD 4.11Å; F719-M734 HydrophobicContact CB-CE 3.9Å; F719-M734 HydrophobicContact CD1-CE 4.04Å; F719-M734 HydrophobicContact CD2-CE 3.56Å; F719-M734 HydrophobicContact CE1-CE 4.5Å; F719-M734 HydrophobicContact CE2-CE 4.08Å; F719-M734 HydrophobicContact CG-CE 3.56Å; M730-M734 HydrophobicContact CB-CE 4.11Å; M730-M734 WeakPolarHBondContact O-CE 3.46Å; M730-M734 PolarHBondContact O-N 3.03Å; G731-M734 CarbonylContact O-C 3.29Å; G731-M734 PolarHBondContact O-N 2.96Å; G731-M734 VanDerWaalsContact O-N 3.1Å; M734-Y737 CarbonylContact O-C 3.54Å; M734-T741 HydrophobicContact CB-CG2 4.25Å; M734-T741 HydrophobicContact CG-CG2 4.37Å
735	D	90.5	Very high	90.8	Very high	75 Å²	75	51.2 Å²	51.2	40%	0.401	27%	0.271	S	S	.	.	H	α-helix	trans	-76.4	-41.1	171.1	-75	5.5	0	0	0	111.5	R716 G731 E732 F733 Y737	R716-D735 IonicContact CZ-OD1 2.68Å; R716-D735 IonicContact NH1-OD1 3.62Å; R716-D735 PolarHBondContact NH1-OD1 3.03Å; R716-D735 IonicContact NH2-OD1 3.25Å; R716-D735 PolarHBondContact NH2-OD1 2.04Å; G731-D735 PolarHBondContact O-N 3.46Å; E732-D735 PolarHBondContact O-N 3.42Å; F733-D735 VanDerWaalsContact C-N 3.32Å; F733-D735 PolarHBondContact O-N 3.46Å; D735-Y737 VanDerWaalsContact C-N 3.33Å
736	K	90.3	Very high	90.6	Very high	121 Å²	121	50.7 Å²	50.7	53%	0.526	26%	0.26	S	S	.	.	H	α-helix	trans	-66	-32.6	175.2	-178.9	-173	175.1	-156.9	0	112.7	E703 E732 F733 P738	E703-K736 IonicContact OE1-NZ 2.62Å; E703-K736 PolarHBondContact OE1-NZ 3.05Å; E732-K736 WeakPolarHBondContact O-CB 3.4Å; E732-K736 PolarHBondContact O-N 2.88Å; F733-K736 PolarHBondContact O-N 3.43Å; K736-P738 WeakPolarHBondContact O-CD 3.42Å
737	Y	90	Very high	90.6	Very high	68 Å²	68	52 Å²	52	27%	0.267	26%	0.263	S	S	.	.			trans	-123.3	76.7	179.1	-61.3	-68	0	0	0	111.3	F733 M734 D735 D739 A740	F733-Y737 HydrophobicContact CD1-CD2 4.3Å; F733-Y737 AromaticContact CD2-CD2 3.76Å; F733-Y737 HydrophobicContact CD2-CD2 3.76Å; F733-Y737 AromaticContact CD2-CE2 3.89Å; F733-Y737 HydrophobicContact CD2-CE2 3.89Å; F733-Y737 HydrophobicContact CE1-CD2 4.12Å; F733-Y737 AromaticContact CE2-CD2 3.57Å; F733-Y737 HydrophobicContact CE2-CD2 3.57Å; F733-Y737 AromaticContact CE2-CE2 3.62Å; F733-Y737 HydrophobicContact CE2-CE2 3.62Å; F733-Y737 HydrophobicContact CG-CD2 4.13Å; F733-Y737 AromaticContact CZ-CD2 3.76Å; F733-Y737 HydrophobicContact CZ-CD2 3.76Å; F733-Y737 HydrophobicContact CZ-CE2 4.2Å; F733-Y737 WeakPolarHBondContact O-CD2 3.23Å; F733-Y737 PolarHBondContact O-N 3.12Å; M734-Y737 CarbonylContact O-C 3.54Å; D735-Y737 VanDerWaalsContact C-N 3.33Å; Y737-D739 PolarHBondContact O-N 3.43Å; Y737-D739 VanDerWaalsContact O-N 3.09Å; Y737-A740 VanDerWaalsContact O-CB 3.26Å; Y737-A740 WeakPolarHBondContact O-CB 3.06Å; Y737-A740 PolarHBondContact O-N 3.46Å
738	P	86	Confident	90.5	Very high	84 Å²	84	50.8 Å²	50.8	55%	0.545	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-56.9	-28.8	177.1	-24.8	34.7	0	0	0	112.7	K736 A740 T741	K736-P738 WeakPolarHBondContact O-CD 3.42Å; P738-A740 PolarHBondContact O-N 3.22Å; P738-T741 PolarHBondContact O-N 2.9Å; P738-T741 VanDerWaalsContact O-N 3.13Å; P738-T741 PolarHBondContact O-OG1 3.33Å
739	D	88.2	Confident	90.5	Very high	76 Å²	76	46.3 Å²	46.3	41%	0.406	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-60.6	-21.6	174.6	86.8	-83.2	0	0	0	113.3	K706 Y737 T741 R751	K706-D739 IonicContact NZ-OD1 3.2Å; K706-D739 PolarHBondContact NZ-OD1 2.66Å; K706-D739 IonicContact NZ-OD2 3.67Å; K706-D739 PolarHBondContact NZ-OD2 3.04Å; Y737-D739 PolarHBondContact O-N 3.43Å; Y737-D739 VanDerWaalsContact O-N 3.09Å; D739-T741 VanDerWaalsContact C-N 3.34Å; D739-R751 PolarHBondContact O-NH1 3.49Å; D739-R751 PolarHBondContact O-NH2 3.33Å; D739-R751 IonicContact OD2-NH2 3.84Å; D739-R751 PolarHBondContact OD2-NH2 2.7Å
740	A	88.6	Confident	90.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-75.6	-21.8	177.4	0	0	0	0	0	113.1	Y707 F733 Y737 P738 R751 Y757	Y707-A740 WeakPolarHBondContact O-CB 3.46Å; F733-A740 HydrophobicContact CE1-CB 4.46Å; Y737-A740 VanDerWaalsContact O-CB 3.26Å; Y737-A740 WeakPolarHBondContact O-CB 3.06Å; Y737-A740 PolarHBondContact O-N 3.46Å; P738-A740 PolarHBondContact O-N 3.22Å; A740-R751 PolarHBondContact O-NH1 2.84Å; A740-Y757 VanDerWaalsContact O-CE2 3.3Å; A740-Y757 WeakPolarHBondContact O-CE2 3.41Å; A740-Y757 PolarHBondContact O-OH 2.88Å
741	T	90.5	Very high	90.5	Very high	8 Å²	8	49.1 Å²	49.1	5%	0.049	25%	0.251	C	S	.	.	S	Bend	trans	-87.3	144.8	176.1	64.4	0	0	0	0	111.6	T709 K711 M734 P738 D739	T709-T741 WeakPolarHBondContact O-CA 3.43Å; K711-T741 WeakPolarHBondContact CE-O 3.19Å; K711-T741 VanDerWaalsContact CG-OG1 3.3Å; K711-T741 WeakPolarHBondContact CG-OG1 3.33Å; M734-T741 HydrophobicContact CB-CG2 4.25Å; M734-T741 HydrophobicContact CG-CG2 4.37Å; P738-T741 PolarHBondContact O-N 2.9Å; P738-T741 VanDerWaalsContact O-N 3.13Å; P738-T741 PolarHBondContact O-OG1 3.33Å; D739-T741 VanDerWaalsContact C-N 3.34Å
742	V	91.7	Very high	90.6	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-112.8	155.2	-175.4	-67.5	0	0	0	0	111.9	T709 L710 K711 E747 F759	T709-V742 PolarHBondContact O-N 3.26Å; L710-V742 CarbonylContact C-O 3.59Å; L710-V742 WeakPolarHBondContact CA-O 3.39Å; L710-V742 HydrophobicContact CD2-CG2 4.38Å; K711-V742 WeakPolarHBondContact CG-O 3.26Å; K711-V742 PolarHBondContact N-O 3.4Å; V742-E747 HydrophobicContact CB-CB 4.28Å; V742-E747 HydrophobicContact CB-CG 3.95Å; V742-E747 HydrophobicContact CG1-CG 3.88Å; V742-F759 HydrophobicContact CG2-CD2 4.08Å; V742-F759 HydrophobicContact CG2-CE2 3.36Å; V742-F759 HydrophobicContact CG2-CZ 3.9Å
743	S	86	Confident	90.6	Very high	74 Å²	74	46.6 Å²	46.6	52%	0.517	24%	0.24	S	C	.	.	S	Bend	trans	-83.1	-32.3	178.8	69.2	0	0	0	0	113.8	E747	S743-E747 WeakPolarHBondContact CA-OE2 3.46Å; S743-E747 WeakPolarHBondContact CB-OE2 3.39Å; S743-E747 PolarHBondContact N-OE2 2.9Å; S743-E747 PolarHBondContact OG-OE2 3.32Å
744	T	87.2	Confident	90.4	Very high	69 Å²	69	53.2 Å²	53.2	42%	0.423	27%	0.271	S	S	.	.	S	Bend	trans	-131.3	157.8	-179.5	66.2	0	0	0	0	112.2	L710 Q746 E747 G748	L710-T744 VanDerWaalsContact CD2-C 3.47Å; T744-Q746 VanDerWaalsContact C-N 3.26Å; T744-Q746 PolarHBondContact O-N 3.44Å; T744-E747 PolarHBondContact N-OE2 2.9Å; T744-E747 PolarHBondContact O-N 2.9Å; T744-E747 VanDerWaalsContact OG1-CB 3.32Å; T744-E747 WeakPolarHBondContact OG1-CB 3.44Å; T744-E747 PolarHBondContact OG1-N 3.13Å; T744-G748 PolarHBondContact O-N 3.47Å; T744-G748 VanDerWaalsContact O-N 3.14Å
745	T	88.3	Confident	90.1	Very high	23 Å²	23	54.4 Å²	54.4	14%	0.141	28%	0.283	C	S	.	.	H	α-helix	trans	-62.7	-36.2	177.3	-46.7	0	0	0	0	111.3	G748 I749 F759 L761 Y769	T745-G748 PolarHBondContact O-N 3.34Å; T745-I749 HydrophobicContact CG2-CD1 4.22Å; T745-I749 WeakPolarHBondContact O-CD1 3.14Å; T745-I749 VanDerWaalsContact O-CG1 3.31Å; T745-I749 WeakPolarHBondContact O-CG1 3.38Å; T745-I749 PolarHBondContact O-N 2.79Å; T745-F759 HydrophobicContact CG2-CE1 4.04Å; T745-L761 HydrophobicContact CG2-CD1 4.27Å; T745-Y769 HydrophobicContact CG2-CE2 3.66Å
746	Q	89.7	Confident	90	Very high	94 Å²	94	55.9 Å²	55.9	44%	0.439	29%	0.291	S	S	.	.	H	α-helix	trans	-64.6	-46.9	176.7	-176.5	61.9	22.6	0	0	112.2	T744 G748 I749 E750	T744-Q746 VanDerWaalsContact C-N 3.26Å; T744-Q746 PolarHBondContact O-N 3.44Å; Q746-G748 PolarHBondContact O-N 2.94Å; Q746-I749 PolarHBondContact O-N 3.27Å; Q746-I749 VanDerWaalsContact O-N 3.13Å; Q746-E750 WeakPolarHBondContact CG-OE1 3.44Å; Q746-E750 PolarHBondContact NE2-OE1 3.03Å; Q746-E750 WeakPolarHBondContact O-CG 3.39Å; Q746-E750 PolarHBondContact O-N 2.88Å
747	E	91.8	Very high	90.1	Very high	61 Å²	61	50.4 Å²	50.4	29%	0.285	27%	0.267	S	S	.	.	H	α-helix	trans	-56.4	-40	172.8	-179.4	-166.1	160.5	0	0	111.4	V742 S743 T744 R751	V742-E747 HydrophobicContact CB-CB 4.28Å; V742-E747 HydrophobicContact CB-CG 3.95Å; V742-E747 HydrophobicContact CG1-CG 3.88Å; S743-E747 WeakPolarHBondContact CA-OE2 3.46Å; S743-E747 WeakPolarHBondContact CB-OE2 3.39Å; S743-E747 PolarHBondContact N-OE2 2.9Å; S743-E747 PolarHBondContact OG-OE2 3.32Å; T744-E747 PolarHBondContact N-OE2 2.9Å; T744-E747 PolarHBondContact O-N 2.9Å; T744-E747 VanDerWaalsContact OG1-CB 3.32Å; T744-E747 WeakPolarHBondContact OG1-CB 3.44Å; T744-E747 PolarHBondContact OG1-N 3.13Å; E747-R751 VanDerWaalsContact O-CB 3.24Å; E747-R751 WeakPolarHBondContact O-CB 3.48Å; E747-R751 PolarHBondContact O-N 3.48Å; E747-R751 VanDerWaalsContact O-N 3.07Å
748	G	92	Very high	90.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61	-46.1	173.8	0	0	0	0	0	113.4	T744 T745 Q746 R751 V752	T744-G748 PolarHBondContact O-N 3.47Å; T744-G748 VanDerWaalsContact O-N 3.14Å; T745-G748 PolarHBondContact O-N 3.34Å; Q746-G748 PolarHBondContact O-N 2.94Å; G748-R751 PolarHBondContact O-N 3.12Å; G748-V752 WeakPolarHBondContact O-CG2 3.22Å; G748-V752 PolarHBondContact O-N 3.41Å
749	I	92.8	Very high	90.7	Very high	9 Å²	9	43.1 Å²	43.1	5%	0.046	23%	0.228	C	C	.	.	H	α-helix	trans	-66.4	-48.4	179.6	-66.4	156.7	0	0	0	111.2	L566 T745 Q746 R751 V752 L753 Y769 L776	L566-I749 HydrophobicContact CD2-CG1 3.98Å; T745-I749 HydrophobicContact CG2-CD1 4.22Å; T745-I749 WeakPolarHBondContact O-CD1 3.14Å; T745-I749 VanDerWaalsContact O-CG1 3.31Å; T745-I749 WeakPolarHBondContact O-CG1 3.38Å; T745-I749 PolarHBondContact O-N 2.79Å; Q746-I749 PolarHBondContact O-N 3.27Å; Q746-I749 VanDerWaalsContact O-N 3.13Å; I749-R751 PolarHBondContact O-N 3.37Å; I749-V752 WeakPolarHBondContact O-CB 3.4Å; I749-V752 PolarHBondContact O-N 2.97Å; I749-V752 VanDerWaalsContact O-N 3.11Å; I749-L753 HydrophobicContact CG2-CD1 3.97Å; I749-L753 HydrophobicContact CG2-CG 4.48Å; I749-L753 WeakPolarHBondContact O-CG 3.34Å; I749-L753 PolarHBondContact O-N 3.02Å; I749-Y769 HydrophobicContact CD1-CD1 3.48Å; I749-Y769 VanDerWaalsContact CD1-CD1 3.48Å; I749-Y769 HydrophobicContact CD1-CD2 3.67Å; I749-Y769 HydrophobicContact CD1-CE1 3.49Å; I749-Y769 VanDerWaalsContact CD1-CE1 3.49Å; I749-Y769 HydrophobicContact CD1-CE2 3.72Å; I749-Y769 HydrophobicContact CD1-CG 3.56Å; I749-Y769 HydrophobicContact CG1-CG 4.45Å; I749-L776 HydrophobicContact CG2-CD1 3.98Å
750	E	93.5	Very high	91	Very high	95 Å²	95	39.6 Å²	39.6	44%	0.444	21%	0.209	S	C	.	.	H	α-helix	trans	-58.1	-38.4	177.7	-73.2	173.5	-167.2	0	0	111.6	Q746 L753 Q754	Q746-E750 WeakPolarHBondContact CG-OE1 3.44Å; Q746-E750 PolarHBondContact NE2-OE1 3.03Å; Q746-E750 WeakPolarHBondContact O-CG 3.39Å; Q746-E750 PolarHBondContact O-N 2.88Å; E750-L753 PolarHBondContact O-N 3.04Å; E750-Q754 WeakPolarHBondContact O-CG 3.4Å; E750-Q754 PolarHBondContact O-N 3.09Å; E750-Q754 VanDerWaalsContact O-N 3.07Å
751	R	93.3	Very high	91.2	Very high	55 Å²	55	40 Å²	40	21%	0.208	21%	0.211	C	C	.	.	H	α-helix	trans	-70.7	-35.7	176	-163.2	-179.1	-166.3	175.3	6.6	113.5	D739 A740 E747 G748 I749 L753 Q754 Y757	D739-R751 PolarHBondContact O-NH1 3.49Å; D739-R751 PolarHBondContact O-NH2 3.33Å; D739-R751 IonicContact OD2-NH2 3.84Å; D739-R751 PolarHBondContact OD2-NH2 2.7Å; A740-R751 PolarHBondContact O-NH1 2.84Å; E747-R751 VanDerWaalsContact O-CB 3.24Å; E747-R751 WeakPolarHBondContact O-CB 3.48Å; E747-R751 PolarHBondContact O-N 3.48Å; E747-R751 VanDerWaalsContact O-N 3.07Å; G748-R751 PolarHBondContact O-N 3.12Å; I749-R751 PolarHBondContact O-N 3.37Å; R751-L753 VanDerWaalsContact C-N 3.31Å; R751-Q754 PolarHBondContact O-N 2.9Å; R751-Y757 HydrophobicContact CB-CD1 3.78Å; R751-Y757 HydrophobicContact CB-CE1 4.1Å; R751-Y757 HydrophobicContact CB-CG 4.42Å; R751-Y757 HydrophobicContact CG-CD1 3.66Å; R751-Y757 HydrophobicContact CG-CD2 4.41Å; R751-Y757 HydrophobicContact CG-CE1 4.15Å; R751-Y757 HydrophobicContact CG-CG 3.8Å
752	V	93.5	Very high	91.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.9	-44.9	169.9	169.4	0	0	0	0	109.9	L566 F567 T568 G748 I749 Q754 G755 Y757 F759 L776	L566-V752 HydrophobicContact CD2-CG2 4.34Å; F567-V752 VanDerWaalsContact C-CG1 3.46Å; T568-V752 HydrophobicContact CG2-CG1 4.08Å; T568-V752 WeakPolarHBondContact CG2-O 3.45Å; G748-V752 WeakPolarHBondContact O-CG2 3.22Å; G748-V752 PolarHBondContact O-N 3.41Å; I749-V752 WeakPolarHBondContact O-CB 3.4Å; I749-V752 PolarHBondContact O-N 2.97Å; I749-V752 VanDerWaalsContact O-N 3.11Å; V752-Q754 VanDerWaalsContact C-N 3.28Å; V752-Q754 PolarHBondContact O-N 3.44Å; V752-G755 WeakPolarHBondContact O-CA 3.27Å; V752-G755 PolarHBondContact O-N 2.88Å; V752-Y757 HydrophobicContact CG2-CD1 3.74Å; V752-Y757 HydrophobicContact CG2-CE1 4.24Å; V752-F759 HydrophobicContact CG2-CB 3.47Å; V752-F759 VanDerWaalsContact CG2-CB 3.47Å; V752-L776 HydrophobicContact CB-CD2 4.4Å; V752-L776 HydrophobicContact CG1-CD2 3.7Å
753	L	92.1	Very high	91.4	Very high	50 Å²	50	40.4 Å²	40.4	26%	0.262	21%	0.214	S	C	.	.	H	α-helix	trans	-64.8	-26.5	-179.6	-67.9	168.5	0	0	0	113.9	I749 E750 R751 G755 D773 R775 L776	I749-L753 HydrophobicContact CG2-CD1 3.97Å; I749-L753 HydrophobicContact CG2-CG 4.48Å; I749-L753 WeakPolarHBondContact O-CG 3.34Å; I749-L753 PolarHBondContact O-N 3.02Å; E750-L753 PolarHBondContact O-N 3.04Å; R751-L753 VanDerWaalsContact C-N 3.31Å; L753-G755 PolarHBondContact O-N 3.44Å; L753-D773 WeakPolarHBondContact CD1-OD2 3.38Å; L753-D773 WeakPolarHBondContact CD2-OD2 3.48Å; L753-R775 HydrophobicContact CD2-CB 3.85Å; L753-L776 HydrophobicContact CD2-CD2 3.72Å; L753-L776 HydrophobicContact CD2-CG 4.23Å; L753-L776 HydrophobicContact CG-CD2 4.09Å
754	Q	90.9	Very high	91.8	Very high	156 Å²	156	37 Å²	37	73%	0.729	19%	0.19	S	C	*	.	H	α-helix	trans	-68.9	-20.3	169.8	-70.3	167.8	18.8	0	0	113	E750 R751 V752	E750-Q754 WeakPolarHBondContact O-CG 3.4Å; E750-Q754 PolarHBondContact O-N 3.09Å; E750-Q754 VanDerWaalsContact O-N 3.07Å; R751-Q754 PolarHBondContact O-N 2.9Å; V752-Q754 VanDerWaalsContact C-N 3.28Å; V752-Q754 PolarHBondContact O-N 3.44Å
755	G	86.4	Confident	92	Very high	25 Å²	25	34.5 Å²	34.5	26%	0.258	17%	0.173	S	C	.	.	S	Bend	trans	89.5	166.7	177.5	0	0	0	0	0	114.5	V752 L753 Y757	V752-G755 WeakPolarHBondContact O-CA 3.27Å; V752-G755 PolarHBondContact O-N 2.88Å; L753-G755 PolarHBondContact O-N 3.44Å; G755-Y757 PolarHBondContact O-N 3.38Å; G755-Y757 VanDerWaalsContact O-N 3.08Å
756	N	87	Confident	92.2	Very high	106 Å²	106	33.4 Å²	33.4	57%	0.567	17%	0.167	S	C	*	.	S	Bend	trans	55.1	18.8	-174.2	-55.3	-49.6	0	0	0	115.2	I705 K706	I705-N756 CarbonylContact C-O 3.58Å; I705-N756 WeakPolarHBondContact CA-O 3.28Å; K706-N756 PolarHBondContact N-O 2.8Å
757	Y	93.6	Very high	92.3	Very high	5 Å²	5	31.8 Å²	31.8	2%	0.02	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	138.7	173.7	-178.1	-108.3	0	0	0	110.8	F567 K706 A740 R751 V752 G755 F759	F567-Y757 VanDerWaalsContact CD2-O 3.31Å; F567-Y757 WeakPolarHBondContact CD2-O 3.05Å; F567-Y757 WeakPolarHBondContact CE2-O 3.49Å; K706-Y757 HydrophobicContact CB-CD2 3.96Å; K706-Y757 CarbonylContact O-C 3.58Å; K706-Y757 VanDerWaalsContact O-CA 3.26Å; K706-Y757 WeakPolarHBondContact O-CA 3.36Å; K706-Y757 VanDerWaalsContact O-CD2 3.3Å; K706-Y757 WeakPolarHBondContact O-CD2 3.31Å; A740-Y757 VanDerWaalsContact O-CE2 3.3Å; A740-Y757 WeakPolarHBondContact O-CE2 3.41Å; A740-Y757 PolarHBondContact O-OH 2.88Å; R751-Y757 HydrophobicContact CB-CD1 3.78Å; R751-Y757 HydrophobicContact CB-CE1 4.1Å; R751-Y757 HydrophobicContact CB-CG 4.42Å; R751-Y757 HydrophobicContact CG-CD1 3.66Å; R751-Y757 HydrophobicContact CG-CD2 4.41Å; R751-Y757 HydrophobicContact CG-CE1 4.15Å; R751-Y757 HydrophobicContact CG-CG 3.8Å; V752-Y757 HydrophobicContact CG2-CD1 3.74Å; V752-Y757 HydrophobicContact CG2-CE1 4.24Å; G755-Y757 PolarHBondContact O-N 3.38Å; G755-Y757 VanDerWaalsContact O-N 3.08Å; Y757-F759 HydrophobicContact CD1-CB 4.46Å; Y757-F759 HydrophobicContact CE1-CB 3.82Å; Y757-F759 HydrophobicContact CE1-CD2 4.25Å; Y757-F759 HydrophobicContact CE1-CG 4.37Å
758	A	93.5	Very high	92.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	120.4	174.7	0	0	0	0	0	109.8	I565 F567 I693 L699 I705 K706 Y707 G708	I565-A758 HydrophobicContact CG2-CB 3.99Å; F567-A758 HydrophobicContact CD2-CB 3.89Å; F567-A758 HydrophobicContact CE2-CB 4.5Å; I693-A758 HydrophobicContact CD1-CB 4.41Å; L699-A758 HydrophobicContact CD1-CB 4.12Å; L699-A758 HydrophobicContact CD2-CB 4.13Å; I705-A758 HydrophobicContact CG2-CB 4.08Å; K706-A758 PolarHBondContact O-N 2.92Å; Y707-A758 WeakPolarHBondContact CA-O 3.42Å; Y707-A758 WeakPolarHBondContact CB-O 3.47Å; G708-A758 PolarHBondContact N-O 3.08Å
759	F	94.7	Very high	92.3	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	128.9	-176.6	-175.5	-140.3	0	0	0	110	L566 G708 L710 V742 T745 V752 Y757 L761	L566-F759 HydrophobicContact CB-CB 4.37Å; L566-F759 HydrophobicContact CD2-CB 4.44Å; L566-F759 HydrophobicContact CD2-CD1 4.11Å; L566-F759 PolarHBondContact N-O 3.49Å; L566-F759 PolarHBondContact O-N 3.2Å; G708-F759 WeakPolarHBondContact O-CD2 3.3Å; L710-F759 HydrophobicContact CD2-CZ 4.26Å; L710-F759 HydrophobicContact CG-CZ 4.21Å; V742-F759 HydrophobicContact CG2-CD2 4.08Å; V742-F759 HydrophobicContact CG2-CE2 3.36Å; V742-F759 HydrophobicContact CG2-CZ 3.9Å; T745-F759 HydrophobicContact CG2-CE1 4.04Å; V752-F759 HydrophobicContact CG2-CB 3.47Å; V752-F759 VanDerWaalsContact CG2-CB 3.47Å; Y757-F759 HydrophobicContact CD1-CB 4.46Å; Y757-F759 HydrophobicContact CE1-CB 3.82Å; Y757-F759 HydrophobicContact CE1-CD2 4.25Å; Y757-F759 HydrophobicContact CE1-CG 4.37Å; F759-L761 HydrophobicContact CD1-CB 4.37Å; F759-L761 HydrophobicContact CD1-CD1 4.03Å; F759-L761 HydrophobicContact CD1-CD2 4.17Å; F759-L761 HydrophobicContact CD1-CG 4.42Å; F759-L761 HydrophobicContact CE1-CB 4.11Å; F759-L761 HydrophobicContact CE1-CD1 3.83Å; F759-L761 HydrophobicContact CE1-CG 4.41Å; F759-L761 HydrophobicContact CZ-CB 4.43Å
760	I	94.3	Very high	92.1	Very high	2 Å²	2	32 Å²	32	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	112.3	179.7	-52.6	174.2	0	0	0	108.5	Y707 G708 T709 F719 M730 L783	Y707-I760 HydrophobicContact CD2-CD1 4.17Å; G708-I760 PolarHBondContact O-N 3.33Å; T709-I760 HydrophobicContact CG2-CB 4.03Å; T709-I760 HydrophobicContact CG2-CG2 4.38Å; F719-I760 HydrophobicContact CE2-CB 4.49Å; F719-I760 HydrophobicContact CE2-CD1 4.17Å; F719-I760 HydrophobicContact CE2-CG2 3.84Å; F719-I760 HydrophobicContact CZ-CD1 3.98Å; F719-I760 HydrophobicContact CZ-CG2 4.02Å; M730-I760 HydrophobicContact CE-CD1 3.47Å; M730-I760 VanDerWaalsContact CE-CD1 3.47Å; I760-L783 HydrophobicContact CG2-CD1 3.96Å
761	L	92.5	Very high	91.8	Very high	8 Å²	8	29.4 Å²	29.4	4%	0.042	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	177.9	-179.5	77.2	175.7	0	0	0	110.1	S564 L566 T745 F759 W765 N766	S564-L761 PolarHBondContact N-O 2.7Å; S564-L761 PolarHBondContact O-N 2.66Å; S564-L761 VanDerWaalsContact O-N 3.13Å; L566-L761 HydrophobicContact CB-CD2 3.55Å; L566-L761 HydrophobicContact CD2-CD2 4.42Å; T745-L761 HydrophobicContact CG2-CD1 4.27Å; F759-L761 HydrophobicContact CD1-CB 4.37Å; F759-L761 HydrophobicContact CD1-CD1 4.03Å; F759-L761 HydrophobicContact CD1-CD2 4.17Å; F759-L761 HydrophobicContact CD1-CG 4.42Å; F759-L761 HydrophobicContact CE1-CB 4.11Å; F759-L761 HydrophobicContact CE1-CD1 3.83Å; F759-L761 HydrophobicContact CE1-CG 4.41Å; F759-L761 HydrophobicContact CZ-CB 4.43Å; L761-W765 HydrophobicContact CD1-CB 3.57Å; L761-W765 HydrophobicContact CG-CB 4.2Å; L761-N766 HydrophobicContact CD2-CB 4.15Å
762	E	93.1	Very high	91.5	Very high	3 Å²	3	29.7 Å²	29.7	1%	0.014	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	143.2	178.2	-64.3	177.6	148.4	0	0	111.3	T543 L561 G562 T764 W765 N766 Y788	T543-E762 WeakPolarHBondContact CG2-OE1 3.35Å; T543-E762 PolarHBondContact OG1-OE1 2.84Å; L561-E762 HydrophobicContact CD1-CB 3.65Å; L561-E762 HydrophobicContact CD1-CG 3.6Å; L561-E762 WeakPolarHBondContact CD1-OE1 3.1Å; G562-E762 WeakPolarHBondContact O-CA 3.08Å; E762-T764 PolarHBondContact O-N 3.25Å; E762-T764 VanDerWaalsContact O-N 3.1Å; E762-W765 HydrophobicContact CB-CE3 4.01Å; E762-W765 HydrophobicContact CB-CZ3 4.35Å; E762-W765 HydrophobicContact CG-CZ3 4.45Å; E762-W765 PolarHBondContact O-N 3.43Å; E762-W765 VanDerWaalsContact OE2-CZ3 3.26Å; E762-W765 WeakPolarHBondContact OE2-CZ3 3.43Å; E762-N766 PolarHBondContact O-N 3.5Å; E762-N766 VanDerWaalsContact O-N 3.1Å; E762-Y788 WeakPolarHBondContact OE2-CE1 3.17Å; E762-Y788 VanDerWaalsContact OE2-CZ 3.27Å; E762-Y788 PolarHBondContact OE2-OH 3.11Å
763	S	94	Very high	91.3	Very high	14 Å²	14	31.2 Å²	31.2	10%	0.098	16%	0.158	C	C	.	.	H	α-helix	trans	-56.6	-29.5	-173.7	58.9	0	0	0	0	114.1	G562 N766 E767 L782	G562-S763 PolarHBondContact N-OG 3.33Å; G562-S763 WeakPolarHBondContact O-CB 3.28Å; G562-S763 PolarHBondContact O-N 2.89Å; G562-S763 PolarHBondContact O-OG 3.46Å; S763-N766 PolarHBondContact O-N 3.21Å; S763-E767 VanDerWaalsContact O-CB 3.32Å; S763-E767 WeakPolarHBondContact O-CB 3.33Å; S763-E767 PolarHBondContact O-N 3.02Å; S763-L782 VanDerWaalsContact CB-CD2 3.45Å
764	T	93	Very high	91	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.012	15%	0.154	C	C	.	.	H	α-helix	trans	-59.3	-48	172.9	39.6	0	0	0	0	112.3	M559 L561 E762 Y768 Y788 W823	M559-T764 HydrophobicContact CG-CG2 4.27Å; M559-T764 HydrophobicContact SD-CG2 3.55Å; M559-T764 VanDerWaalsContact SD-CG2 3.55Å; L561-T764 HydrophobicContact CB-CG2 3.9Å; E762-T764 PolarHBondContact O-N 3.25Å; E762-T764 VanDerWaalsContact O-N 3.1Å; T764-Y768 WeakPolarHBondContact O-CB 3.2Å; T764-Y768 PolarHBondContact O-N 3.34Å; T764-Y768 VanDerWaalsContact O-N 3.13Å; T764-Y788 HydrophobicContact CG2-CE2 3.85Å; T764-Y788 PolarHBondContact OG1-OH 2.88Å; T764-W823 HydrophobicContact CG2-CZ2 4.5Å; T764-W823 PolarHBondContact O-NE1 3.11Å
765	W	92.4	Very high	90.9	Very high	17 Å²	17	30 Å²	30	6%	0.064	15%	0.146	C	C	.	.	H	α-helix	trans	-71.1	-37.4	172.4	-79.4	-60.6	0	0	0	111.9	D459 A460 F462 Y510 L761 E762 E767 Y768 Y769	D459-W765 HydrophobicContact CB-CZ2 4.33Å; A460-W765 PolarHBondContact O-NE1 3.18Å; A460-W765 VanDerWaalsContact O-NE1 3.16Å; F462-W765 HydrophobicContact CD2-CZ2 4.22Å; F462-W765 HydrophobicContact CE2-CD2 4.4Å; F462-W765 AromaticContact CE2-CE2 3.69Å; F462-W765 AromaticContact CE2-CZ2 3.79Å; F462-W765 HydrophobicContact CE2-CZ2 3.79Å; F462-W765 AromaticContact CE2-NE1 3.69Å; Y510-W765 HydrophobicContact CE2-CH2 4.01Å; Y510-W765 WeakPolarHBondContact OH-CH2 3.37Å; L761-W765 HydrophobicContact CD1-CB 3.57Å; L761-W765 HydrophobicContact CG-CB 4.2Å; E762-W765 HydrophobicContact CB-CE3 4.01Å; E762-W765 HydrophobicContact CB-CZ3 4.35Å; E762-W765 HydrophobicContact CG-CZ3 4.45Å; E762-W765 PolarHBondContact O-N 3.43Å; E762-W765 VanDerWaalsContact OE2-CZ3 3.26Å; E762-W765 WeakPolarHBondContact OE2-CZ3 3.43Å; W765-E767 PolarHBondContact O-N 3.21Å; W765-Y768 WeakPolarHBondContact O-CB 3.43Å; W765-Y768 PolarHBondContact O-N 3.44Å; W765-Y768 VanDerWaalsContact O-N 3.16Å; W765-Y769 HydrophobicContact CB-CD2 4.12Å; W765-Y769 HydrophobicContact CB-CE2 4.01Å; W765-Y769 AromaticContact CD1-CE2 3.76Å; W765-Y769 HydrophobicContact CG-CE2 4.16Å; W765-Y769 WeakPolarHBondContact O-CD2 3.46Å; W765-Y769 PolarHBondContact O-N 3.35Å
766	N	92.3	Very high	91.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-57	-49.2	176.8	-162.5	-14.7	0	0	0	111.2	S564 I565 L566 L761 E762 S763 Y768 Y769 A770	S564-N766 PolarHBondContact OG-ND2 2.87Å; I565-N766 VanDerWaalsContact C-ND2 3.32Å; I565-N766 PolarHBondContact O-ND2 3.03Å; L566-N766 WeakPolarHBondContact CD1-OD1 3.41Å; L761-N766 HydrophobicContact CD2-CB 4.15Å; E762-N766 PolarHBondContact O-N 3.5Å; E762-N766 VanDerWaalsContact O-N 3.1Å; S763-N766 PolarHBondContact O-N 3.21Å; N766-Y768 PolarHBondContact O-N 3.46Å; N766-Y769 PolarHBondContact O-N 3.02Å; N766-A770 WeakPolarHBondContact O-CB 3.42Å; N766-A770 PolarHBondContact O-N 2.57Å
767	E	91.2	Very high	91.2	Very high	59 Å²	59	25.6 Å²	25.6	28%	0.276	12%	0.119	S	C	.	.	H	α-helix	trans	-60	-41.2	174.3	-172.1	179.8	174.4	0	0	112.5	S763 W765 Q771 K819	S763-E767 VanDerWaalsContact O-CB 3.32Å; S763-E767 WeakPolarHBondContact O-CB 3.33Å; S763-E767 PolarHBondContact O-N 3.02Å; W765-E767 PolarHBondContact O-N 3.21Å; E767-Q771 WeakPolarHBondContact O-CG 3.47Å; E767-Q771 PolarHBondContact O-N 3.04Å; E767-K819 WeakPolarHBondContact OE1-CE 3.28Å; E767-K819 IonicContact OE1-NZ 2.69Å; E767-K819 PolarHBondContact OE1-NZ 3.3Å; E767-K819 WeakPolarHBondContact OE2-CE 3.37Å; E767-K819 IonicContact OE2-NZ 3.89Å; E767-K819 PolarHBondContact OE2-NZ 3.14Å
768	Y	92.2	Very high	91	Very high	12 Å²	12	28.8 Å²	28.8	5%	0.047	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-48.5	177.6	177.3	-99.4	0	0	0	112.5	A460 P461 T764 W765 N766 R772	A460-Y768 HydrophobicContact CB-CE1 4.47Å; P461-Y768 HydrophobicContact CB-CD2 3.81Å; P461-Y768 HydrophobicContact CB-CE2 3.56Å; P461-Y768 HydrophobicContact CG-CD2 3.63Å; P461-Y768 HydrophobicContact CG-CE2 3.92Å; P461-Y768 HydrophobicContact CG-CG 4.24Å; T764-Y768 WeakPolarHBondContact O-CB 3.2Å; T764-Y768 PolarHBondContact O-N 3.34Å; T764-Y768 VanDerWaalsContact O-N 3.13Å; W765-Y768 WeakPolarHBondContact O-CB 3.43Å; W765-Y768 PolarHBondContact O-N 3.44Å; W765-Y768 VanDerWaalsContact O-N 3.16Å; N766-Y768 PolarHBondContact O-N 3.46Å; Y768-R772 VanDerWaalsContact CD2-CZ 3.41Å; Y768-R772 PolarHBondContact O-NH1 2.95Å
769	Y	91.4	Very high	90.8	Very high	45 Å²	45	29.1 Å²	29.1	18%	0.176	14%	0.136	C	C	.	.	H	α-helix	trans	-77.1	-37.7	-177.4	-68.2	-67.9	0	0	0	112.6	T745 I749 W765 N766 Q771 R772 D773	T745-Y769 HydrophobicContact CG2-CE2 3.66Å; I749-Y769 HydrophobicContact CD1-CD1 3.48Å; I749-Y769 VanDerWaalsContact CD1-CD1 3.48Å; I749-Y769 HydrophobicContact CD1-CD2 3.67Å; I749-Y769 HydrophobicContact CD1-CE1 3.49Å; I749-Y769 VanDerWaalsContact CD1-CE1 3.49Å; I749-Y769 HydrophobicContact CD1-CE2 3.72Å; I749-Y769 HydrophobicContact CD1-CG 3.56Å; I749-Y769 HydrophobicContact CG1-CG 4.45Å; W765-Y769 HydrophobicContact CB-CD2 4.12Å; W765-Y769 HydrophobicContact CB-CE2 4.01Å; W765-Y769 AromaticContact CD1-CE2 3.76Å; W765-Y769 HydrophobicContact CG-CE2 4.16Å; W765-Y769 WeakPolarHBondContact O-CD2 3.46Å; W765-Y769 PolarHBondContact O-N 3.35Å; N766-Y769 PolarHBondContact O-N 3.02Å; Y769-Q771 PolarHBondContact O-N 2.85Å; Y769-R772 PolarHBondContact O-N 3.45Å; Y769-D773 PolarHBondContact O-N 2.85Å
770	A	89	Confident	90.4	Very high	17 Å²	17	30.7 Å²	30.7	14%	0.14	15%	0.152	C	C	.	.	H	α-helix	trans	-69.7	-14.9	178.9	0	0	0	0	0	114.4	N766 L776	N766-A770 WeakPolarHBondContact O-CB 3.42Å; N766-A770 PolarHBondContact O-N 2.57Å; A770-L776 HydrophobicContact CB-CB 4.36Å
771	Q	87.2	Confident	90.1	Very high	42 Å²	42	36.2 Å²	36.2	20%	0.196	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-15.5	169.6	-72	179.3	13.9	0	0	113.8	E767 Y769 W823 N824 I828 C832	E767-Q771 WeakPolarHBondContact O-CG 3.47Å; E767-Q771 PolarHBondContact O-N 3.04Å; Y769-Q771 PolarHBondContact O-N 2.85Å; Q771-W823 PolarHBondContact OE1-O 3.48Å; Q771-N824 PolarHBondContact NE2-OD1 2.82Å; Q771-N824 VanDerWaalsContact OE1-CA 3.25Å; Q771-N824 PolarHBondContact OE1-OD1 2.94Å; Q771-N824 VanDerWaalsContact OE1-OD1 3.12Å; Q771-I828 HydrophobicContact CB-CD1 4.05Å; Q771-C832 PolarHBondContact O-SG 3.34Å; Q771-C832 VanDerWaalsContact O-SG 3.32Å
772	R	87.9	Confident	90.1	Very high	61 Å²	61	39.6 Å²	39.6	23%	0.23	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-36.1	-178.4	-74.6	162.8	-175.9	69.8	6.8	112.8	Y768 Y769 W822 W823 F826 I828	Y768-R772 VanDerWaalsContact CD2-CZ 3.41Å; Y768-R772 PolarHBondContact O-NH1 2.95Å; Y769-R772 PolarHBondContact O-N 3.45Å; R772-W822 PolarHBondContact NH2-O 3.49Å; R772-W823 VanDerWaalsContact CZ-O 3.29Å; R772-W823 PolarHBondContact NH1-O 3.48Å; R772-W823 PolarHBondContact NH2-O 2.9Å; R772-F826 PolarHBondContact NH2-O 3.17Å; R772-I828 HydrophobicContact CG-CD1 4.29Å; R772-I828 HydrophobicContact CG-CG1 3.78Å
773	D	87.8	Confident	90	Very high	32 Å²	32	40.6 Å²	40.6	17%	0.171	21%	0.209	C	C	.	.			trans	-115.4	101.7	169.9	-171.6	-15	0	0	0	110.4	L753 Y769 R775 L776	L753-D773 WeakPolarHBondContact CD1-OD2 3.38Å; L753-D773 WeakPolarHBondContact CD2-OD2 3.48Å; Y769-D773 PolarHBondContact O-N 2.85Å; D773-R775 PolarHBondContact O-N 3.41Å; D773-R775 WeakPolarHBondContact OD1-CB 3.17Å; D773-R775 WeakPolarHBondContact OD1-CG 3.37Å; D773-R775 IonicContact OD1-CZ 2.66Å; D773-R775 PolarHBondContact OD1-N 2.91Å; D773-R775 IonicContact OD1-NE 3.24Å; D773-R775 PolarHBondContact OD1-NE 3.47Å; D773-R775 IonicContact OD1-NH2 3.84Å; D773-R775 IonicContact OD2-CZ 2.92Å; D773-R775 VanDerWaalsContact OD2-CZ 3.25Å; D773-R775 IonicContact OD2-NE 2.65Å; D773-R775 PolarHBondContact OD2-NE 2.61Å; D773-R775 IonicContact OD2-NH2 2.68Å; D773-R775 PolarHBondContact OD2-NH2 2.97Å; D773-L776 HydrophobicContact CB-CD1 3.88Å; D773-L776 HydrophobicContact CB-CG 4.15Å; D773-L776 WeakPolarHBondContact O-CB 3.37Å; D773-L776 PolarHBondContact O-N 3.38Å
774	C	86.9	Confident	89.7	Confident	26 Å²	26	41.4 Å²	41.4	18%	0.176	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-1.5	-178.5	-41.6	0	0	0	0	113.7	R569 C832 L835	R569-C774 PolarHBondContact NE-O 3.24Å; R569-C774 VanDerWaalsContact NE-O 3.15Å; R569-C774 PolarHBondContact NH1-O 3.3Å; R569-C774 PolarHBondContact NH2-O 2.57Å; R569-C774 VanDerWaalsContact NH2-O 3.14Å; C774-C832 WeakPolarHBondContact CA-SG 3.43Å; C774-C832 HydrophobicContact CB-CB 3.92Å; C774-C832 WeakPolarHBondContact CB-SG 3.34Å; C774-C832 WeakPolarHBondContact SG-CA 3.32Å; C774-C832 WeakPolarHBondContact SG-CB 3.49Å; C774-C832 CovalentContact SG-SG 2.04Å; C774-C832 PolarHBondContact SG-SG 3.08Å; C774-L835 HydrophobicContact CB-CD1 3.89Å
775	R	87.8	Confident	89.6	Confident	153 Å²	153	46.8 Å²	46.8	58%	0.577	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-12.6	167.4	-55.9	173.9	-67.2	-179.1	-0.1	112.3	T568 R569 L753 D773	T568-R775 WeakPolarHBondContact CA-O 3.32Å; R569-R775 PolarHBondContact N-O 2.92Å; L753-R775 HydrophobicContact CD2-CB 3.85Å; D773-R775 PolarHBondContact O-N 3.41Å; D773-R775 WeakPolarHBondContact OD1-CB 3.17Å; D773-R775 WeakPolarHBondContact OD1-CG 3.37Å; D773-R775 IonicContact OD1-CZ 2.66Å; D773-R775 PolarHBondContact OD1-N 2.91Å; D773-R775 IonicContact OD1-NE 3.24Å; D773-R775 PolarHBondContact OD1-NE 3.47Å; D773-R775 IonicContact OD1-NH2 3.84Å; D773-R775 IonicContact OD2-CZ 2.92Å; D773-R775 VanDerWaalsContact OD2-CZ 3.25Å; D773-R775 IonicContact OD2-NE 2.65Å; D773-R775 PolarHBondContact OD2-NE 2.61Å; D773-R775 IonicContact OD2-NH2 2.68Å; D773-R775 PolarHBondContact OD2-NH2 2.97Å
776	L	90.5	Very high	89.5	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	159.2	178.1	-58.1	172.4	0	0	0	111.7	L566 F567 R569 I749 V752 L753 A770 D773	L566-L776 HydrophobicContact CD1-CB 3.93Å; L566-L776 HydrophobicContact CD1-CD1 4.12Å; L566-L776 HydrophobicContact CD1-CD2 4.32Å; L566-L776 HydrophobicContact CD1-CG 4.34Å; L566-L776 HydrophobicContact CD2-CD1 4.44Å; L566-L776 HydrophobicContact CD2-CD2 4.45Å; L566-L776 HydrophobicContact CG-CD2 4.34Å; F567-L776 WeakPolarHBondContact O-CA 3.13Å; R569-L776 PolarHBondContact NE-O 3.12Å; R569-L776 PolarHBondContact NH2-O 2.92Å; I749-L776 HydrophobicContact CG2-CD1 3.98Å; V752-L776 HydrophobicContact CB-CD2 4.4Å; V752-L776 HydrophobicContact CG1-CD2 3.7Å; L753-L776 HydrophobicContact CD2-CD2 3.72Å; L753-L776 HydrophobicContact CD2-CG 4.23Å; L753-L776 HydrophobicContact CG-CD2 4.09Å; A770-L776 HydrophobicContact CB-CB 4.36Å; D773-L776 HydrophobicContact CB-CD1 3.88Å; D773-L776 HydrophobicContact CB-CG 4.15Å; D773-L776 WeakPolarHBondContact O-CB 3.37Å; D773-L776 PolarHBondContact O-N 3.38Å
777	T	89.4	Confident	89.6	Confident	38 Å²	38	47.7 Å²	47.7	23%	0.233	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	148.6	169.3	-167.4	0	0	0	0	110.6	F567 V779	F567-T777 PolarHBondContact N-O 3.34Å; F567-T777 PolarHBondContact O-N 3.34Å; T777-V779 HydrophobicContact CG2-CG2 4.15Å
778	Q	89.8	Confident	89.8	Confident	72 Å²	72	44.9 Å²	44.9	34%	0.336	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	144.4	157.3	176.5	169	-14.8	0	0	109.3	S564 I565 G780	S564-Q778 WeakPolarHBondContact OG-CG 3.21Å; S564-Q778 PolarHBondContact OG-NE2 2.68Å; I565-Q778 CarbonylContact O-C 3.56Å; I565-Q778 WeakPolarHBondContact O-CA 3.37Å; Q778-G780 PolarHBondContact NE2-O 3.5Å
779	V	88.8	Confident	90	Very high	8 Å²	8	44.3 Å²	44.3	5%	0.048	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.2	167.4	175.1	0	0	0	0	109.2	I565 F567 I693 T777	I565-V779 HydrophobicContact CB-CB 4.2Å; I565-V779 HydrophobicContact CG2-CB 4.16Å; I565-V779 PolarHBondContact O-N 2.81Å; F567-V779 HydrophobicContact CB-CG2 3.73Å; F567-V779 HydrophobicContact CG-CG2 4.5Å; I693-V779 HydrophobicContact CB-CG1 4.3Å; I693-V779 HydrophobicContact CD1-CB 4.32Å; I693-V779 HydrophobicContact CD1-CG1 4.03Å; I693-V779 HydrophobicContact CD1-CG2 4.14Å; I693-V779 HydrophobicContact CG1-CG1 3.95Å; I693-V779 HydrophobicContact CG1-CG2 4.28Å; I693-V779 VanDerWaalsContact O-CG1 3.23Å; I693-V779 WeakPolarHBondContact O-CG1 3.38Å; T777-V779 HydrophobicContact CG2-CG2 4.15Å
780	G	86.4	Confident	90.3	Very high	33 Å²	33	42.1 Å²	42.1	34%	0.34	23%	0.233	S	C	.	.	S	Bend	trans	70.2	180	172.1	0	0	0	0	0	116	E694 Q778	E694-G780 WeakPolarHBondContact O-CA 3.26Å; Q778-G780 PolarHBondContact NE2-O 3.5Å
781	T	89.5	Confident	90.6	Very high	117 Å²	117	41.3 Å²	41.3	72%	0.718	23%	0.226	S	C	*	.	S	Bend	trans	-73	172.5	173.3	52.7	0	0	0	0	111.7
782	L	91.4	Very high	91	Very high	80 Å²	80	39.3 Å²	39.3	42%	0.419	22%	0.217	S	C	.	.			trans	-66.2	136.4	168.5	-57.6	-179.6	0	0	0	110	G563 S763	G563-L782 CarbonylContact O-C 3.53Å; G563-L782 WeakPolarHBondContact O-CA 3.42Å; S763-L782 VanDerWaalsContact CB-CD2 3.45Å
783	L	90.7	Very high	91.2	Very high	23 Å²	23	37 Å²	37	12%	0.12	21%	0.209	C	C	.	.	S	Bend	trans	-78.9	-23.7	-177.1	-53.9	-175	0	0	0	112.8	G563 I565 A696 F719 F727 I760	G563-L783 WeakPolarHBondContact O-CG 3.39Å; G563-L783 PolarHBondContact O-N 3.46Å; I565-L783 HydrophobicContact CD1-CD2 4.49Å; A696-L783 HydrophobicContact CB-CD2 3.62Å; F719-L783 HydrophobicContact CZ-CD1 4.09Å; F727-L783 HydrophobicContact CE1-CB 4.41Å; F727-L783 WeakPolarHBondContact CE2-O 3.46Å; F727-L783 HydrophobicContact CZ-CB 4.12Å; F727-L783 WeakPolarHBondContact CZ-O 3.38Å; I760-L783 HydrophobicContact CG2-CD1 3.96Å
784	D	89.3	Confident	91.3	Very high	32 Å²	32	41.6 Å²	41.6	17%	0.171	23%	0.23	C	C	.	.	S	Bend	trans	-150.7	179	177.1	56.7	31.3	0	0	0	109.7	G562 G563 F718 K786	G562-D784 WeakPolarHBondContact CA-O 3.12Å; G562-D784 WeakPolarHBondContact CA-OD1 3.17Å; G563-D784 PolarHBondContact N-OD1 3.29Å; F718-D784 HydrophobicContact CE2-CB 4.17Å; F718-D784 HydrophobicContact CZ-CB 4.11Å; D784-K786 WeakPolarHBondContact OD1-CD 3.35Å; D784-K786 IonicContact OD1-NZ 3.65Å; D784-K786 WeakPolarHBondContact OD2-CE 3.3Å; D784-K786 IonicContact OD2-NZ 2.71Å; D784-K786 PolarHBondContact OD2-NZ 3.49Å
785	S	89.9	Confident	91.2	Very high	115 Å²	115	42.7 Å²	42.7	80%	0.804	25%	0.246	S	C	*	.			trans	-118.6	120.4	170.1	-168.3	0	0	0	0	109
786	K	91.1	Very high	91.2	Very high	26 Å²	26	36 Å²	36	11%	0.113	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	166.3	-175.1	-81.2	167.9	170.4	154.5	0	110.2	T543 L561 D784	T543-K786 HydrophobicContact CG2-CB 4.1Å; T543-K786 HydrophobicContact CG2-CD 3.71Å; T543-K786 HydrophobicContact CG2-CG 3.98Å; L561-K786 HydrophobicContact CD1-CB 3.92Å; L561-K786 HydrophobicContact CG-CB 3.86Å; L561-K786 PolarHBondContact N-O 2.87Å; L561-K786 PolarHBondContact O-N 2.86Å; L561-K786 VanDerWaalsContact O-O 3.05Å; D784-K786 WeakPolarHBondContact OD1-CD 3.35Å; D784-K786 IonicContact OD1-NZ 3.65Å; D784-K786 WeakPolarHBondContact OD2-CE 3.3Å; D784-K786 IonicContact OD2-NZ 2.71Å; D784-K786 PolarHBondContact OD2-NZ 3.49Å
787	G	94	Very high	91	Very high	9 Å²	9	38.5 Å²	38.5	9%	0.093	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	150.1	172.8	0	0	0	0	0	111.7	I544 M559	I544-G787 WeakPolarHBondContact CG1-O 3.44Å; I544-G787 PolarHBondContact N-O 3.48Å; M559-G787 VanDerWaalsContact O-CA 3.29Å; M559-G787 WeakPolarHBondContact O-CA 3.31Å
788	Y	95.8	Very high	91.1	Very high	0 Å²	0	38 Å²	38	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	128.9	164.4	-62.9	-41.3	0	0	0	109.6	F462 G541 P557 W558 M559 L561 E762 T764	F462-Y788 HydrophobicContact CE1-CD2 4.07Å; F462-Y788 AromaticContact CE1-CE2 3.61Å; F462-Y788 HydrophobicContact CE1-CE2 3.61Å; F462-Y788 HydrophobicContact CE2-CE2 4.45Å; F462-Y788 HydrophobicContact CZ-CD2 4.32Å; F462-Y788 AromaticContact CZ-CE2 3.42Å; F462-Y788 HydrophobicContact CZ-CE2 3.42Å; F462-Y788 VanDerWaalsContact CZ-CE2 3.42Å; F462-Y788 AromaticContact CZ-CZ 3.87Å; G541-Y788 VanDerWaalsContact O-CE1 3.27Å; G541-Y788 WeakPolarHBondContact O-CE1 3.3Å; P557-Y788 CarbonylContact C-O 3.6Å; P557-Y788 WeakPolarHBondContact CA-O 3.2Å; W558-Y788 AromaticContact CH2-CD2 3.47Å; W558-Y788 HydrophobicContact CH2-CD2 3.47Å; W558-Y788 VanDerWaalsContact CH2-CD2 3.47Å; W558-Y788 HydrophobicContact CH2-CE2 4.38Å; W558-Y788 AromaticContact CH2-CG 3.95Å; W558-Y788 HydrophobicContact CH2-CG 3.95Å; W558-Y788 AromaticContact CZ2-CD2 3.96Å; W558-Y788 HydrophobicContact CZ2-CD2 3.96Å; W558-Y788 AromaticContact CZ2-CG 3.95Å; W558-Y788 HydrophobicContact CZ2-CG 3.95Å; W558-Y788 AromaticContact CZ3-CD2 3.87Å; W558-Y788 HydrophobicContact CZ3-CD2 3.87Å; W558-Y788 PolarHBondContact N-O 3.15Å; W558-Y788 PolarHBondContact NE1-O 2.83Å; M559-Y788 HydrophobicContact CB-CD2 4.24Å; M559-Y788 PolarHBondContact O-N 2.85Å; M559-Y788 HydrophobicContact SD-CD2 4.48Å; L561-Y788 HydrophobicContact CD1-CE1 4.01Å; L561-Y788 HydrophobicContact CD2-CD1 3.68Å; L561-Y788 HydrophobicContact CD2-CD2 3.73Å; L561-Y788 HydrophobicContact CD2-CE1 3.78Å; L561-Y788 HydrophobicContact CD2-CE2 3.83Å; L561-Y788 HydrophobicContact CD2-CG 3.65Å; E762-Y788 WeakPolarHBondContact OE2-CE1 3.17Å; E762-Y788 VanDerWaalsContact OE2-CZ 3.27Å; E762-Y788 PolarHBondContact OE2-OH 3.11Å; T764-Y788 HydrophobicContact CG2-CE2 3.85Å; T764-Y788 PolarHBondContact OG1-OH 2.88Å
789	G	95.4	Very high	91.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.231	C	C	.	.			trans	-116.8	164.2	172.4	0	0	0	0	0	110.9	F542	F542-G789 PolarHBondContact O-N 3.4Å
790	I	96.9	Very high	91.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.254	C	S	.	.			trans	-85.6	125.9	162.2	-67.4	-178.1	0	0	0	106.8	I492 M537 A538 V539 F554 S555 F792 V802 I806	I492-I790 HydrophobicContact CD1-CD1 3.7Å; M537-I790 HydrophobicContact CB-CG2 4.35Å; M537-I790 HydrophobicContact CE-CD1 4.35Å; M537-I790 HydrophobicContact CE-CG2 3.65Å; A538-I790 WeakPolarHBondContact O-CA 3.35Å; V539-I790 HydrophobicContact CG2-CD1 4.15Å; V539-I790 HydrophobicContact CG2-CG1 4.19Å; V539-I790 HydrophobicContact CG2-CG2 4.09Å; F554-I790 CarbonylContact C-O 3.57Å; F554-I790 WeakPolarHBondContact CA-O 3.49Å; S555-I790 PolarHBondContact N-O 3.01Å; S555-I790 PolarHBondContact OG-N 2.86Å; I790-F792 HydrophobicContact CB-CE2 4.17Å; I790-F792 HydrophobicContact CB-CZ 4.34Å; I790-F792 HydrophobicContact CG2-CD2 4.39Å; I790-F792 HydrophobicContact CG2-CE1 4.09Å; I790-F792 HydrophobicContact CG2-CE2 3.65Å; I790-F792 HydrophobicContact CG2-CZ 3.47Å; I790-F792 VanDerWaalsContact CG2-CZ 3.47Å; I790-V802 HydrophobicContact CD1-CG1 3.82Å; I790-I806 HydrophobicContact CD1-CD1 4.23Å
791	G	95.7	Very high	91.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	150.7	178.9	0	0	0	0	0	112	M537 A538 D553	M537-G791 CarbonylContact C-O 3.6Å; M537-G791 VanDerWaalsContact CA-O 3.24Å; M537-G791 WeakPolarHBondContact CA-O 3.42Å; A538-G791 PolarHBondContact N-O 3Å; A538-G791 PolarHBondContact O-N 3.2Å; A538-G791 VanDerWaalsContact O-N 3.09Å; D553-G791 CarbonylContact O-C 3.55Å; D553-G791 WeakPolarHBondContact O-CA 3.29Å
792	F	96.1	Very high	91.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	154.5	178.6	-60.6	-84.7	0	0	0	111.3	M537 V552 D553 I790 W798 R799 V802	M537-F792 HydrophobicContact CB-CD1 3.64Å; M537-F792 HydrophobicContact CB-CE1 3.6Å; M537-F792 HydrophobicContact CE-CE1 4.28Å; M537-F792 HydrophobicContact CE-CZ 4.48Å; M537-F792 HydrophobicContact SD-CE1 4.45Å; V552-F792 WeakPolarHBondContact CB-O 3.5Å; D553-F792 HydrophobicContact CB-CB 4.27Å; D553-F792 PolarHBondContact N-O 3.21Å; D553-F792 PolarHBondContact O-N 3.43Å; I790-F792 HydrophobicContact CB-CE2 4.17Å; I790-F792 HydrophobicContact CB-CZ 4.34Å; I790-F792 HydrophobicContact CG2-CD2 4.39Å; I790-F792 HydrophobicContact CG2-CE1 4.09Å; I790-F792 HydrophobicContact CG2-CE2 3.65Å; I790-F792 HydrophobicContact CG2-CZ 3.47Å; I790-F792 VanDerWaalsContact CG2-CZ 3.47Å; F792-W798 HydrophobicContact CD1-CB 4.08Å; F792-W798 HydrophobicContact CE1-CB 3.62Å; F792-W798 HydrophobicContact CZ-CB 4.39Å; F792-R799 HydrophobicContact CD2-CB 4.01Å; F792-R799 HydrophobicContact CD2-CG 4.13Å; F792-R799 HydrophobicContact CE2-CB 4.2Å; F792-R799 HydrophobicContact CE2-CG 4.34Å; F792-R799 HydrophobicContact CG-CB 4.49Å; F792-V802 HydrophobicContact CE1-CG2 4.41Å; F792-V802 HydrophobicContact CZ-CB 3.83Å; F792-V802 HydrophobicContact CZ-CG1 3.95Å; F792-V802 HydrophobicContact CZ-CG2 3.92Å
793	P	92.6	Very high	92	Very high	11 Å²	11	33.7 Å²	33.7	7%	0.071	20%	0.196	C	C	.	.	S	Bend	trans	-54	146.3	163	-23.8	35.3	0	0	0	111.5	L530 E533 D536 G795 S796	L530-P793 HydrophobicContact CD2-CG 4.47Å; E533-P793 HydrophobicContact CG-CB 4.36Å; D536-P793 WeakPolarHBondContact O-CD 3.45Å; P793-G795 PolarHBondContact O-N 3.15Å; P793-S796 WeakPolarHBondContact O-CB 3.28Å; P793-S796 PolarHBondContact O-N 3.5Å
794	Q	88.8	Confident	92.2	Very high	130 Å²	130	39.4 Å²	39.4	61%	0.607	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	124.1	-172.7	179	163.4	90.4	0	0	112	D553	D553-Q794 WeakPolarHBondContact OD1-CA 3.45Å
795	G	85.4	Confident	92.5	Very high	49 Å²	49	37.9 Å²	37.9	51%	0.505	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	11.1	-176.2	0	0	0	0	0	115.9	D553 P793	D553-G795 PolarHBondContact OD1-N 3.03Å; D553-G795 PolarHBondContact OD2-N 3.22Å; D553-G795 VanDerWaalsContact OD2-N 3.12Å; P793-G795 PolarHBondContact O-N 3.15Å
796	S	87.3	Confident	92.8	Very high	13 Å²	13	32.4 Å²	32.4	9%	0.091	17%	0.173	C	C	.	.			trans	-55	133.8	178.3	176.2	0	0	0	0	113.2	P793 W798 R799	P793-S796 WeakPolarHBondContact O-CB 3.28Å; P793-S796 PolarHBondContact O-N 3.5Å; S796-W798 PolarHBondContact O-N 3.42Å; S796-W798 VanDerWaalsContact O-N 3.13Å; S796-W798 PolarHBondContact OG-N 3.46Å; S796-R799 PolarHBondContact O-N 2.83Å
797	P	87.8	Confident	93	Very high	53 Å²	53	35.4 Å²	35.4	34%	0.344	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-13.4	-178.8	30	-37.1	0	0	0	114	L440 P801	L440-P797 HydrophobicContact CD2-CB 3.75Å; P797-P801 WeakPolarHBondContact O-CD 3.5Å
798	W	89.8	Confident	93.1	Very high	27 Å²	27	39.4 Å²	39.4	10%	0.102	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-20.3	-177.5	-60.3	110.1	0	0	0	113.8	L444 I447 V450 L452 V496 F498 F792 S796 D800 P801 V802	L444-W798 HydrophobicContact CD2-CE3 4.4Å; L444-W798 HydrophobicContact CD2-CH2 4.12Å; L444-W798 HydrophobicContact CD2-CZ3 3.66Å; I447-W798 HydrophobicContact CG2-CH2 4.13Å; V450-W798 HydrophobicContact CG1-CZ2 4.24Å; L452-W798 HydrophobicContact CD1-CD2 3.98Å; L452-W798 HydrophobicContact CD1-CE3 4.35Å; L452-W798 HydrophobicContact CD1-CG 4.25Å; L452-W798 HydrophobicContact CD1-CZ2 4.45Å; L452-W798 HydrophobicContact CD2-CD2 4.45Å; L452-W798 HydrophobicContact CD2-CZ2 3.86Å; V496-W798 HydrophobicContact CG1-CE3 4.2Å; V496-W798 HydrophobicContact CG1-CZ3 4.04Å; F498-W798 HydrophobicContact CB-CH2 4.47Å; F498-W798 HydrophobicContact CB-CZ3 4.42Å; F498-W798 HydrophobicContact CD1-CE3 4.37Å; F498-W798 HydrophobicContact CD1-CZ3 4.26Å; F792-W798 HydrophobicContact CD1-CB 4.08Å; F792-W798 HydrophobicContact CE1-CB 3.62Å; F792-W798 HydrophobicContact CZ-CB 4.39Å; S796-W798 PolarHBondContact O-N 3.42Å; S796-W798 VanDerWaalsContact O-N 3.13Å; S796-W798 PolarHBondContact OG-N 3.46Å; W798-D800 PolarHBondContact O-N 3.26Å; W798-P801 WeakPolarHBondContact O-CD 3.42Å; W798-V802 VanDerWaalsContact O-CB 3.29Å; W798-V802 WeakPolarHBondContact O-CB 3.36Å; W798-V802 VanDerWaalsContact O-CG2 3.24Å; W798-V802 WeakPolarHBondContact O-CG2 3.16Å; W798-V802 PolarHBondContact O-N 3.03Å
799	R	91.9	Very high	93.1	Very high	82 Å²	82	40 Å²	40	31%	0.309	21%	0.208	S	C	.	.	H	α-helix	trans	-55.5	-50.8	-175.9	-173.1	-163	70	-157.8	0.8	113.3	D553 F554 F792 S796 S803	D553-R799 HydrophobicContact CB-CG 4.48Å; D553-R799 WeakPolarHBondContact OD2-CD 3.32Å; D553-R799 IonicContact OD2-CZ 2.64Å; D553-R799 IonicContact OD2-NE 3.18Å; D553-R799 IonicContact OD2-NH1 2.72Å; D553-R799 PolarHBondContact OD2-NH1 3.2Å; F554-R799 WeakPolarHBondContact O-CG 3.5Å; F792-R799 HydrophobicContact CD2-CB 4.01Å; F792-R799 HydrophobicContact CD2-CG 4.13Å; F792-R799 HydrophobicContact CE2-CB 4.2Å; F792-R799 HydrophobicContact CE2-CG 4.34Å; F792-R799 HydrophobicContact CG-CB 4.49Å; S796-R799 PolarHBondContact O-N 2.83Å; R799-S803 VanDerWaalsContact O-CB 3.28Å; R799-S803 WeakPolarHBondContact O-CB 3.25Å; R799-S803 PolarHBondContact O-N 3.11Å; R799-S803 PolarHBondContact O-OG 2.97Å
800	D	91.4	Very high	93.1	Very high	97 Å²	97	45.3 Å²	45.3	52%	0.519	23%	0.233	S	C	.	.	H	α-helix	trans	-73.2	-44.4	-175.7	-65	0.6	0	0	0	112.4	W798 S803 K804	W798-D800 PolarHBondContact O-N 3.26Å; D800-S803 PolarHBondContact O-N 2.97Å; D800-K804 WeakPolarHBondContact O-CB 3.37Å; D800-K804 PolarHBondContact O-N 3Å
801	P	92.4	Very high	92.9	Very high	27 Å²	27	52.1 Å²	52.1	18%	0.175	27%	0.27	C	S	.	.	H	α-helix	trans	-57.2	-46	170.4	-26.9	34.8	0	0	0	114	L444 V496 P797 W798 K804 S805	L444-P801 HydrophobicContact CD1-CB 4.46Å; L444-P801 HydrophobicContact CD1-CG 3.85Å; V496-P801 HydrophobicContact CG1-CB 3.98Å; V496-P801 HydrophobicContact CG2-CB 4.41Å; P797-P801 WeakPolarHBondContact O-CD 3.5Å; W798-P801 WeakPolarHBondContact O-CD 3.42Å; P801-K804 PolarHBondContact O-N 3.02Å; P801-S805 PolarHBondContact O-N 2.68Å
802	V	94.4	Very high	92.9	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-66.6	-43.7	179.8	169.6	0	0	0	0	111.1	I492 F498 I790 F792 W798 K804 S805 I806	I492-V802 HydrophobicContact CD1-CG1 4.25Å; I492-V802 HydrophobicContact CG2-CB 4.35Å; I492-V802 HydrophobicContact CG2-CG1 4.03Å; I492-V802 HydrophobicContact CG2-CG2 3.9Å; F498-V802 HydrophobicContact CE1-CG2 4.24Å; I790-V802 HydrophobicContact CD1-CG1 3.82Å; F792-V802 HydrophobicContact CE1-CG2 4.41Å; F792-V802 HydrophobicContact CZ-CB 3.83Å; F792-V802 HydrophobicContact CZ-CG1 3.95Å; F792-V802 HydrophobicContact CZ-CG2 3.92Å; W798-V802 VanDerWaalsContact O-CB 3.29Å; W798-V802 WeakPolarHBondContact O-CB 3.36Å; W798-V802 VanDerWaalsContact O-CG2 3.24Å; W798-V802 WeakPolarHBondContact O-CG2 3.16Å; W798-V802 PolarHBondContact O-N 3.03Å; V802-K804 VanDerWaalsContact C-N 3.34Å; V802-K804 PolarHBondContact O-N 3.23Å; V802-S805 WeakPolarHBondContact O-CA 3.4Å; V802-S805 VanDerWaalsContact O-CB 3.3Å; V802-S805 WeakPolarHBondContact O-CB 3.17Å; V802-S805 PolarHBondContact O-N 2.9Å; V802-I806 HydrophobicContact CG1-CD1 4Å; V802-I806 HydrophobicContact CG1-CG1 4.5Å; V802-I806 WeakPolarHBondContact O-CG1 3.13Å; V802-I806 PolarHBondContact O-N 3Å
803	S	95.2	Very high	92.8	Very high	13 Å²	13	62.1 Å²	62.1	9%	0.091	33%	0.327	C	S	.	.	H	α-helix	trans	-60.1	-43.3	175.2	-60.2	0	0	0	0	112	S555 T556 R799 D800 S805 I806 L807	S555-S803 VanDerWaalsContact CA-OG 3.27Å; S555-S803 WeakPolarHBondContact CA-OG 3.31Å; S555-S803 WeakPolarHBondContact CB-OG 3.11Å; T556-S803 PolarHBondContact N-OG 3.03Å; T556-S803 VanDerWaalsContact N-OG 3.13Å; T556-S803 WeakPolarHBondContact OG1-CA 3.47Å; T556-S803 WeakPolarHBondContact OG1-CB 3.26Å; T556-S803 PolarHBondContact OG1-O 2.92Å; R799-S803 VanDerWaalsContact O-CB 3.28Å; R799-S803 WeakPolarHBondContact O-CB 3.25Å; R799-S803 PolarHBondContact O-N 3.11Å; R799-S803 PolarHBondContact O-OG 2.97Å; D800-S803 PolarHBondContact O-N 2.97Å; S803-S805 PolarHBondContact O-N 3.17Å; S803-I806 PolarHBondContact O-N 3.42Å; S803-L807 WeakPolarHBondContact O-CG 3.27Å; S803-L807 PolarHBondContact O-N 2.81Å
804	K	94.5	Very high	93	Very high	143 Å²	143	63.8 Å²	63.8	62%	0.622	34%	0.335	S	S	*	.	H	α-helix	trans	-61.6	-32.6	173.7	-172.8	176.2	-177.1	177.9	0	112.3	D800 P801 V802 K808	D800-K804 WeakPolarHBondContact O-CB 3.37Å; D800-K804 PolarHBondContact O-N 3Å; P801-K804 PolarHBondContact O-N 3.02Å; V802-K804 VanDerWaalsContact C-N 3.34Å; V802-K804 PolarHBondContact O-N 3.23Å; K804-K808 WeakPolarHBondContact O-CG 3.33Å; K804-K808 PolarHBondContact O-N 2.96Å
805	S	95.2	Very high	93.2	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-70.7	-48.1	174.5	-158.6	0	0	0	0	111.9	D495 P801 V802 S803 L807 K808 L809	D495-S805 WeakPolarHBondContact CB-OG 3.12Å; D495-S805 VanDerWaalsContact OD2-CB 3.31Å; D495-S805 WeakPolarHBondContact OD2-CB 3.27Å; D495-S805 PolarHBondContact OD2-OG 2.96Å; P801-S805 PolarHBondContact O-N 2.68Å; V802-S805 WeakPolarHBondContact O-CA 3.4Å; V802-S805 VanDerWaalsContact O-CB 3.3Å; V802-S805 WeakPolarHBondContact O-CB 3.17Å; V802-S805 PolarHBondContact O-N 2.9Å; S803-S805 PolarHBondContact O-N 3.17Å; S805-L807 VanDerWaalsContact C-N 3.28Å; S805-L807 PolarHBondContact O-N 3.31Å; S805-K808 WeakPolarHBondContact O-CA 3.31Å; S805-K808 WeakPolarHBondContact O-CB 3.37Å; S805-K808 PolarHBondContact O-N 3.43Å; S805-L809 WeakPolarHBondContact O-CG 3.45Å; S805-L809 PolarHBondContact O-N 2.65Å
806	I	96.3	Very high	93.6	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-53.3	-45.4	175	-69.6	166	0	0	0	111	I492 S555 W558 I790 V802 S803 K808 L809 Q810 L815	I492-I806 HydrophobicContact CD1-CD1 4.38Å; I492-I806 HydrophobicContact CD1-CG1 3.83Å; S555-I806 WeakPolarHBondContact OG-CD1 3.25Å; W558-I806 HydrophobicContact CB-CD1 4.33Å; W558-I806 HydrophobicContact CB-CG1 4.44Å; W558-I806 HydrophobicContact CB-CG2 3.82Å; I790-I806 HydrophobicContact CD1-CD1 4.23Å; V802-I806 HydrophobicContact CG1-CD1 4Å; V802-I806 HydrophobicContact CG1-CG1 4.5Å; V802-I806 WeakPolarHBondContact O-CG1 3.13Å; V802-I806 PolarHBondContact O-N 3Å; S803-I806 PolarHBondContact O-N 3.42Å; I806-K808 VanDerWaalsContact C-N 3.34Å; I806-K808 PolarHBondContact O-N 3.17Å; I806-L809 PolarHBondContact O-N 3.34Å; I806-L809 VanDerWaalsContact O-N 3.14Å; I806-Q810 WeakPolarHBondContact O-CB 3.47Å; I806-Q810 PolarHBondContact O-N 3.42Å; I806-L815 HydrophobicContact CG2-CD1 4.28Å
807	L	95.6	Very high	94	Very high	89 Å²	89	65.1 Å²	65.1	47%	0.466	34%	0.336	S	S	.	.	H	α-helix	trans	-62.8	-34.2	176.7	-68.2	172	0	0	0	113.2	T556 S803 S805 N811	T556-L807 HydrophobicContact CG2-CD1 4.33Å; T556-L807 HydrophobicContact CG2-CG 4.42Å; S803-L807 WeakPolarHBondContact O-CG 3.27Å; S803-L807 PolarHBondContact O-N 2.81Å; S805-L807 VanDerWaalsContact C-N 3.28Å; S805-L807 PolarHBondContact O-N 3.31Å; L807-N811 WeakPolarHBondContact O-CB 3.37Å; L807-N811 PolarHBondContact O-N 3.4Å
808	K	95.9	Very high	94.4	Very high	93 Å²	93	63 Å²	63	40%	0.404	32%	0.321	S	S	.	.	H	α-helix	trans	-65.6	-46.4	170.3	-66.7	168.2	-174.6	168.1	0	111.2	D495 K804 S805 I806 Q810 N811 A812	D495-K808 IonicContact OD1-NZ 3.55Å; D495-K808 PolarHBondContact OD1-NZ 3.16Å; D495-K808 WeakPolarHBondContact OD2-CD 3.47Å; D495-K808 IonicContact OD2-NZ 2.68Å; D495-K808 PolarHBondContact OD2-NZ 3.14Å; K804-K808 WeakPolarHBondContact O-CG 3.33Å; K804-K808 PolarHBondContact O-N 2.96Å; S805-K808 WeakPolarHBondContact O-CA 3.31Å; S805-K808 WeakPolarHBondContact O-CB 3.37Å; S805-K808 PolarHBondContact O-N 3.43Å; I806-K808 VanDerWaalsContact C-N 3.34Å; I806-K808 PolarHBondContact O-N 3.17Å; K808-Q810 VanDerWaalsContact C-N 3.27Å; K808-Q810 PolarHBondContact O-N 2.94Å; K808-N811 PolarHBondContact O-N 3.29Å; K808-A812 VanDerWaalsContact O-CB 3.29Å; K808-A812 WeakPolarHBondContact O-CB 3.49Å; K808-A812 PolarHBondContact O-N 2.77Å
809	L	96.3	Very high	94.6	Very high	12 Å²	12	64.6 Å²	64.6	6%	0.063	33%	0.329	C	S	.	.	H	α-helix	trans	-64.6	-33.2	-178.9	-60.8	178.2	0	0	0	111.8	L488 H491 I492 S805 I806 Q813 I814 L815	L488-L809 HydrophobicContact CD1-CD1 3.92Å; H491-L809 HydrophobicContact CB-CD1 3.79Å; H491-L809 HydrophobicContact CB-CD2 3.91Å; I492-L809 HydrophobicContact CG1-CD1 3.84Å; S805-L809 WeakPolarHBondContact O-CG 3.45Å; S805-L809 PolarHBondContact O-N 2.65Å; I806-L809 PolarHBondContact O-N 3.34Å; I806-L809 VanDerWaalsContact O-N 3.14Å; L809-Q813 PolarHBondContact O-N 2.98Å; L809-I814 HydrophobicContact CB-CB 4.39Å; L809-I814 HydrophobicContact CD2-CB 4.33Å; L809-I814 HydrophobicContact CD2-CD1 3.73Å; L809-I814 HydrophobicContact CD2-CG2 4.29Å; L809-I814 PolarHBondContact O-N 2.81Å; L809-L815 HydrophobicContact CB-CD1 4.45Å; L809-L815 HydrophobicContact CB-CD2 3.8Å; L809-L815 HydrophobicContact CB-CG 3.87Å; L809-L815 HydrophobicContact CD1-CD2 4.28Å; L809-L815 PolarHBondContact O-N 2.97Å
810	Q	94.7	Very high	94.6	Very high	112 Å²	112	68.1 Å²	68.1	52%	0.523	34%	0.342	S	S	.	.	H	α-helix	trans	-67.3	-50	172.2	-168.4	178.9	7.2	0	0	111.4	I806 K808 A812 Q813 L815	I806-Q810 WeakPolarHBondContact O-CB 3.47Å; I806-Q810 PolarHBondContact O-N 3.42Å; K808-Q810 VanDerWaalsContact C-N 3.27Å; K808-Q810 PolarHBondContact O-N 2.94Å; Q810-A812 VanDerWaalsContact C-N 3.31Å; Q810-A812 PolarHBondContact O-N 3.41Å; Q810-Q813 PolarHBondContact O-N 3.27Å; Q810-L815 HydrophobicContact CB-CD1 3.8Å; Q810-L815 HydrophobicContact CG-CD1 4.39Å
811	N	94.6	Very high	94.7	Very high	144 Å²	144	66 Å²	66	77%	0.77	33%	0.33	S	S	*	.	H	α-helix	trans	-62.8	-36.2	178.6	-169.2	30.8	0	0	0	112.4	L807 K808 Q813	L807-N811 WeakPolarHBondContact O-CB 3.37Å; L807-N811 PolarHBondContact O-N 3.4Å; K808-N811 PolarHBondContact O-N 3.29Å; N811-Q813 PolarHBondContact O-N 3Å
812	A	95.1	Very high	94.8	Very high	62 Å²	62	65.5 Å²	65.5	51%	0.512	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	3.9	174	0	0	0	0	0	114	K808 Q810 I814	K808-A812 VanDerWaalsContact O-CB 3.29Å; K808-A812 WeakPolarHBondContact O-CB 3.49Å; K808-A812 PolarHBondContact O-N 2.77Å; Q810-A812 VanDerWaalsContact C-N 3.31Å; Q810-A812 PolarHBondContact O-N 3.41Å; A812-I814 HydrophobicContact CB-CD1 3.89Å; A812-I814 HydrophobicContact CB-CG1 4Å; A812-I814 PolarHBondContact O-N 3.41Å
813	Q	93.8	Very high	94.7	Very high	148 Å²	148	65.5 Å²	65.5	69%	0.692	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	13	-177.2	-57	-175.2	-10.8	0	0	115.5	L809 Q810 N811 L815 A816 K817	L809-Q813 PolarHBondContact O-N 2.98Å; Q810-Q813 PolarHBondContact O-N 3.27Å; N811-Q813 PolarHBondContact O-N 3Å; Q813-L815 VanDerWaalsContact C-N 3.33Å; Q813-L815 PolarHBondContact O-N 3.08Å; Q813-A816 PolarHBondContact O-N 3.09Å; Q813-K817 PolarHBondContact O-N 3.12Å; Q813-K817 VanDerWaalsContact O-N 3.08Å
814	I	95.7	Very high	94.3	Very high	45 Å²	45	68.4 Å²	68.4	23%	0.231	34%	0.34	C	S	.	.	H	α-helix	trans	-62.8	-41.6	-179.7	-66.5	169.6	0	0	0	110.3	L809 A812 A816 K817 L818	L809-I814 HydrophobicContact CB-CB 4.39Å; L809-I814 HydrophobicContact CD2-CB 4.33Å; L809-I814 HydrophobicContact CD2-CD1 3.73Å; L809-I814 HydrophobicContact CD2-CG2 4.29Å; L809-I814 PolarHBondContact O-N 2.81Å; A812-I814 HydrophobicContact CB-CD1 3.89Å; A812-I814 HydrophobicContact CB-CG1 4Å; A812-I814 PolarHBondContact O-N 3.41Å; I814-A816 PolarHBondContact O-N 3.47Å; I814-K817 WeakPolarHBondContact O-CB 3.48Å; I814-K817 PolarHBondContact O-N 2.8Å; I814-K817 VanDerWaalsContact O-N 3.14Å; I814-L818 HydrophobicContact CG2-CD1 4.12Å; I814-L818 HydrophobicContact CG2-CG 4.2Å; I814-L818 WeakPolarHBondContact O-CG 3.42Å; I814-L818 PolarHBondContact O-N 3.27Å
815	L	94.8	Very high	94	Very high	14 Å²	14	66 Å²	66	7%	0.073	33%	0.331	C	S	.	.	H	α-helix	trans	-59.2	-35.4	178	-57.9	-178.4	0	0	0	112.7	Y484 L488 W558 I806 L809 Q810 Q813 K819	Y484-L815 PolarHBondContact OH-O 3.32Å; L488-L815 HydrophobicContact CD1-CD2 3.51Å; W558-L815 HydrophobicContact CB-CD1 4.48Å; I806-L815 HydrophobicContact CG2-CD1 4.28Å; L809-L815 HydrophobicContact CB-CD1 4.45Å; L809-L815 HydrophobicContact CB-CD2 3.8Å; L809-L815 HydrophobicContact CB-CG 3.87Å; L809-L815 HydrophobicContact CD1-CD2 4.28Å; L809-L815 PolarHBondContact O-N 2.97Å; Q810-L815 HydrophobicContact CB-CD1 3.8Å; Q810-L815 HydrophobicContact CG-CD1 4.39Å; Q813-L815 VanDerWaalsContact C-N 3.33Å; Q813-L815 PolarHBondContact O-N 3.08Å; L815-K819 PolarHBondContact O-N 3.46Å
816	A	93.7	Very high	93.6	Very high	64 Å²	64	68.1 Å²	68.1	53%	0.529	34%	0.34	S	S	.	.	H	α-helix	trans	-74.5	-39.7	176.9	0	0	0	0	0	111.9	Q813 I814 K819 R820	Q813-A816 PolarHBondContact O-N 3.09Å; I814-A816 PolarHBondContact O-N 3.47Å; A816-K819 PolarHBondContact O-N 3.38Å; A816-R820 PolarHBondContact O-N 2.9Å
817	K	95.4	Very high	92.9	Very high	143 Å²	143	72.6 Å²	72.6	62%	0.622	36%	0.364	S	S	*	.	H	α-helix	trans	-59.9	-48	172	-173.9	-170.9	176	-169.7	0	111.2	Q813 I814 K819 R820 I821	Q813-K817 PolarHBondContact O-N 3.12Å; Q813-K817 VanDerWaalsContact O-N 3.08Å; I814-K817 WeakPolarHBondContact O-CB 3.48Å; I814-K817 PolarHBondContact O-N 2.8Å; I814-K817 VanDerWaalsContact O-N 3.14Å; K817-K819 VanDerWaalsContact C-N 3.31Å; K817-K819 PolarHBondContact O-N 3.08Å; K817-R820 PolarHBondContact O-N 3.46Å; K817-I821 HydrophobicContact CG-CD1 4.18Å; K817-I821 WeakPolarHBondContact O-CG1 3.46Å; K817-I821 PolarHBondContact O-N 2.96Å; K817-I821 VanDerWaalsContact O-N 3.1Å
818	L	95.4	Very high	92.2	Very high	9 Å²	9	69.9 Å²	69.9	5%	0.047	35%	0.349	C	S	.	.	H	α-helix	trans	-61.2	-39.6	176.8	-67.3	-179.9	0	0	0	111.6	Y484 D487 I814 I821 W822	Y484-L818 HydrophobicContact CD2-CB 3.78Å; Y484-L818 HydrophobicContact CE2-CB 3.42Å; Y484-L818 VanDerWaalsContact CE2-CB 3.42Å; D487-L818 HydrophobicContact CB-CD1 4.01Å; D487-L818 HydrophobicContact CB-CD2 3.66Å; D487-L818 HydrophobicContact CB-CG 4.46Å; I814-L818 HydrophobicContact CG2-CD1 4.12Å; I814-L818 HydrophobicContact CG2-CG 4.2Å; I814-L818 WeakPolarHBondContact O-CG 3.42Å; I814-L818 PolarHBondContact O-N 3.27Å; L818-I821 PolarHBondContact O-N 3.17Å; L818-W822 VanDerWaalsContact O-CD1 3.32Å; L818-W822 PolarHBondContact O-N 3.47Å
819	K	94.2	Very high	91	Very high	59 Å²	59	71.9 Å²	71.9	26%	0.257	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-46.6	178.3	-167	-162.8	-178.1	-156.7	0	110.2	Y484 M559 E767 L815 A816 K817 I821 W822 W823	Y484-K819 HydrophobicContact CE2-CB 4.24Å; M559-K819 HydrophobicContact CE-CB 4.18Å; M559-K819 HydrophobicContact CE-CD 4.22Å; M559-K819 HydrophobicContact CE-CG 3.83Å; E767-K819 WeakPolarHBondContact OE1-CE 3.28Å; E767-K819 IonicContact OE1-NZ 2.69Å; E767-K819 PolarHBondContact OE1-NZ 3.3Å; E767-K819 WeakPolarHBondContact OE2-CE 3.37Å; E767-K819 IonicContact OE2-NZ 3.89Å; E767-K819 PolarHBondContact OE2-NZ 3.14Å; L815-K819 PolarHBondContact O-N 3.46Å; A816-K819 PolarHBondContact O-N 3.38Å; K817-K819 VanDerWaalsContact C-N 3.31Å; K817-K819 PolarHBondContact O-N 3.08Å; K819-I821 VanDerWaalsContact C-N 3.32Å; K819-I821 PolarHBondContact O-N 3.38Å; K819-W822 PolarHBondContact O-N 3.42Å; K819-W823 HydrophobicContact CB-CE3 4.43Å; K819-W823 HydrophobicContact CG-CD2 3.95Å; K819-W823 HydrophobicContact CG-CE3 3.69Å; K819-W823 HydrophobicContact CG-CG 4.39Å; K819-W823 HydrophobicContact CG-CZ3 4.2Å; K819-W823 WeakPolarHBondContact O-CB 3.45Å; K819-W823 PolarHBondContact O-N 3.47Å
820	R	92.7	Very high	89.8	Confident	157 Å²	157	77.9 Å²	77.9	59%	0.592	40%	0.397	S	S	*	.	H	α-helix	trans	-54.6	-46.8	176.6	173.5	179.4	161	143.7	6.5	111.8	A816 K817 N824 E825	A816-R820 PolarHBondContact O-N 2.9Å; K817-R820 PolarHBondContact O-N 3.46Å; R820-N824 WeakPolarHBondContact O-CA 3.43Å; R820-N824 VanDerWaalsContact O-CB 3.28Å; R820-N824 WeakPolarHBondContact O-CB 3.17Å; R820-N824 PolarHBondContact O-N 3.42Å; R820-E825 IonicContact CZ-OE1 2.62Å; R820-E825 IonicContact NE-OE1 3.04Å; R820-E825 PolarHBondContact NE-OE1 3.29Å; R820-E825 IonicContact NH2-OE1 3.36Å; R820-E825 PolarHBondContact NH2-OE1 2.58Å; R820-E825 PolarHBondContact O-N 3.25Å
821	I	93.6	Very high	88.7	Confident	52 Å²	52	75 Å²	75	27%	0.267	39%	0.388	S	S	.	.	I	π-helix	trans	-60.7	-57.6	179	-66.8	163	0	0	0	110.4	K817 L818 K819 W823 E825 F826	K817-I821 HydrophobicContact CG-CD1 4.18Å; K817-I821 WeakPolarHBondContact O-CG1 3.46Å; K817-I821 PolarHBondContact O-N 2.96Å; K817-I821 VanDerWaalsContact O-N 3.1Å; L818-I821 PolarHBondContact O-N 3.17Å; K819-I821 VanDerWaalsContact C-N 3.32Å; K819-I821 PolarHBondContact O-N 3.38Å; I821-W823 PolarHBondContact O-N 2.85Å; I821-E825 PolarHBondContact O-N 3.22Å; I821-E825 VanDerWaalsContact O-N 3.15Å; I821-F826 WeakPolarHBondContact O-CB 3.48Å; I821-F826 PolarHBondContact O-N 2.76Å
822	W	94	Very high	87.8	Confident	16 Å²	16	68.7 Å²	68.7	6%	0.061	36%	0.355	C	S	.	.	I	π-helix	trans	-74.2	-25.9	-169.8	-75.9	103.4	0	0	0	114.8	P461 I464 M482 G483 Y484 D487 R772 L818 K819 F826	P461-W822 HydrophobicContact CB-CB 4.31Å; P461-W822 HydrophobicContact CB-CE3 4.48Å; I464-W822 HydrophobicContact CD1-CZ3 4.41Å; M482-W822 HydrophobicContact CB-CH2 3.94Å; M482-W822 HydrophobicContact CG-CH2 4.11Å; M482-W822 HydrophobicContact SD-CH2 4.31Å; G483-W822 VanDerWaalsContact C-CE2 3.43Å; G483-W822 VanDerWaalsContact CA-CH2 3.49Å; G483-W822 VanDerWaalsContact N-CH2 3.25Å; Y484-W822 HydrophobicContact CD2-CB 4.29Å; Y484-W822 AromaticContact CD2-CD1 3.97Å; Y484-W822 HydrophobicContact CD2-CG 4.38Å; D487-W822 PolarHBondContact OD2-NE1 2.99Å; R772-W822 PolarHBondContact NH2-O 3.49Å; L818-W822 VanDerWaalsContact O-CD1 3.32Å; L818-W822 PolarHBondContact O-N 3.47Å; K819-W822 PolarHBondContact O-N 3.42Å; W822-F826 HydrophobicContact CE3-CB 4.1Å; W822-F826 AromaticContact CE3-CD1 3.96Å; W822-F826 HydrophobicContact CE3-CD1 3.96Å; W822-F826 HydrophobicContact CE3-CD2 4.04Å; W822-F826 HydrophobicContact CE3-CE1 4.45Å; W822-F826 AromaticContact CE3-CG 3.75Å; W822-F826 HydrophobicContact CE3-CG 3.75Å; W822-F826 HydrophobicContact CH2-CD2 4.1Å; W822-F826 HydrophobicContact CH2-CE2 4.14Å; W822-F826 HydrophobicContact CZ3-CB 4.4Å; W822-F826 AromaticContact CZ3-CD1 3.9Å; W822-F826 HydrophobicContact CZ3-CD1 3.9Å; W822-F826 AromaticContact CZ3-CD2 3.48Å; W822-F826 HydrophobicContact CZ3-CD2 3.48Å; W822-F826 VanDerWaalsContact CZ3-CD2 3.48Å; W822-F826 HydrophobicContact CZ3-CE1 4.02Å; W822-F826 AromaticContact CZ3-CE2 3.61Å; W822-F826 HydrophobicContact CZ3-CE2 3.61Å; W822-F826 AromaticContact CZ3-CG 3.64Å; W822-F826 HydrophobicContact CZ3-CG 3.64Å; W822-F826 AromaticContact CZ3-CZ 3.88Å; W822-F826 HydrophobicContact CZ3-CZ 3.88Å
823	W	92.1	Very high	86.5	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	35%	0.351	C	S	.	.	I	π-helix	trans	-88.9	-56.2	173.4	-82.3	-108.9	0	0	0	111.5	P461 F462 Y484 M559 T764 Q771 R772 K819 I821 I828	P461-W823 HydrophobicContact CG-CD2 4.24Å; P461-W823 HydrophobicContact CG-CE3 4.2Å; P461-W823 HydrophobicContact CG-CH2 3.6Å; P461-W823 HydrophobicContact CG-CZ2 3.63Å; P461-W823 HydrophobicContact CG-CZ3 3.89Å; F462-W823 HydrophobicContact CD1-CH2 4.28Å; F462-W823 AromaticContact CE1-CH2 3.67Å; F462-W823 HydrophobicContact CE1-CH2 3.67Å; F462-W823 HydrophobicContact CE1-CZ2 4.04Å; F462-W823 HydrophobicContact CZ-CH2 4.16Å; F462-W823 HydrophobicContact CZ-CZ2 4.06Å; Y484-W823 HydrophobicContact CD2-CE3 4.44Å; Y484-W823 HydrophobicContact CD2-CH2 4.44Å; Y484-W823 AromaticContact CD2-CZ3 3.59Å; Y484-W823 HydrophobicContact CD2-CZ3 3.59Å; Y484-W823 HydrophobicContact CE2-CZ3 4.26Å; Y484-W823 HydrophobicContact CG-CH2 4.36Å; Y484-W823 AromaticContact CG-CZ3 3.85Å; Y484-W823 HydrophobicContact CG-CZ3 3.85Å; M559-W823 HydrophobicContact CE-CH2 3.92Å; M559-W823 HydrophobicContact CE-CZ3 4.09Å; M559-W823 HydrophobicContact SD-CH2 4.12Å; M559-W823 HydrophobicContact SD-CZ2 4.23Å; T764-W823 HydrophobicContact CG2-CZ2 4.5Å; T764-W823 PolarHBondContact O-NE1 3.11Å; Q771-W823 PolarHBondContact OE1-O 3.48Å; R772-W823 VanDerWaalsContact CZ-O 3.29Å; R772-W823 PolarHBondContact NH1-O 3.48Å; R772-W823 PolarHBondContact NH2-O 2.9Å; K819-W823 HydrophobicContact CB-CE3 4.43Å; K819-W823 HydrophobicContact CG-CD2 3.95Å; K819-W823 HydrophobicContact CG-CE3 3.69Å; K819-W823 HydrophobicContact CG-CG 4.39Å; K819-W823 HydrophobicContact CG-CZ3 4.2Å; K819-W823 WeakPolarHBondContact O-CB 3.45Å; K819-W823 PolarHBondContact O-N 3.47Å; I821-W823 PolarHBondContact O-N 2.85Å; W823-I828 VanDerWaalsContact O-CD1 3.29Å; W823-I828 WeakPolarHBondContact O-CD1 3.44Å
824	N	87.7	Confident	84.9	Confident	75 Å²	75	66.1 Å²	66.1	40%	0.401	34%	0.342	S	S	.	.	I	π-helix	trans	-95.8	-18	-162.1	-52.3	6.3	0	0	0	114.8	Q771 R820	Q771-N824 PolarHBondContact NE2-OD1 2.82Å; Q771-N824 VanDerWaalsContact OE1-CA 3.25Å; Q771-N824 PolarHBondContact OE1-OD1 2.94Å; Q771-N824 VanDerWaalsContact OE1-OD1 3.12Å; R820-N824 WeakPolarHBondContact O-CA 3.43Å; R820-N824 VanDerWaalsContact O-CB 3.28Å; R820-N824 WeakPolarHBondContact O-CB 3.17Å; R820-N824 PolarHBondContact O-N 3.42Å
825	E	87.3	Confident	83.2	Confident	93 Å²	93	68.1 Å²	68.1	44%	0.435	35%	0.353	S	S	.	.	I	π-helix	trans	-119.3	-33.3	-171.3	-60	174.4	163.4	0	0	112.3	R820 I821 N827	R820-E825 IonicContact CZ-OE1 2.62Å; R820-E825 IonicContact NE-OE1 3.04Å; R820-E825 PolarHBondContact NE-OE1 3.29Å; R820-E825 IonicContact NH2-OE1 3.36Å; R820-E825 PolarHBondContact NH2-OE1 2.58Å; R820-E825 PolarHBondContact O-N 3.25Å; I821-E825 PolarHBondContact O-N 3.22Å; I821-E825 VanDerWaalsContact O-N 3.15Å; E825-N827 PolarHBondContact O-N 3.5Å
826	F	86.5	Confident	81.5	Confident	44 Å²	44	76 Å²	76	19%	0.193	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	123.2	-179.8	177.4	-100	0	0	0	113.2	I464 M482 R772 I821 W822 I828	I464-F826 HydrophobicContact CD1-CE1 3.78Å; I464-F826 HydrophobicContact CD1-CZ 3.94Å; M482-F826 HydrophobicContact CE-CE2 4.19Å; M482-F826 HydrophobicContact CE-CZ 3.84Å; M482-F826 HydrophobicContact SD-CE2 4.09Å; M482-F826 HydrophobicContact SD-CZ 4.29Å; R772-F826 PolarHBondContact NH2-O 3.17Å; I821-F826 WeakPolarHBondContact O-CB 3.48Å; I821-F826 PolarHBondContact O-N 2.76Å; W822-F826 HydrophobicContact CE3-CB 4.1Å; W822-F826 AromaticContact CE3-CD1 3.96Å; W822-F826 HydrophobicContact CE3-CD1 3.96Å; W822-F826 HydrophobicContact CE3-CD2 4.04Å; W822-F826 HydrophobicContact CE3-CE1 4.45Å; W822-F826 AromaticContact CE3-CG 3.75Å; W822-F826 HydrophobicContact CE3-CG 3.75Å; W822-F826 HydrophobicContact CH2-CD2 4.1Å; W822-F826 HydrophobicContact CH2-CE2 4.14Å; W822-F826 HydrophobicContact CZ3-CB 4.4Å; W822-F826 AromaticContact CZ3-CD1 3.9Å; W822-F826 HydrophobicContact CZ3-CD1 3.9Å; W822-F826 AromaticContact CZ3-CD2 3.48Å; W822-F826 HydrophobicContact CZ3-CD2 3.48Å; W822-F826 VanDerWaalsContact CZ3-CD2 3.48Å; W822-F826 HydrophobicContact CZ3-CE1 4.02Å; W822-F826 AromaticContact CZ3-CE2 3.61Å; W822-F826 HydrophobicContact CZ3-CE2 3.61Å; W822-F826 AromaticContact CZ3-CG 3.64Å; W822-F826 HydrophobicContact CZ3-CG 3.64Å; W822-F826 AromaticContact CZ3-CZ 3.88Å; W822-F826 HydrophobicContact CZ3-CZ 3.88Å; F826-I828 VanDerWaalsContact C-N 3.34Å; F826-I828 PolarHBondContact O-N 3.12Å
827	N	81.7	Confident	79.6	Confident	93 Å²	93	78.1 Å²	78.1	50%	0.497	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	47.7	176.3	-165.8	45.6	0	0	0	114.3	E825 Y989	E825-N827 PolarHBondContact O-N 3.5Å; N827-Y989 PolarHBondContact ND2-OH 2.73Å
828	I	80.1	Confident	77.5	Confident	32 Å²	32	75 Å²	75	16%	0.164	38%	0.377	C	S	.	.			trans	-126.1	110	169.8	-71.1	167.9	0	0	0	107	Q771 R772 W823 F826 P831	Q771-I828 HydrophobicContact CB-CD1 4.05Å; R772-I828 HydrophobicContact CG-CD1 4.29Å; R772-I828 HydrophobicContact CG-CG1 3.78Å; W823-I828 VanDerWaalsContact O-CD1 3.29Å; W823-I828 WeakPolarHBondContact O-CD1 3.44Å; F826-I828 VanDerWaalsContact C-N 3.34Å; F826-I828 PolarHBondContact O-N 3.12Å; I828-P831 VanDerWaalsContact CG2-CA 3.49Å; I828-P831 HydrophobicContact CG2-CB 3.91Å
829	T	72	Confident	75.5	Confident	136 Å²	136	77.6 Å²	77.6	83%	0.834	41%	0.405	S	S	*	.	S	Bend	trans	-80.3	-42.9	178.5	47.2	0	0	0	0	111.9
830	E	71.1	Confident	73.6	Confident	138 Å²	138	82.3 Å²	82.3	65%	0.645	43%	0.426	S	S	*	.	S	Bend	trans	-126	110.6	172.9	-68.7	-177.1	-171.4	0	0	108.8	C832	E830-C832 PolarHBondContact O-N 3.29Å
831	P	70.5	Confident	71.9	Confident	51 Å²	51	77.8 Å²	77.8	33%	0.331	42%	0.421	S	S	.	.			trans	-70.1	134.8	179.7	27	-33.3	0	0	0	110.8	I828 S833 L834	I828-P831 VanDerWaalsContact CG2-CA 3.49Å; I828-P831 HydrophobicContact CG2-CB 3.91Å; P831-S833 PolarHBondContact O-N 3.03Å; P831-L834 HydrophobicContact CG-CD1 4.16Å; P831-L834 HydrophobicContact CG-CG 4.21Å; P831-L834 PolarHBondContact O-N 3.3Å
832	C	76.3	Confident	70.2	Confident	12 Å²	12	80.1 Å²	80.1	8%	0.081	44%	0.44	C	S	.	.	H	α-helix	trans	-57.2	-9.4	179.7	-63.4	0	0	0	0	114.9	Q771 C774 E830 L835 R836	Q771-C832 PolarHBondContact O-SG 3.34Å; Q771-C832 VanDerWaalsContact O-SG 3.32Å; C774-C832 WeakPolarHBondContact CA-SG 3.43Å; C774-C832 HydrophobicContact CB-CB 3.92Å; C774-C832 WeakPolarHBondContact CB-SG 3.34Å; C774-C832 WeakPolarHBondContact SG-CA 3.32Å; C774-C832 WeakPolarHBondContact SG-CB 3.49Å; C774-C832 CovalentContact SG-SG 2.04Å; C774-C832 PolarHBondContact SG-SG 3.08Å; E830-C832 PolarHBondContact O-N 3.29Å; C832-L835 PolarHBondContact O-N 3.35Å; C832-R836 WeakPolarHBondContact O-CG 3.37Å; C832-R836 PolarHBondContact O-N 3.15Å
833	S	68	Low	68.7	Low	59 Å²	59	82.3 Å²	82.3	41%	0.413	46%	0.458	S	S	.	.	H	α-helix	trans	-60.2	-41.2	166.8	50.8	0	0	0	0	112.3	P831 L835 R836 E837	P831-S833 PolarHBondContact O-N 3.03Å; S833-L835 VanDerWaalsContact C-N 3.29Å; S833-L835 PolarHBondContact O-N 3.11Å; S833-R836 CarbonylContact O-C 3.54Å; S833-R836 WeakPolarHBondContact O-CA 3.44Å; S833-R836 WeakPolarHBondContact O-CB 3.39Å; S833-R836 PolarHBondContact O-N 3.29Å; S833-E837 WeakPolarHBondContact O-CG 3.29Å; S833-E837 PolarHBondContact O-N 2.94Å
834	L	60.4	Low	67.7	Low	96 Å²	96	88.1 Å²	88.1	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-63.9	-35.8	178.3	-64	176.2	0	0	0	111.5	P831 E837 S838	P831-L834 HydrophobicContact CG-CD1 4.16Å; P831-L834 HydrophobicContact CG-CG 4.21Å; P831-L834 PolarHBondContact O-N 3.3Å; L834-E837 PolarHBondContact O-N 2.87Å; L834-S838 WeakPolarHBondContact O-CB 3.37Å; L834-S838 PolarHBondContact O-N 3.32Å
835	L	60.9	Low	66.9	Low	88 Å²	88	89.7 Å²	89.7	46%	0.461	50%	0.504	S	S	.	.	H	α-helix	trans	-73.7	-28.8	172.6	-74.5	166.6	0	0	0	112.8	C774 C832 S833 E837 G839	C774-L835 HydrophobicContact CB-CD1 3.89Å; C832-L835 PolarHBondContact O-N 3.35Å; S833-L835 VanDerWaalsContact C-N 3.29Å; S833-L835 PolarHBondContact O-N 3.11Å; L835-E837 VanDerWaalsContact C-N 3.29Å; L835-G839 PolarHBondContact O-N 2.92Å
836	R	58	Low	66.3	Low	180 Å²	180	86.7 Å²	86.7	68%	0.679	50%	0.498	S	S	*	.	H	α-helix	trans	-71.8	-22.4	168.5	-72.2	177.9	68.9	179.7	2.4	113	C832 S833	C832-R836 WeakPolarHBondContact O-CG 3.37Å; C832-R836 PolarHBondContact O-N 3.15Å; S833-R836 CarbonylContact O-C 3.54Å; S833-R836 WeakPolarHBondContact O-CA 3.44Å; S833-R836 WeakPolarHBondContact O-CB 3.39Å; S833-R836 PolarHBondContact O-N 3.29Å
837	E	53.5	Low	66	Low	107 Å²	107	90.4 Å²	90.4	50%	0.5	52%	0.523	S	S	.	.	H	α-helix	trans	-89.4	-35.7	175.3	-72.5	174.1	163.1	0	0	111.9	S833 L834 L835 G839 K840	S833-E837 WeakPolarHBondContact O-CG 3.29Å; S833-E837 PolarHBondContact O-N 2.94Å; L834-E837 PolarHBondContact O-N 2.87Å; L835-E837 VanDerWaalsContact C-N 3.29Å; E837-G839 VanDerWaalsContact C-N 3.26Å; E837-G839 PolarHBondContact O-N 3.11Å; E837-K840 WeakPolarHBondContact O-CB 3.48Å; E837-K840 PolarHBondContact O-N 3.11Å
838	S	51.5	Low	65.5	Low	79 Å²	79	90.5 Å²	90.5	55%	0.552	52%	0.521	S	S	*	.	H	α-helix	trans	-56.7	-41.7	164.8	-177.7	0	0	0	0	111	L834 K840 A841	L834-S838 WeakPolarHBondContact O-CB 3.37Å; L834-S838 PolarHBondContact O-N 3.32Å; S838-K840 PolarHBondContact O-N 3.32Å; S838-K840 VanDerWaalsContact O-N 3.12Å; S838-A841 WeakPolarHBondContact O-CB 3.47Å; S838-A841 PolarHBondContact O-N 2.99Å
839	G	53.2	Low	65.2	Low	62 Å²	62	91 Å²	91	64%	0.639	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	3	171.1	0	0	0	0	0	116.4	L835 E837	L835-G839 PolarHBondContact O-N 2.92Å; E837-G839 VanDerWaalsContact C-N 3.26Å; E837-G839 PolarHBondContact O-N 3.11Å
840	K	54.8	Low	65.6	Low	159 Å²	159	86.7 Å²	86.7	69%	0.691	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-11.6	166.1	-65	173	-177.4	171.7	0	112.7	E837 S838	E837-K840 WeakPolarHBondContact O-CB 3.48Å; E837-K840 PolarHBondContact O-N 3.11Å; S838-K840 PolarHBondContact O-N 3.32Å; S838-K840 VanDerWaalsContact O-N 3.12Å
841	A	56.3	Low	66.2	Low	61 Å²	61	80.7 Å²	80.7	50%	0.504	47%	0.472	S	S	.	.	S	Bend	trans	-72.8	135.3	172.7	0	0	0	0	0	109.1	S838 S843	S838-A841 WeakPolarHBondContact O-CB 3.47Å; S838-A841 PolarHBondContact O-N 2.99Å; A841-S843 PolarHBondContact O-N 2.81Å
842	P	58.4	Low	67	Low	102 Å²	102	78.3 Å²	78.3	66%	0.662	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-67.6	118.2	-179.8	26.4	-33.3	0	0	0	110.7
843	S	62.8	Low	67.6	Low	61 Å²	61	80.9 Å²	80.9	43%	0.427	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-55.8	137.7	175.6	-66.1	0	0	0	0	111.6	E687 A841	E687-S843 VanDerWaalsContact OE1-CB 3.3Å; E687-S843 WeakPolarHBondContact OE1-CB 3.36Å; E687-S843 PolarHBondContact OE1-OG 2.86Å; A841-S843 PolarHBondContact O-N 2.81Å
844	P	71.1	Confident	68.7	Low	122 Å²	122	83.9 Å²	83.9	79%	0.792	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-65.6	142.4	177.8	27.8	-34.7	0	0	0	111.3	G846	P844-G846 PolarHBondContact O-N 3.49Å; P844-G846 VanDerWaalsContact O-N 3.09Å
845	L	71.3	Confident	70.1	Confident	109 Å²	109	82.4 Å²	82.4	57%	0.571	47%	0.469	S	S	*	.			trans	-63.3	111.9	-171.4	-159.7	81.5	0	0	0	112.1	L684 V850	L684-L845 HydrophobicContact CD1-CD1 3.7Å; L684-L845 HydrophobicContact CD2-CD1 3.65Å; L684-L845 HydrophobicContact CG-CD1 4.14Å; L845-V850 HydrophobicContact CD2-CG2 3.73Å; L845-V850 HydrophobicContact CG-CG2 4.21Å
846	G	73.4	Confident	71.5	Confident	30 Å²	30	81.6 Å²	81.6	31%	0.309	47%	0.468	S	S	.	.			trans	-85.6	149.9	-175.7	0	0	0	0	0	113.3	P844 E848 Q849	P844-G846 PolarHBondContact O-N 3.49Å; P844-G846 VanDerWaalsContact O-N 3.09Å; G846-E848 PolarHBondContact O-N 3.05Å; G846-E848 VanDerWaalsContact O-N 3.11Å; G846-Q849 WeakPolarHBondContact O-CB 3.42Å; G846-Q849 PolarHBondContact O-N 3.01Å
847	V	80.8	Confident	73.2	Confident	121 Å²	121	78.8 Å²	78.8	73%	0.733	47%	0.465	S	S	*	.	H	α-helix	trans	-56.5	-29.5	173.7	-178.1	0	0	0	0	111.7	Q849 V850 G851	V847-Q849 VanDerWaalsContact C-N 3.31Å; V847-Q849 PolarHBondContact O-N 3.26Å; V847-V850 PolarHBondContact O-N 2.93Å; V847-G851 WeakPolarHBondContact O-CA 3.18Å; V847-G851 PolarHBondContact O-N 2.69Å
848	E	72.2	Confident	75.1	Confident	96 Å²	96	78.5 Å²	78.5	45%	0.449	47%	0.467	S	S	.	.	H	α-helix	trans	-62.9	-32.5	175.6	-58.3	-168.6	161.9	0	0	113.2	K574 P575 G846	K574-E848 IonicContact NZ-OE1 3.12Å; K574-E848 PolarHBondContact NZ-OE1 2.84Å; K574-E848 IonicContact NZ-OE2 3.58Å; K574-E848 PolarHBondContact NZ-OE2 3.31Å; P575-E848 HydrophobicContact CG-CB 4.21Å; G846-E848 PolarHBondContact O-N 3.05Å; G846-E848 VanDerWaalsContact O-N 3.11Å
849	Q	73.7	Confident	77.2	Confident	41 Å²	41	79.5 Å²	79.5	19%	0.192	47%	0.465	C	S	.	.	H	α-helix	trans	-74	-31.9	178.1	-68	165.3	-39.6	0	0	112.3	P575 L684 G846 V847	P575-Q849 HydrophobicContact CB-CG 4.23Å; P575-Q849 HydrophobicContact CG-CB 4.4Å; P575-Q849 HydrophobicContact CG-CG 3.62Å; L684-Q849 HydrophobicContact CD2-CB 4.45Å; G846-Q849 WeakPolarHBondContact O-CB 3.42Å; G846-Q849 PolarHBondContact O-N 3.01Å; V847-Q849 VanDerWaalsContact C-N 3.31Å; V847-Q849 PolarHBondContact O-N 3.26Å
850	V	80.5	Confident	79.1	Confident	46 Å²	46	78.8 Å²	78.8	28%	0.279	46%	0.457	S	S	.	.	H	α-helix	trans	-100.1	-12	-174.9	-167.1	0	0	0	0	112.3	L845 V847 G852 V853 F854	L845-V850 HydrophobicContact CD2-CG2 3.73Å; L845-V850 HydrophobicContact CG-CG2 4.21Å; V847-V850 PolarHBondContact O-N 2.93Å; V850-G852 VanDerWaalsContact C-N 3.33Å; V850-G852 PolarHBondContact O-N 3.24Å; V850-G852 VanDerWaalsContact O-N 3.12Å; V850-V853 HydrophobicContact CG1-CB 4.32Å; V850-V853 HydrophobicContact CG1-CG2 4.27Å; V850-V853 WeakPolarHBondContact O-CB 3.41Å; V850-V853 PolarHBondContact O-N 3.32Å; V850-F854 HydrophobicContact CB-CE2 4.28Å; V850-F854 HydrophobicContact CG1-CD2 4.38Å; V850-F854 HydrophobicContact CG1-CE2 3.8Å
851	G	83.5	Confident	81	Confident	13 Å²	13	77.6 Å²	77.6	13%	0.134	45%	0.452	C	S	.	.	H	α-helix	trans	-51.8	-40.5	-168.3	0	0	0	0	0	115.8	V847 V853 F854 I855	V847-G851 WeakPolarHBondContact O-CA 3.18Å; V847-G851 PolarHBondContact O-N 2.69Å; G851-V853 VanDerWaalsContact C-N 3.29Å; G851-V853 PolarHBondContact O-N 2.85Å; G851-F854 PolarHBondContact O-N 3.34Å; G851-I855 PolarHBondContact O-N 3.38Å
852	G	86.8	Confident	82.8	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	45%	0.454	C	S	.	.	H	α-helix	trans	-67.9	-23.7	178.8	0	0	0	0	0	114.7	L577 V850 F854 I855 V856	L577-G852 WeakPolarHBondContact O-CA 3.21Å; L577-G852 PolarHBondContact O-N 3.21Å; V850-G852 VanDerWaalsContact C-N 3.33Å; V850-G852 PolarHBondContact O-N 3.24Å; V850-G852 VanDerWaalsContact O-N 3.12Å; G852-F854 VanDerWaalsContact C-N 3.33Å; G852-I855 PolarHBondContact O-N 3.16Å; G852-V856 WeakPolarHBondContact O-CG2 3.1Å; G852-V856 PolarHBondContact O-N 2.8Å
853	V	89.2	Confident	84.5	Confident	67 Å²	67	81.6 Å²	81.6	41%	0.406	45%	0.451	S	S	.	.	H	α-helix	trans	-65.2	-41.3	175.3	-174.8	0	0	0	0	110	F580 V850 G851 I855 V856 L857	F580-V853 HydrophobicContact CB-CG2 4.12Å; F580-V853 HydrophobicContact CD1-CG2 3.7Å; F580-V853 HydrophobicContact CD2-CG2 4.22Å; F580-V853 HydrophobicContact CE1-CG2 4.17Å; F580-V853 HydrophobicContact CG-CG2 3.74Å; V850-V853 HydrophobicContact CG1-CB 4.32Å; V850-V853 HydrophobicContact CG1-CG2 4.27Å; V850-V853 WeakPolarHBondContact O-CB 3.41Å; V850-V853 PolarHBondContact O-N 3.32Å; G851-V853 VanDerWaalsContact C-N 3.29Å; G851-V853 PolarHBondContact O-N 2.85Å; V853-I855 VanDerWaalsContact C-N 3.34Å; V853-I855 PolarHBondContact O-N 2.79Å; V853-V856 PolarHBondContact O-N 3.47Å; V853-L857 WeakPolarHBondContact O-CB 3.33Å; V853-L857 PolarHBondContact O-N 3.47Å
854	F	90.1	Very high	86	Confident	121 Å²	121	80.8 Å²	80.8	53%	0.531	45%	0.453	S	S	.	.	H	α-helix	trans	-66.1	-34.9	173.7	-63.5	-77.8	0	0	0	112.5	V850 G851 G852 L857 L858	V850-F854 HydrophobicContact CB-CE2 4.28Å; V850-F854 HydrophobicContact CG1-CD2 4.38Å; V850-F854 HydrophobicContact CG1-CE2 3.8Å; G851-F854 PolarHBondContact O-N 3.34Å; G852-F854 VanDerWaalsContact C-N 3.33Å; F854-L857 PolarHBondContact O-N 3.37Å; F854-L858 WeakPolarHBondContact O-CG 3.32Å; F854-L858 PolarHBondContact O-N 3.47Å; F854-L858 VanDerWaalsContact O-N 3.07Å
855	I	90.5	Very high	87	Confident	65 Å²	65	80.6 Å²	80.6	33%	0.333	44%	0.44	S	S	.	.	H	α-helix	trans	-67.6	-44.6	175.8	-63.9	171.3	0	0	0	110.8	L577 G851 G852 V853 L857 L858 I859	L577-I855 HydrophobicContact CD1-CD1 3.85Å; L577-I855 HydrophobicContact CD2-CD1 4.16Å; L577-I855 HydrophobicContact CG-CD1 4.45Å; G851-I855 PolarHBondContact O-N 3.38Å; G852-I855 PolarHBondContact O-N 3.16Å; V853-I855 VanDerWaalsContact C-N 3.34Å; V853-I855 PolarHBondContact O-N 2.79Å; I855-L857 VanDerWaalsContact C-N 3.33Å; I855-L857 PolarHBondContact O-N 2.93Å; I855-L858 PolarHBondContact O-N 2.88Å; I855-I859 HydrophobicContact CG2-CD1 3.86Å; I855-I859 WeakPolarHBondContact O-CG1 3.42Å; I855-I859 PolarHBondContact O-N 3.29Å
856	V	90.9	Very high	88	Confident	72 Å²	72	77.3 Å²	77.3	44%	0.436	43%	0.428	S	S	.	.	H	α-helix	trans	-63.1	-39.7	175.9	170.9	0	0	0	0	111.3	F580 G852 V853 L858 I859 G860	F580-V856 HydrophobicContact CZ-CG2 4.07Å; G852-V856 WeakPolarHBondContact O-CG2 3.1Å; G852-V856 PolarHBondContact O-N 2.8Å; V853-V856 PolarHBondContact O-N 3.47Å; V856-L858 PolarHBondContact O-N 2.87Å; V856-I859 PolarHBondContact O-N 3.46Å; V856-G860 PolarHBondContact O-N 3.29Å
857	L	93	Very high	89	Confident	121 Å²	121	79.2 Å²	79.2	63%	0.634	43%	0.434	S	S	*	.	H	α-helix	trans	-58.7	-45.2	173.6	177.8	62.6	0	0	0	112.1	V853 F854 I855 G860 F861	V853-L857 WeakPolarHBondContact O-CB 3.33Å; V853-L857 PolarHBondContact O-N 3.47Å; F854-L857 PolarHBondContact O-N 3.37Å; I855-L857 VanDerWaalsContact C-N 3.33Å; I855-L857 PolarHBondContact O-N 2.93Å; L857-G860 PolarHBondContact O-N 2.95Å; L857-F861 WeakPolarHBondContact O-CB 3.28Å; L857-F861 PolarHBondContact O-N 3.36Å
858	L	94	Very high	89.5	Confident	101 Å²	101	76.6 Å²	76.6	53%	0.529	42%	0.421	S	S	.	.	H	α-helix	trans	-64.3	-44.6	176.7	-73.4	169	0	0	0	112.1	F854 I855 V856 F861 F862	F854-L858 WeakPolarHBondContact O-CG 3.32Å; F854-L858 PolarHBondContact O-N 3.47Å; F854-L858 VanDerWaalsContact O-N 3.07Å; I855-L858 PolarHBondContact O-N 2.88Å; V856-L858 PolarHBondContact O-N 2.87Å; L858-F861 PolarHBondContact O-N 3.44Å; L858-F862 WeakPolarHBondContact O-CD2 3.36Å; L858-F862 PolarHBondContact O-N 2.86Å
859	I	94	Very high	90.3	Very high	100 Å²	100	75.5 Å²	75.5	51%	0.513	42%	0.417	S	S	.	.	H	α-helix	trans	-63.3	-44.9	177.7	-66.8	167.9	0	0	0	110.5	I855 V856 F861 F862 M863	I855-I859 HydrophobicContact CG2-CD1 3.86Å; I855-I859 WeakPolarHBondContact O-CG1 3.42Å; I855-I859 PolarHBondContact O-N 3.29Å; V856-I859 PolarHBondContact O-N 3.46Å; I859-F861 VanDerWaalsContact C-N 3.35Å; I859-F861 PolarHBondContact O-N 3.35Å; I859-F862 PolarHBondContact O-N 2.96Å; I859-M863 HydrophobicContact CG2-CG 4.31Å; I859-M863 WeakPolarHBondContact O-CB 3.14Å; I859-M863 VanDerWaalsContact O-CG 3.32Å; I859-M863 WeakPolarHBondContact O-CG 3.38Å; I859-M863 PolarHBondContact O-N 2.95Å
860	G	93.8	Very high	91	Very high	46 Å²	46	78.4 Å²	78.4	47%	0.474	43%	0.433	S	S	.	.	H	α-helix	trans	-60.5	-42.2	176.3	0	0	0	0	0	112.6	V856 L857 M863 G864	V856-G860 PolarHBondContact O-N 3.29Å; L857-G860 PolarHBondContact O-N 2.95Å; G860-M863 PolarHBondContact O-N 3.49Å; G860-G864 PolarHBondContact O-N 3.22Å
861	F	95.1	Very high	91.4	Very high	134 Å²	134	82.2 Å²	82.2	59%	0.588	45%	0.448	S	S	*	.	H	α-helix	trans	-60.7	-49.2	173.6	177	-92.8	0	0	0	112	L857 L858 I859 M863 G864 F865	L857-F861 WeakPolarHBondContact O-CB 3.28Å; L857-F861 PolarHBondContact O-N 3.36Å; L858-F861 PolarHBondContact O-N 3.44Å; I859-F861 VanDerWaalsContact C-N 3.35Å; I859-F861 PolarHBondContact O-N 3.35Å; F861-M863 PolarHBondContact O-N 3.07Å; F861-G864 PolarHBondContact O-N 3.37Å; F861-F865 VanDerWaalsContact O-CB 3.31Å; F861-F865 WeakPolarHBondContact O-CB 3.4Å; F861-F865 PolarHBondContact O-N 2.8Å
862	F	93.9	Very high	91.4	Very high	125 Å²	125	84.8 Å²	84.8	55%	0.548	46%	0.455	S	S	.	.	H	α-helix	trans	-65.7	-36.1	178.5	-77.3	-61	0	0	0	112.9	L858 I859 F865 A866	L858-F862 WeakPolarHBondContact O-CD2 3.36Å; L858-F862 PolarHBondContact O-N 2.86Å; I859-F862 PolarHBondContact O-N 2.96Å; F862-F865 PolarHBondContact O-N 2.83Å; F862-A866 VanDerWaalsContact O-CB 3.23Å; F862-A866 WeakPolarHBondContact O-CB 3.26Å; F862-A866 PolarHBondContact O-N 3.1Å
863	M	93.8	Very high	91.3	Very high	122 Å²	122	89.6 Å²	89.6	60%	0.601	48%	0.481	S	S	*	.	H	α-helix	trans	-65.6	-46.1	174.2	-74.8	-66	-69.6	0	0	111.7	I859 G860 F861 F865 A866 V867	I859-M863 HydrophobicContact CG2-CG 4.31Å; I859-M863 WeakPolarHBondContact O-CB 3.14Å; I859-M863 VanDerWaalsContact O-CG 3.32Å; I859-M863 WeakPolarHBondContact O-CG 3.38Å; I859-M863 PolarHBondContact O-N 2.95Å; G860-M863 PolarHBondContact O-N 3.49Å; F861-M863 PolarHBondContact O-N 3.07Å; M863-F865 VanDerWaalsContact C-N 3.35Å; M863-F865 PolarHBondContact O-N 3.17Å; M863-A866 PolarHBondContact O-N 2.88Å; M863-V867 WeakPolarHBondContact O-CG2 3.37Å; M863-V867 PolarHBondContact O-N 2.85Å
864	G	94	Very high	91.1	Very high	44 Å²	44	90.7 Å²	90.7	45%	0.454	49%	0.487	S	S	.	.	H	α-helix	trans	-62	-40.9	175.1	0	0	0	0	0	112.7	G860 F861 V867 S868	G860-G864 PolarHBondContact O-N 3.22Å; F861-G864 PolarHBondContact O-N 3.37Å; G864-V867 PolarHBondContact O-N 2.87Å; G864-S868 WeakPolarHBondContact O-CB 3.48Å; G864-S868 PolarHBondContact O-N 3.28Å
865	F	93.1	Very high	90.6	Very high	118 Å²	118	87.7 Å²	87.7	52%	0.518	49%	0.485	S	S	.	.	H	α-helix	trans	-65.6	-40.5	174.9	-172.8	-113.7	0	0	0	112.3	F861 F862 M863 S868 I869	F861-F865 VanDerWaalsContact O-CB 3.31Å; F861-F865 WeakPolarHBondContact O-CB 3.4Å; F861-F865 PolarHBondContact O-N 2.8Å; F862-F865 PolarHBondContact O-N 2.83Å; M863-F865 VanDerWaalsContact C-N 3.35Å; M863-F865 PolarHBondContact O-N 3.17Å; F865-S868 PolarHBondContact O-N 3.36Å; F865-I869 HydrophobicContact CD1-CD1 3.81Å; F865-I869 HydrophobicContact CE1-CD1 3.52Å; F865-I869 HydrophobicContact CG-CD1 4.47Å; F865-I869 HydrophobicContact CZ-CD1 3.93Å; F865-I869 WeakPolarHBondContact O-CG1 3.27Å; F865-I869 PolarHBondContact O-N 2.93Å
866	A	92.6	Very high	89.7	Confident	41 Å²	41	85.5 Å²	85.5	34%	0.339	48%	0.475	S	S	.	.	H	α-helix	trans	-66.8	-41	175.4	0	0	0	0	0	112.3	F862 M863 I869 I870	F862-A866 VanDerWaalsContact O-CB 3.23Å; F862-A866 WeakPolarHBondContact O-CB 3.26Å; F862-A866 PolarHBondContact O-N 3.1Å; M863-A866 PolarHBondContact O-N 2.88Å; A866-I869 PolarHBondContact O-N 3.43Å; A866-I870 VanDerWaalsContact O-CG1 3.27Å; A866-I870 WeakPolarHBondContact O-CG1 3.42Å; A866-I870 PolarHBondContact O-N 2.93Å
867	V	93	Very high	88.7	Confident	69 Å²	69	92.2 Å²	92.2	42%	0.418	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-45.4	172.6	170.4	0	0	0	0	110.4	M863 G864 I869 I870 E871	M863-V867 WeakPolarHBondContact O-CG2 3.37Å; M863-V867 PolarHBondContact O-N 2.85Å; G864-V867 PolarHBondContact O-N 2.87Å; V867-I869 VanDerWaalsContact C-N 3.31Å; V867-I869 PolarHBondContact O-N 3.01Å; V867-I870 CarbonylContact O-C 3.47Å; V867-I870 WeakPolarHBondContact O-CA 3.23Å; V867-I870 PolarHBondContact O-N 3.45Å; V867-E871 HydrophobicContact CG1-CG 4.3Å; V867-E871 WeakPolarHBondContact O-CG 3.43Å; V867-E871 PolarHBondContact O-N 2.95Å
868	S	91	Very high	87.5	Confident	66 Å²	66	93.4 Å²	93.4	46%	0.462	50%	0.499	S	S	.	.	H	α-helix	trans	-60.9	-37.6	175.6	-172.8	0	0	0	0	112.6	G864 F865 F872	G864-S868 WeakPolarHBondContact O-CB 3.48Å; G864-S868 PolarHBondContact O-N 3.28Å; F865-S868 PolarHBondContact O-N 3.36Å; S868-F872 VanDerWaalsContact O-CB 3.26Å; S868-F872 WeakPolarHBondContact O-CB 3.31Å; S868-F872 PolarHBondContact O-N 3.02Å
869	I	88.9	Confident	85.8	Confident	73 Å²	73	94.6 Å²	94.6	37%	0.374	50%	0.502	S	S	.	.	H	α-helix	trans	-65.3	-39.7	170.9	-72.6	168.1	0	0	0	111.5	F865 A866 V867 F872 L873	F865-I869 HydrophobicContact CD1-CD1 3.81Å; F865-I869 HydrophobicContact CE1-CD1 3.52Å; F865-I869 HydrophobicContact CG-CD1 4.47Å; F865-I869 HydrophobicContact CZ-CD1 3.93Å; F865-I869 WeakPolarHBondContact O-CG1 3.27Å; F865-I869 PolarHBondContact O-N 2.93Å; A866-I869 PolarHBondContact O-N 3.43Å; V867-I869 VanDerWaalsContact C-N 3.31Å; V867-I869 PolarHBondContact O-N 3.01Å; I869-F872 PolarHBondContact O-N 3.39Å; I869-L873 HydrophobicContact CG2-CD1 3.85Å; I869-L873 HydrophobicContact CG2-CG 4.3Å; I869-L873 WeakPolarHBondContact O-CB 3.35Å; I869-L873 VanDerWaalsContact O-CG 3.23Å; I869-L873 WeakPolarHBondContact O-CG 3.34Å; I869-L873 PolarHBondContact O-N 3.01Å
870	I	88.9	Confident	84.1	Confident	102 Å²	102	97.3 Å²	97.3	52%	0.523	51%	0.513	S	S	.	.	H	α-helix	trans	-68.7	-44.5	178.5	-70	162.6	0	0	0	111	A866 V867 F872 L873 V874	A866-I870 VanDerWaalsContact O-CG1 3.27Å; A866-I870 WeakPolarHBondContact O-CG1 3.42Å; A866-I870 PolarHBondContact O-N 2.93Å; V867-I870 CarbonylContact O-C 3.47Å; V867-I870 WeakPolarHBondContact O-CA 3.23Å; V867-I870 PolarHBondContact O-N 3.45Å; I870-F872 VanDerWaalsContact C-N 3.3Å; I870-F872 PolarHBondContact O-N 2.84Å; I870-L873 CarbonylContact O-C 3.49Å; I870-L873 PolarHBondContact O-N 3.49Å; I870-L873 VanDerWaalsContact O-N 3.1Å; I870-V874 WeakPolarHBondContact O-CG2 3.37Å; I870-V874 PolarHBondContact O-N 2.9Å
871	E	89.6	Confident	82.3	Confident	127 Å²	127	103 Å²	103	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-57.3	-44.5	172.4	-71.7	176.5	163.8	0	0	111	V867 V874 A875	V867-E871 HydrophobicContact CG1-CG 4.3Å; V867-E871 WeakPolarHBondContact O-CG 3.43Å; V867-E871 PolarHBondContact O-N 2.95Å; E871-V874 PolarHBondContact O-N 2.99Å; E871-A875 WeakPolarHBondContact O-CB 3.24Å; E871-A875 PolarHBondContact O-N 3.28Å
872	F	84.2	Confident	80.5	Confident	66 Å²	66	101.1 Å²	101.1	29%	0.289	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-40	173.3	-177.9	-96.8	0	0	0	112.4	S868 I869 I870 T876 V884 M888	S868-F872 VanDerWaalsContact O-CB 3.26Å; S868-F872 WeakPolarHBondContact O-CB 3.31Å; S868-F872 PolarHBondContact O-N 3.02Å; I869-F872 PolarHBondContact O-N 3.39Å; I870-F872 VanDerWaalsContact C-N 3.3Å; I870-F872 PolarHBondContact O-N 2.84Å; F872-T876 HydrophobicContact CD1-CG2 4.29Å; F872-T876 HydrophobicContact CD2-CG2 4.5Å; F872-T876 HydrophobicContact CE1-CG2 4.01Å; F872-T876 HydrophobicContact CE2-CG2 4.24Å; F872-T876 HydrophobicContact CZ-CG2 3.99Å; F872-T876 VanDerWaalsContact O-CB 3.31Å; F872-T876 WeakPolarHBondContact O-CB 3.24Å; F872-T876 VanDerWaalsContact O-CG2 3.24Å; F872-T876 WeakPolarHBondContact O-CG2 3.5Å; F872-T876 PolarHBondContact O-N 3.21Å; F872-T876 PolarHBondContact O-OG1 3.27Å; F872-V884 HydrophobicContact CE2-CG1 3.76Å; F872-V884 HydrophobicContact CZ-CG1 3.77Å; F872-M888 HydrophobicContact CE1-SD 3.93Å; F872-M888 HydrophobicContact CE2-SD 3.98Å; F872-M888 HydrophobicContact CZ-CB 4.19Å; F872-M888 HydrophobicContact CZ-CG 4.35Å; F872-M888 HydrophobicContact CZ-SD 3.48Å; F872-M888 WeakPolarHBondContact CZ-SD 3.23Å
873	L	84	Confident	79.1	Confident	102 Å²	102	97.4 Å²	97.4	53%	0.534	52%	0.517	S	S	.	.	H	α-helix	trans	-69.6	-29.6	176.3	-74.7	172.1	0	0	0	113.2	I869 I870 T876 R877	I869-L873 HydrophobicContact CG2-CD1 3.85Å; I869-L873 HydrophobicContact CG2-CG 4.3Å; I869-L873 WeakPolarHBondContact O-CB 3.35Å; I869-L873 VanDerWaalsContact O-CG 3.23Å; I869-L873 WeakPolarHBondContact O-CG 3.34Å; I869-L873 PolarHBondContact O-N 3.01Å; I870-L873 CarbonylContact O-C 3.49Å; I870-L873 PolarHBondContact O-N 3.49Å; I870-L873 VanDerWaalsContact O-N 3.1Å; L873-T876 WeakPolarHBondContact CA-OG1 3.31Å; L873-T876 PolarHBondContact O-OG1 3.07Å; L873-R877 PolarHBondContact O-N 2.85Å
874	V	84.1	Confident	77.7	Confident	89 Å²	89	92.9 Å²	92.9	54%	0.539	50%	0.496	S	S	.	.	H	α-helix	trans	-74.5	-48.3	172	172.4	0	0	0	0	110.3	I870 E871 T876 R877	I870-V874 WeakPolarHBondContact O-CG2 3.37Å; I870-V874 PolarHBondContact O-N 2.9Å; E871-V874 PolarHBondContact O-N 2.99Å; V874-T876 PolarHBondContact O-N 3.42Å; V874-R877 WeakPolarHBondContact O-CA 3.37Å; V874-R877 VanDerWaalsContact O-CB 3.24Å; V874-R877 WeakPolarHBondContact O-CB 3.26Å; V874-R877 PolarHBondContact O-N 3.44Å
875	A	79.8	Confident	76.2	Confident	59 Å²	59	98.2 Å²	98.2	49%	0.488	50%	0.502	S	S	.	.	H	α-helix	trans	-61.5	-31.5	175.2	0	0	0	0	0	112.9	E871 R877 Q879	E871-A875 WeakPolarHBondContact O-CB 3.24Å; E871-A875 PolarHBondContact O-N 3.28Å; A875-R877 VanDerWaalsContact C-N 3.33Å; A875-Q879 PolarHBondContact O-N 2.91Å
876	T	72.5	Confident	74.9	Confident	19 Å²	19	100.7 Å²	100.7	12%	0.117	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	5.2	172.2	58.5	0	0	0	0	114.6	F872 L873 V874 V884	F872-T876 HydrophobicContact CD1-CG2 4.29Å; F872-T876 HydrophobicContact CD2-CG2 4.5Å; F872-T876 HydrophobicContact CE1-CG2 4.01Å; F872-T876 HydrophobicContact CE2-CG2 4.24Å; F872-T876 HydrophobicContact CZ-CG2 3.99Å; F872-T876 VanDerWaalsContact O-CB 3.31Å; F872-T876 WeakPolarHBondContact O-CB 3.24Å; F872-T876 VanDerWaalsContact O-CG2 3.24Å; F872-T876 WeakPolarHBondContact O-CG2 3.5Å; F872-T876 PolarHBondContact O-N 3.21Å; F872-T876 PolarHBondContact O-OG1 3.27Å; L873-T876 WeakPolarHBondContact CA-OG1 3.31Å; L873-T876 PolarHBondContact O-OG1 3.07Å; V874-T876 PolarHBondContact O-N 3.42Å; T876-V884 HydrophobicContact CG2-CB 3.54Å; T876-V884 HydrophobicContact CG2-CG1 3.5Å; T876-V884 HydrophobicContact CG2-CG2 3.85Å
877	R	70.4	Confident	73.9	Confident	212 Å²	212	100.3 Å²	100.3	80%	0.8	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-36.5	162.9	-171.8	173.2	176.8	147.9	-1.3	111.2	L873 V874 A875 Q879	L873-R877 PolarHBondContact O-N 2.85Å; V874-R877 WeakPolarHBondContact O-CA 3.37Å; V874-R877 VanDerWaalsContact O-CB 3.24Å; V874-R877 WeakPolarHBondContact O-CB 3.26Å; V874-R877 PolarHBondContact O-N 3.44Å; A875-R877 VanDerWaalsContact C-N 3.33Å; R877-Q879 VanDerWaalsContact C-N 3.33Å
878	D	66	Low	72.7	Confident	147 Å²	147	100.4 Å²	100.4	79%	0.786	51%	0.505	S	S	*	.	S	Bend	trans	-82.6	-8.6	177	-69.6	-9	0	0	0	113.3
879	Q	59.4	Low	71.8	Confident	125 Å²	125	103.8 Å²	103.8	58%	0.584	51%	0.507	S	S	*	.	S	Bend	trans	-121.3	147	174.6	-63.4	-161.9	-1.3	0	0	112.4	A875 R877 K881 V884	A875-Q879 PolarHBondContact O-N 2.91Å; R877-Q879 VanDerWaalsContact C-N 3.33Å; Q879-K881 PolarHBondContact O-N 2.85Å; Q879-K881 VanDerWaalsContact O-N 3.12Å; Q879-V884 HydrophobicContact CB-CG2 3.85Å
880	Q	58	Low	71.1	Confident	158 Å²	158	107.8 Å²	107.8	74%	0.738	52%	0.522	S	S	*	.			trans	-56.8	119.3	-177.4	-72	-174.9	-14.1	0	0	111.8	T882 A883	Q880-T882 PolarHBondContact O-N 2.71Å; Q880-A883 WeakPolarHBondContact O-CB 3.48Å; Q880-A883 PolarHBondContact O-N 3.33Å
881	K	55.2	Low	70.4	Confident	165 Å²	165	108.7 Å²	108.7	72%	0.717	52%	0.524	S	S	*	.	H	α-helix	trans	-50.4	-32.2	-171.4	-64.3	-177.1	177	-177.9	0	115.1	Q879	Q879-K881 PolarHBondContact O-N 2.85Å; Q879-K881 VanDerWaalsContact O-N 3.12Å
882	T	58.6	Low	69.6	Low	94 Å²	94	107 Å²	107	58%	0.577	52%	0.519	S	S	*	.	H	α-helix	trans	-84.4	-8.3	-179.6	55.9	0	0	0	0	114.2	Q880 R886	Q880-T882 PolarHBondContact O-N 2.71Å; T882-R886 PolarHBondContact O-NE 2.97Å; T882-R886 PolarHBondContact O-NH2 3.19Å
883	A	64.3	Low	69.1	Low	48 Å²	48	109.6 Å²	109.6	40%	0.397	53%	0.53	S	S	.	.	H	α-helix	trans	-83.7	-55.4	172.7	0	0	0	0	0	110.6	Q880 W885 R886 G887	Q880-A883 WeakPolarHBondContact O-CB 3.48Å; Q880-A883 PolarHBondContact O-N 3.33Å; A883-W885 PolarHBondContact O-N 3.42Å; A883-R886 CarbonylContact O-C 2.99Å; A883-R886 PolarHBondContact O-N 3.31Å; A883-G887 PolarHBondContact O-N 2.86Å
884	V	63.9	Low	68.6	Low	27 Å²	27	110.5 Å²	110.5	16%	0.164	53%	0.53	C	S	.	.	H	α-helix	trans	-71.6	-31	-169.6	-165.5	0	0	0	0	112.9	F872 T876 Q879 R886 G887 M888	F872-V884 HydrophobicContact CE2-CG1 3.76Å; F872-V884 HydrophobicContact CZ-CG1 3.77Å; T876-V884 HydrophobicContact CG2-CB 3.54Å; T876-V884 HydrophobicContact CG2-CG1 3.5Å; T876-V884 HydrophobicContact CG2-CG2 3.85Å; Q879-V884 HydrophobicContact CB-CG2 3.85Å; V884-R886 VanDerWaalsContact C-N 3.32Å; V884-R886 PolarHBondContact O-N 3.12Å; V884-G887 CarbonylContact O-C 3.52Å; V884-G887 PolarHBondContact O-N 3.42Å; V884-M888 WeakPolarHBondContact O-CB 3.37Å; V884-M888 PolarHBondContact O-N 2.81Å
885	W	62	Low	68	Low	156 Å²	156	108.6 Å²	108.6	59%	0.591	52%	0.523	S	S	*	.	H	α-helix	trans	-63.5	-35.4	170	-105.5	92.5	0	0	0	112.9	A883 M888 W889	A883-W885 PolarHBondContact O-N 3.42Å; W885-M888 HydrophobicContact CH2-CE 4.33Å; W885-M888 HydrophobicContact CZ2-CE 4.44Å; W885-M888 HydrophobicContact CZ3-CE 4.38Å; W885-W889 AromaticContact CE3-CD1 3.88Å; W885-W889 AromaticContact CZ3-CD1 3.78Å; W885-W889 AromaticContact CZ3-NE1 3.9Å; W885-W889 WeakPolarHBondContact O-CB 3.43Å; W885-W889 PolarHBondContact O-N 2.96Å
886	R	66.7	Low	67.4	Low	170 Å²	170	109.9 Å²	109.9	64%	0.642	53%	0.525	S	S	*	.	H	α-helix	trans	-74.7	-32	172.3	-82.2	-178.4	-68.4	175.2	-1.9	112.3	T882 A883 V884 K890	T882-R886 PolarHBondContact O-NE 2.97Å; T882-R886 PolarHBondContact O-NH2 3.19Å; A883-R886 CarbonylContact O-C 2.99Å; A883-R886 PolarHBondContact O-N 3.31Å; V884-R886 VanDerWaalsContact C-N 3.32Å; V884-R886 PolarHBondContact O-N 3.12Å; R886-K890 WeakPolarHBondContact O-CB 3.12Å; R886-K890 WeakPolarHBondContact O-CG 3.23Å; R886-K890 PolarHBondContact O-N 2.85Å
887	G	71	Confident	67	Low	32 Å²	32	118.1 Å²	118.1	33%	0.33	55%	0.554	S	S	.	*	H	α-helix	trans	-60.3	-57.7	169	0	0	0	0	0	110.8	A883 V884 W889 K890 E891	A883-G887 PolarHBondContact O-N 2.86Å; V884-G887 CarbonylContact O-C 3.52Å; V884-G887 PolarHBondContact O-N 3.42Å; G887-W889 VanDerWaalsContact C-N 3.34Å; G887-W889 PolarHBondContact O-N 3.06Å; G887-K890 CarbonylContact O-C 3.3Å; G887-K890 WeakPolarHBondContact O-CA 3.43Å; G887-K890 WeakPolarHBondContact O-CB 3.36Å; G887-K890 PolarHBondContact O-N 3.41Å; G887-E891 PolarHBondContact O-N 2.76Å
888	M	68.9	Low	66.5	Low	72 Å²	72	111 Å²	111	36%	0.355	54%	0.536	S	S	.	.	H	α-helix	trans	-62	-35	179	-164.6	179.8	79	0	0	112.9	F872 V884 W885 L892	F872-M888 HydrophobicContact CE1-SD 3.93Å; F872-M888 HydrophobicContact CE2-SD 3.98Å; F872-M888 HydrophobicContact CZ-CB 4.19Å; F872-M888 HydrophobicContact CZ-CG 4.35Å; F872-M888 HydrophobicContact CZ-SD 3.48Å; F872-M888 WeakPolarHBondContact CZ-SD 3.23Å; V884-M888 WeakPolarHBondContact O-CB 3.37Å; V884-M888 PolarHBondContact O-N 2.81Å; W885-M888 HydrophobicContact CH2-CE 4.33Å; W885-M888 HydrophobicContact CZ2-CE 4.44Å; W885-M888 HydrophobicContact CZ3-CE 4.38Å; M888-L892 WeakPolarHBondContact O-CB 3.36Å; M888-L892 PolarHBondContact O-N 2.98Å
889	W	71.5	Confident	65.9	Low	136 Å²	136	111.2 Å²	111.2	52%	0.515	54%	0.537	S	S	.	.	H	α-helix	trans	-73.5	-25.6	171.7	-111.6	80	0	0	0	114	W885 G887 K893	W885-W889 AromaticContact CE3-CD1 3.88Å; W885-W889 AromaticContact CZ3-CD1 3.78Å; W885-W889 AromaticContact CZ3-NE1 3.9Å; W885-W889 WeakPolarHBondContact O-CB 3.43Å; W885-W889 PolarHBondContact O-N 2.96Å; G887-W889 VanDerWaalsContact C-N 3.34Å; G887-W889 PolarHBondContact O-N 3.06Å; W889-K893 HydrophobicContact CE3-CD 4.11Å; W889-K893 HydrophobicContact CE3-CG 4.27Å; W889-K893 HydrophobicContact CZ3-CD 4.31Å; W889-K893 HydrophobicContact CZ3-CG 4.49Å; W889-K893 VanDerWaalsContact O-CB 3.29Å; W889-K893 WeakPolarHBondContact O-CB 3.39Å; W889-K893 WeakPolarHBondContact O-CG 3.42Å; W889-K893 PolarHBondContact O-N 2.76Å
890	K	74.8	Confident	65.3	Low	157 Å²	157	110 Å²	110	68%	0.683	54%	0.537	S	S	*	.	H	α-helix	trans	-71.4	-48.3	167.9	-84.9	-176.2	172.4	-172.4	0	110.7	R886 G887 L892 K893 F894	R886-K890 WeakPolarHBondContact O-CB 3.12Å; R886-K890 WeakPolarHBondContact O-CG 3.23Å; R886-K890 PolarHBondContact O-N 2.85Å; G887-K890 CarbonylContact O-C 3.3Å; G887-K890 WeakPolarHBondContact O-CA 3.43Å; G887-K890 WeakPolarHBondContact O-CB 3.36Å; G887-K890 PolarHBondContact O-N 3.41Å; K890-L892 VanDerWaalsContact C-N 3.33Å; K890-L892 PolarHBondContact O-N 3.33Å; K890-K893 CarbonylContact O-C 3.28Å; K890-K893 PolarHBondContact O-N 3.46Å; K890-F894 VanDerWaalsContact O-CB 3.31Å; K890-F894 WeakPolarHBondContact O-CB 3.3Å; K890-F894 PolarHBondContact O-N 2.85Å
891	E	74.7	Confident	64.5	Low	122 Å²	122	108.2 Å²	108.2	57%	0.57	54%	0.538	S	S	*	.	H	α-helix	trans	-66	-32.5	177.6	-67.2	-51	133	0	0	112.4	G887 F894 A895	G887-E891 PolarHBondContact O-N 2.76Å; E891-F894 CarbonylContact O-C 3.49Å; E891-F894 PolarHBondContact O-N 2.97Å; E891-A895 VanDerWaalsContact O-CB 3.23Å; E891-A895 WeakPolarHBondContact O-CB 3.37Å; E891-A895 PolarHBondContact O-N 2.79Å
892	L	71.7	Confident	64	Low	91 Å²	91	105.3 Å²	105.3	48%	0.476	54%	0.538	S	S	.	.	H	α-helix	trans	-72.6	-39.1	171.9	-172.9	66.3	0	0	0	111.3	M888 K890 F894 T896	M888-L892 WeakPolarHBondContact O-CB 3.36Å; M888-L892 PolarHBondContact O-N 2.98Å; K890-L892 VanDerWaalsContact C-N 3.33Å; K890-L892 PolarHBondContact O-N 3.33Å; L892-F894 PolarHBondContact O-N 3.1Å; L892-T896 WeakPolarHBondContact O-CB 3.37Å; L892-T896 WeakPolarHBondContact O-CG2 3.36Å; L892-T896 PolarHBondContact O-N 2.81Å; L892-T896 PolarHBondContact O-OG1 3.07Å
893	K	73.1	Confident	63.2	Low	120 Å²	120	112 Å²	112	52%	0.522	55%	0.553	S	S	.	*	H	α-helix	trans	-65.9	-27	169.1	-88.9	-180	162.4	165	0	112.8	W889 K890 T896 R897	W889-K893 HydrophobicContact CE3-CD 4.11Å; W889-K893 HydrophobicContact CE3-CG 4.27Å; W889-K893 HydrophobicContact CZ3-CD 4.31Å; W889-K893 HydrophobicContact CZ3-CG 4.49Å; W889-K893 VanDerWaalsContact O-CB 3.29Å; W889-K893 WeakPolarHBondContact O-CB 3.39Å; W889-K893 WeakPolarHBondContact O-CG 3.42Å; W889-K893 PolarHBondContact O-N 2.76Å; K890-K893 CarbonylContact O-C 3.28Å; K890-K893 PolarHBondContact O-N 3.46Å; K893-T896 WeakPolarHBondContact CA-OG1 3.41Å; K893-T896 PolarHBondContact O-OG1 2.73Å; K893-R897 WeakPolarHBondContact O-CB 3.29Å; K893-R897 VanDerWaalsContact O-CD 3.3Å; K893-R897 WeakPolarHBondContact O-CD 3.31Å; K893-R897 WeakPolarHBondContact O-CG 3.49Å; K893-R897 PolarHBondContact O-N 3.33Å
894	F	73.5	Confident	61.8	Low	121 Å²	121	121.9 Å²	121.9	53%	0.531	58%	0.58	S	S	.	*	H	α-helix	trans	-78	-49.4	175.1	-172	-112.1	0	0	0	110.2	K890 E891 L892 T896 R897 C898	K890-F894 VanDerWaalsContact O-CB 3.31Å; K890-F894 WeakPolarHBondContact O-CB 3.3Å; K890-F894 PolarHBondContact O-N 2.85Å; E891-F894 CarbonylContact O-C 3.49Å; E891-F894 PolarHBondContact O-N 2.97Å; L892-F894 PolarHBondContact O-N 3.1Å; F894-T896 PolarHBondContact O-N 2.97Å; F894-R897 CarbonylContact O-C 3.54Å; F894-R897 VanDerWaalsContact O-C 3.28Å; F894-R897 VanDerWaalsContact O-CA 3.3Å; F894-R897 WeakPolarHBondContact O-CA 3.17Å; F894-R897 WeakPolarHBondContact O-CB 3.38Å; F894-R897 PolarHBondContact O-N 3.31Å; F894-C898 VanDerWaalsContact CZ-SG 3.58Å; F894-C898 WeakPolarHBondContact O-CB 3.41Å; F894-C898 PolarHBondContact O-N 3.21Å; F894-C898 PolarHBondContact O-SG 2.74Å
895	A	72.7	Confident	60.7	Low	49 Å²	49	127.8 Å²	127.8	41%	0.405	61%	0.61	S	S	.	*	H	α-helix	trans	-59.7	-42.1	175.4	0	0	0	0	0	112.9	E891 R897 C898 L899	E891-A895 VanDerWaalsContact O-CB 3.23Å; E891-A895 WeakPolarHBondContact O-CB 3.37Å; E891-A895 PolarHBondContact O-N 2.79Å; A895-R897 PolarHBondContact O-N 2.82Å; A895-C898 CarbonylContact O-C 3.56Å; A895-C898 PolarHBondContact O-N 2.81Å; A895-C898 VanDerWaalsContact O-N 3.1Å; A895-L899 PolarHBondContact O-N 2.95Å
896	T	66.7	Low	59.4	Low	87 Å²	87	129.5 Å²	129.5	53%	0.534	62%	0.616	S	S	.	*	H	α-helix	trans	-68.1	-17.9	172.6	51.3	0	0	0	0	113.5	L892 K893 F894	L892-T896 WeakPolarHBondContact O-CB 3.37Å; L892-T896 WeakPolarHBondContact O-CG2 3.36Å; L892-T896 PolarHBondContact O-N 2.81Å; L892-T896 PolarHBondContact O-OG1 3.07Å; K893-T896 WeakPolarHBondContact CA-OG1 3.41Å; K893-T896 PolarHBondContact O-OG1 2.73Å; F894-T896 PolarHBondContact O-N 2.97Å
897	R	63.9	Low	58.4	Low	192 Å²	192	126.9 Å²	126.9	73%	0.725	62%	0.624	S	S	*	*	H	α-helix	trans	-94.6	-13.5	168.3	-72.7	174.2	171.3	-163.6	-6.6	114.1	K893 F894 A895 T900	K893-R897 WeakPolarHBondContact O-CB 3.29Å; K893-R897 VanDerWaalsContact O-CD 3.3Å; K893-R897 WeakPolarHBondContact O-CD 3.31Å; K893-R897 WeakPolarHBondContact O-CG 3.49Å; K893-R897 PolarHBondContact O-N 3.33Å; F894-R897 CarbonylContact O-C 3.54Å; F894-R897 VanDerWaalsContact O-C 3.28Å; F894-R897 VanDerWaalsContact O-CA 3.3Å; F894-R897 WeakPolarHBondContact O-CA 3.17Å; F894-R897 WeakPolarHBondContact O-CB 3.38Å; F894-R897 PolarHBondContact O-N 3.31Å; A895-R897 PolarHBondContact O-N 2.82Å; R897-T900 PolarHBondContact O-OG1 3.2Å
898	C	59.6	Low	56.8	Low	61 Å²	61	130.6 Å²	130.6	41%	0.412	64%	0.636	S	S	.	*	H	α-helix	trans	-107	-2	178.9	-72.1	0	0	0	0	113.3	F894 A895 T900	F894-C898 VanDerWaalsContact CZ-SG 3.58Å; F894-C898 WeakPolarHBondContact O-CB 3.41Å; F894-C898 PolarHBondContact O-N 3.21Å; F894-C898 PolarHBondContact O-SG 2.74Å; A895-C898 CarbonylContact O-C 3.56Å; A895-C898 PolarHBondContact O-N 2.81Å; A895-C898 VanDerWaalsContact O-N 3.1Å; C898-T900 CarbonylContact C-O 3.55Å; C898-T900 CarbonylContact O-C 3.33Å; C898-T900 PolarHBondContact O-N 3.43Å
899	L	53.9	Low	55.4	Low	153 Å²	153	132.8 Å²	132.8	80%	0.801	65%	0.648	S	S	*	*	S	Bend	trans	-55.8	-20.1	155.8	-94.5	159.3	0	0	0	111.5	A895	A895-L899 PolarHBondContact O-N 2.95Å
900	T	45.9	Very low	54	Low	98 Å²	98	131.2 Å²	131.2	60%	0.601	66%	0.655	S	S	*	*	S	Bend	trans	-89	113.9	153.8	49.1	0	0	0	0	111.7	R897 C898	R897-T900 PolarHBondContact O-OG1 3.2Å; C898-T900 CarbonylContact C-O 3.55Å; C898-T900 CarbonylContact O-C 3.33Å; C898-T900 PolarHBondContact O-N 3.43Å
901	T	42.1	Very low	52.5	Low	122 Å²	122	131 Å²	131	75%	0.748	65%	0.654	S	S	*	*			trans	66.3	96	154.4	59.4	0	0	0	0	121.1
902	S	44.9	Very low	50.9	Low	103 Å²	103	132.1 Å²	132.1	72%	0.72	66%	0.663	S	S	*	*				92.4	145.4	120.5	84.1	0	0	0	0	122.2
903	R	40.6	Very low	49.5	Very low	235 Å²	235	132.3 Å²	132.3	89%	0.887	67%	0.672	S	S	*	*			trans	44.3	104.3	148.1	-67.9	176.3	175.7	172.1	-1.6	118.7
904	R	35.8	Very low	47.9	Very low	255 Å²	255	137.8 Å²	137.8	96%	0.962	69%	0.69	S	S	*	*			trans	-72.7	139.8	148.8	-85.6	-173.6	172.8	172.9	-1.2	110.3
905	L	39.6	Very low	46.2	Very low	151 Å²	151	138 Å²	138	79%	0.791	71%	0.706	S	S	*	*			trans	-94.5	142.8	165.3	-123.1	78.2	0	0	0	110.5
906	R	36.7	Very low	44.6	Very low	193 Å²	193	146.8 Å²	146.8	73%	0.728	73%	0.729	S	S	*	*			trans	13.3	133.3	131	-172.7	-179.4	-175.4	139.6	7.8	118.7	D908	R906-D908 IonicContact CZ-OD1 3.26Å; R906-D908 VanDerWaalsContact CZ-OD1 3.26Å; R906-D908 IonicContact NE-OD1 2.81Å; R906-D908 PolarHBondContact NE-OD1 3.38Å; R906-D908 IonicContact NE-OD2 3.21Å; R906-D908 PolarHBondContact NE-OD2 2.67Å; R906-D908 IonicContact NH2-OD1 2.82Å; R906-D908 PolarHBondContact NH2-OD1 3.36Å
907	S	43.8	Very low	43.4	Very low	115 Å²	115	148.3 Å²	148.3	80%	0.804	74%	0.743	S	S	*	*			trans	-126.8	121.6	160.8	58.5	0	0	0	0	111
908	D	38.2	Very low	42.2	Very low	109 Å²	109	143.9 Å²	143.9	58%	0.583	74%	0.742	S	S	*	*			trans	-92.1	145	176.1	-52.8	-84.1	0	0	0	111.6	R906	R906-D908 IonicContact CZ-OD1 3.26Å; R906-D908 VanDerWaalsContact CZ-OD1 3.26Å; R906-D908 IonicContact NE-OD1 2.81Å; R906-D908 PolarHBondContact NE-OD1 3.38Å; R906-D908 IonicContact NE-OD2 3.21Å; R906-D908 PolarHBondContact NE-OD2 2.67Å; R906-D908 IonicContact NH2-OD1 2.82Å; R906-D908 PolarHBondContact NH2-OD1 3.36Å
909	I	39.8	Very low	41.2	Very low	119 Å²	119	148.4 Å²	148.4	61%	0.61	76%	0.761	S	S	*	*			trans	-139.4	122.9	167.1	-58.6	-178.9	0	0	0	110.1	H618	H618-I909 PolarHBondContact CE1-O 3.13Å; H618-I909 VanDerWaalsContact CE1-O 3.31Å
910	P	42.8	Very low	40.3	Very low	102 Å²	102	151.8 Å²	151.8	66%	0.662	76%	0.764	S	S	*	*			trans	-121.2	157.7	173.2	39.8	-30.6	0	0	0	114.5
911	K	41.6	Very low	40	Very low	154 Å²	154	154.1 Å²	154.1	67%	0.67	77%	0.772	S	S	*	*			trans	-172.1	134.3	155	-97.8	136.6	-161.8	177.9	0	109.2
912	L	42	Very low	39.9	Very low	144 Å²	144	154.7 Å²	154.7	75%	0.754	77%	0.769	S	S	*	*				73.9	143.2	80.7	-91.6	81.9	0	0	0	114.1
913	S	42.5	Very low	39.5	Very low	96 Å²	96	154.5 Å²	154.5	67%	0.671	77%	0.768	S	S	*	*			cis	-164.2	147.8	-9.5	70.2	0	0	0	0	115.6
914	R	40	Very low	39.6	Very low	235 Å²	235	147.7 Å²	147.7	89%	0.887	76%	0.756	S	S	*	*				60.2	116.8	129.9	-164.3	-174	-143.8	173.1	7	121.3
915	S	37.2	Very low	39.8	Very low	124 Å²	124	142.3 Å²	142.3	87%	0.867	75%	0.751	S	S	*	*			trans	-130.6	176.6	143.9	-167.3	0	0	0	0	110.9
916	R	38.1	Very low	39.7	Very low	234 Å²	234	139.8 Å²	139.8	88%	0.883	74%	0.744	S	S	*	*			trans	-112.7	130	-164	-71.1	170.6	163.1	167.1	-7	114.7
917	S	42	Very low	39.6	Very low	119 Å²	119	137.3 Å²	137.3	83%	0.832	75%	0.745	S	S	*	*			trans	-161.4	151.2	130.7	58.2	0	0	0	0	112.3
918	S	38.2	Very low	39.2	Very low	100 Å²	100	138.3 Å²	138.3	70%	0.699	74%	0.741	S	S	*	*			trans	-47	141.8	174.8	-153	0	0	0	0	112.4
919	N	39.1	Very low	38.9	Very low	155 Å²	155	141.1 Å²	141.1	83%	0.829	76%	0.756	S	S	*	*				-148	165.2	61.6	-83.4	-34	0	0	0	115.4
920	R	35.9	Very low	38.5	Very low	224 Å²	224	139 Å²	139	85%	0.845	76%	0.763	S	S	*	*			trans	-82.4	149.9	174.9	-57.3	169.8	179.3	164.6	-2.2	111
921	L	38.5	Very low	38	Very low	147 Å²	147	138.6 Å²	138.6	77%	0.77	77%	0.768	S	S	*	*				171.3	151.8	107.4	-88.7	167.9	0	0	0	111.8
922	I	40.4	Very low	37.6	Very low	135 Å²	135	138 Å²	138	69%	0.692	77%	0.771	S	S	*	*			trans	51	103.3	146.2	-64.7	165.3	0	0	0	116.1
923	S	37.8	Very low	37.1	Very low	99 Å²	99	137.2 Å²	137.2	69%	0.692	77%	0.767	S	S	*	*				65.3	151.3	81	103.3	0	0	0	0	114.2
924	S	41.3	Very low	36.8	Very low	92 Å²	92	143 Å²	143	64%	0.643	78%	0.776	S	S	*	*			cis	-167.6	148.3	9.2	18.1	0	0	0	0	112.3
925	V	39.8	Very low	36.5	Very low	141 Å²	141	135.8 Å²	135.8	86%	0.855	76%	0.761	S	S	*	*			trans	71.5	148.5	148.3	172.4	0	0	0	0	117.8
926	P	38.6	Very low	36.8	Very low	99 Å²	99	135.4 Å²	135.4	64%	0.643	76%	0.756	S	S	*	*			trans	-123.1	-174.5	-168.2	40	-22.4	0	0	0	114.8
927	N	34.5	Very low	36.8	Very low	140 Å²	140	131 Å²	131	75%	0.749	75%	0.75	S	S	*	*			trans	126	148.4	147	-69.5	-23.1	0	0	0	117.1
928	N	35.3	Very low	36.5	Very low	137 Å²	137	129.4 Å²	129.4	73%	0.733	74%	0.739	S	S	*	*			trans	82.9	125.7	156.2	-66.1	-10.6	0	0	0	121.8
929	L	31.6	Very low	36.2	Very low	168 Å²	168	133.5 Å²	133.5	88%	0.88	74%	0.744	S	S	*	*			trans	15.6	121	143.8	-61.3	95.4	0	0	0	118.5
930	G	32.3	Very low	36	Very low	75 Å²	75	129.5 Å²	129.5	77%	0.773	74%	0.74	S	S	*	*			trans	-154.1	12.2	-178	0	0	0	0	0	120.1
931	A	31.8	Very low	36	Very low	93 Å²	93	127.2 Å²	127.2	77%	0.769	74%	0.737	S	S	*	*			trans	48.6	180	152.8	0	0	0	0	0	122.3
932	I	33.7	Very low	35.8	Very low	140 Å²	140	124.2 Å²	124.2	72%	0.718	73%	0.728	S	S	*	*			trans	72.8	105.6	156.5	-62.7	159.7	0	0	0	118.8
933	N	31.4	Very low	35.5	Very low	128 Å²	128	125.7 Å²	125.7	68%	0.684	73%	0.732	S	S	*	*				45.9	136.6	128.3	-47.2	-6.1	0	0	0	119.7
934	Y	35.5	Very low	35.2	Very low	218 Å²	218	127.3 Å²	127.3	86%	0.855	73%	0.733	S	S	*	*				-160.7	164.2	66	-107.1	-85.2	0	0	0	114.6
935	S	34	Very low	35	Very low	83 Å²	83	132.1 Å²	132.1	58%	0.58	75%	0.745	S	S	*	*			trans	-137	152.4	172	170.7	0	0	0	0	110.2
936	P	42.4	Very low	34.7	Very low	116 Å²	116	131.9 Å²	131.9	75%	0.753	74%	0.739	S	S	*	*			trans	-113.4	137	135.4	-3	23.8	0	0	0	109.8
937	N	38.6	Very low	34.4	Very low	141 Å²	141	133.9 Å²	133.9	75%	0.754	74%	0.744	S	S	*	*				79.1	139.3	58	-64.8	-13.9	0	0	0	113.1
938	S	35.6	Very low	34.5	Very low	86 Å²	86	135.3 Å²	135.3	60%	0.601	75%	0.751	S	S	*	*			cis	-172.1	179.3	-8	47.7	0	0	0	0	112.2
939	F	32.8	Very low	34.2	Very low	186 Å²	186	136.3 Å²	136.3	82%	0.816	76%	0.755	S	S	*	*			trans	80.6	125.9	177.9	-56.7	-80.2	0	0	0	115.4	F941	F939-F941 HydrophobicContact CD1-CE2 4.02Å; F939-F941 HydrophobicContact CE1-CE2 4.38Å
940	G	34.8	Very low	34.2	Very low	71 Å²	71	137 Å²	137	73%	0.732	75%	0.751	S	S	*	*			cis	173.3	171.8	-3.7	0	0	0	0	0	109.2
941	F	35.3	Very low	34.1	Very low	177 Å²	177	140.4 Å²	140.4	78%	0.776	75%	0.751	S	S	*	*			cis	-161.5	162.6	-5.9	-115.9	-71.1	0	0	0	109.8	F939	F939-F941 HydrophobicContact CD1-CE2 4.02Å; F939-F941 HydrophobicContact CE1-CE2 4.38Å
942	S	33.8	Very low	34.1	Very low	84 Å²	84	143.3 Å²	143.3	59%	0.587	75%	0.753	S	S	*	*			trans	22.5	148.8	147.1	-78.4	0	0	0	0	124.1
943	E	35.5	Very low	33.9	Very low	166 Å²	166	142.6 Å²	142.6	78%	0.776	75%	0.751	S	S	*	*			cis	-161	-176.4	-3.5	-130	165.2	123.2	0	0	115.6
944	N	30.9	Very low	34	Very low	132 Å²	132	144.5 Å²	144.5	71%	0.706	76%	0.761	S	S	*	*			trans	-69.4	161.3	-171.5	-53.7	-73.4	0	0	0	116.7
945	H	36.6	Very low	33.7	Very low	194 Å²	194	138.1 Å²	138.1	90%	0.898	75%	0.745	S	S	*	*				-159.3	157.4	123.6	-122.1	-85.9	0	0	0	114.3
946	N	34.6	Very low	33.5	Very low	136 Å²	136	144.4 Å²	144.4	73%	0.727	76%	0.757	S	S	*	*			trans	-103.1	154.9	-173.1	-84.2	-48.3	0	0	0	114.9
947	N	31.4	Very low	32.9	Very low	140 Å²	140	145.2 Å²	145.2	75%	0.749	75%	0.754	S	S	*	*			trans	40.9	115.2	148.5	-61.4	-17	0	0	0	120.4
948	N	35.8	Very low	32.4	Very low	170 Å²	170	143.2 Å²	143.2	91%	0.909	75%	0.751	S	S	*	*				-165.9	166.1	125.6	-107.5	-50.3	0	0	0	113.9
949	I	30.1	Very low	32.1	Very low	158 Å²	158	148.9 Å²	148.9	81%	0.81	77%	0.765	S	S	*	*			trans	-107.7	121.9	-165.6	-59.8	165	0	0	0	112.5
950	K	32.3	Very low	31.9	Very low	184 Å²	184	147.1 Å²	147.1	80%	0.8	76%	0.764	S	S	*	*			trans	-177.9	132.3	154.2	-98.9	147.2	-173.2	179.9	0	109
951	L	29.1	Very low	31.5	Very low	146 Å²	146	151 Å²	151	76%	0.764	77%	0.766	S	S	*	*				48.6	111.1	91.8	-72.2	146.9	0	0	0	111.6
952	N	33	Very low	31.2	Very low	153 Å²	153	150.4 Å²	150.4	82%	0.818	77%	0.766	S	S	*	*			cis	-135.9	160.6	44.6	-93.4	-22.4	0	0	0	115.5
953	N	29.2	Very low	30.7	Very low	126 Å²	126	153.7 Å²	153.7	67%	0.674	77%	0.774	S	S	*	*			trans	-88	152.9	176.9	-63.2	-29.6	0	0	0	112.8
954	N	31.8	Very low	30.4	Very low	167 Å²	167	151.8 Å²	151.8	89%	0.893	78%	0.779	S	S	*	*			trans	-158.5	74.8	137.8	-103.2	-20.6	0	0	0	109.6
955	T	29.8	Very low	30.4	Very low	85 Å²	85	148.9 Å²	148.9	52%	0.521	78%	0.78	S	S	.	*			trans	-131.9	101.8	-172.8	28	0	0	0	0	111.6	I957	T955-I957 HydrophobicContact CG2-CD1 4.48Å
956	Y	29.9	Very low	30.1	Very low	214 Å²	214	146.9 Å²	146.9	84%	0.839	77%	0.774	S	S	*	*			trans	-147.4	107.9	163.3	-67.4	-71.9	0	0	0	106
957	I	29.5	Very low	29.7	Very low	134 Å²	134	147.3 Å²	147.3	69%	0.687	78%	0.776	S	S	*	*			cis	62.6	109.3	20.7	-56.4	-177.3	0	0	0	113	T955	T955-I957 HydrophobicContact CG2-CD1 4.48Å
958	S	27.7	Very low	29.6	Very low	99 Å²	99	145.9 Å²	145.9	69%	0.692	78%	0.777	S	S	*	*			trans	-10.8	140.2	169.1	59.8	0	0	0	0	119.6
959	K	30.1	Very low	29.3	Very low	205 Å²	205	146.4 Å²	146.4	89%	0.891	77%	0.771	S	S	*	*			trans	-126.7	127.1	137.8	-82.7	-174.1	175.6	176.4	0	111
960	N	28	Very low	29.3	Very low	148 Å²	148	145.9 Å²	145.9	79%	0.791	77%	0.769	S	S	*	*			trans	-88.5	171.9	157.9	-75.7	-32.6	0	0	0	109.5
961	I	27.4	Very low	29.3	Very low	153 Å²	153	140 Å²	140	79%	0.785	76%	0.761	S	S	*	*			trans	81.2	124.4	155.1	-21.9	-177	0	0	0	120.1
962	H	27.6	Very low	29.3	Very low	164 Å²	164	140.6 Å²	140.6	76%	0.759	76%	0.759	S	S	*	*			trans	97	165.9	145.6	-103.9	-58.5	0	0	0	122.5
963	M	25.1	Very low	29.1	Very low	153 Å²	153	140.5 Å²	140.5	75%	0.754	76%	0.759	S	S	*	*			trans	-108.2	169.7	-147.1	-63	161.9	165.8	0	0	114.3
964	S	28.1	Very low	29.1	Very low	127 Å²	127	138.8 Å²	138.8	89%	0.888	75%	0.753	S	S	*	*			trans	79.1	153.9	145	76.4	0	0	0	0	119.1
965	G	30.4	Very low	28.8	Very low	70 Å²	70	136.2 Å²	136.2	72%	0.722	75%	0.748	S	S	*	*			trans	136.9	37	157.3	0	0	0	0	0	122.1
966	I	30.3	Very low	28.7	Very low	152 Å²	152	142.9 Å²	142.9	78%	0.779	76%	0.764	S	S	*	*			trans	38.8	110.3	144.5	-62.1	175.6	0	0	0	120
967	N	28.1	Very low	28.6	Very low	145 Å²	145	139 Å²	139	78%	0.775	76%	0.757	S	S	*	*			trans	61	147.1	139.6	-61.9	-11.2	0	0	0	124.9
968	S	29.3	Very low	28.4	Very low	110 Å²	110	140.8 Å²	140.8	77%	0.769	76%	0.763	S	S	*	*			trans	81.8	143.8	149.6	78.1	0	0	0	0	118.4
969	K	29	Very low	28.2	Very low	181 Å²	181	143.4 Å²	143.4	79%	0.787	77%	0.768	S	S	*	*			cis	-164.8	148.9	-1.7	-123.8	173	175.4	-176	0	112.4
970	I	29.2	Very low	27.9	Very low	148 Å²	148	140.7 Å²	140.7	76%	0.759	76%	0.763	S	S	*	*			trans	71.4	143.7	146.3	-69.3	160.4	0	0	0	120.5
971	G	32.9	Very low	27.7	Very low	61 Å²	61	140.7 Å²	140.7	63%	0.629	76%	0.761	S	S	*	*			trans	123	82.7	-179.2	0	0	0	0	0	109.9
972	Q	28.9	Very low	27.4	Very low	157 Å²	157	138.2 Å²	138.2	73%	0.734	76%	0.758	S	S	*	*				56.3	124.2	78.8	-59.6	-175.8	-84.4	0	0	112.1	T974	Q972-T974 HydrophobicContact CG-CG2 4.36Å
973	D	28.9	Very low	27.3	Very low	151 Å²	151	138.6 Å²	138.6	81%	0.807	76%	0.76	S	S	*	*			cis	-86.8	130.1	10	-55.1	-57.5	0	0	0	113.1
974	T	28.3	Very low	27.3	Very low	90 Å²	90	137.7 Å²	137.7	55%	0.552	76%	0.763	S	S	*	*				50.7	92.8	68.8	62.7	0	0	0	0	113.5	Q972	Q972-T974 HydrophobicContact CG-CG2 4.36Å
975	S	27.2	Very low	27.2	Very low	113 Å²	113	142.1 Å²	142.1	79%	0.79	76%	0.76	S	S	*	*				67.6	109.5	83.4	-62.9	0	0	0	0	114
976	R	26.3	Very low	27	Very low	226 Å²	226	143.8 Å²	143.8	85%	0.853	76%	0.758	S	S	*	*			trans	-149.9	109.6	141.6	-127.1	164.5	-174.6	151.8	3.6	110.6
977	D	28.9	Very low	26.8	Very low	131 Å²	131	146.4 Å²	146.4	70%	0.701	76%	0.764	S	S	*	*			trans	40.2	112.8	139.3	-41.2	-28.8	0	0	0	116.8
978	Q	24.9	Very low	26.7	Very low	173 Å²	173	145.5 Å²	145.5	81%	0.808	76%	0.76	S	S	*	*	S	Bend		43.5	104	77.2	-76.1	-160.4	-9.6	0	0	115
979	L	23.6	Very low	26.6	Very low	153 Å²	153	147.4 Å²	147.4	80%	0.801	75%	0.751	S	S	*	*			trans	67.2	168.2	158.3	-64.3	152.3	0	0	0	115.8
980	L	24	Very low	26.4	Very low	149 Å²	149	146 Å²	146	78%	0.78	75%	0.747	S	S	*	*			trans	66.2	113.5	-171.1	-64.8	99.1	0	0	0	113.2
981	I	23	Very low	26.4	Very low	147 Å²	147	148.3 Å²	148.3	75%	0.754	76%	0.755	S	S	*	*				77.8	112.9	72.6	-69.9	165.1	0	0	0	111.5
982	S	22.3	Very low	26.2	Very low	102 Å²	102	154.7 Å²	154.7	71%	0.713	77%	0.768	S	S	*	*			trans	34.6	116.8	162.6	63	0	0	0	0	119.5
983	E	25.3	Very low	26.1	Very low	172 Å²	172	155 Å²	155	80%	0.804	78%	0.775	S	S	*	*				-156	134.8	105.6	-118.5	179.5	-151.7	0	0	112.9
984	T	23.9	Very low	26	Very low	133 Å²	133	156.7 Å²	156.7	82%	0.816	78%	0.778	S	S	*	*			trans	-77.9	130.8	176.8	45.7	0	0	0	0	111.5
985	R	25.9	Very low	26	Very low	221 Å²	221	161 Å²	161	83%	0.834	79%	0.792	S	S	*	*			trans	-135.2	134.1	152.1	-67.4	-166.7	-177.7	-158.7	-0.9	110.2
986	P	25.7	Very low	26.1	Very low	104 Å²	104	162.7 Å²	162.7	68%	0.675	79%	0.792	S	S	*	*			trans	-80	158.9	-171.9	32.7	-36.6	0	0	0	112.9	N988	P986-N988 WeakPolarHBondContact CG-OD1 3.3Å; P986-N988 PolarHBondContact O-N 3.41Å; P986-N988 VanDerWaalsContact O-N 3.08Å
987	F	26.3	Very low	26.1	Very low	207 Å²	207	161.1 Å²	161.1	91%	0.908	80%	0.795	S	S	*	*			trans	-67.9	96.6	158.2	-105.9	-95.8	0	0	0	108.6	Y989	F987-Y989 PolarHBondContact O-N 2.89Å
988	N	26.3	Very low	26	Very low	127 Å²	127	164.5 Å²	164.5	68%	0.679	81%	0.806	S	S	*	*			trans	-69.4	121.3	176.1	-100.8	32.5	0	0	0	110.8	P986 E990	P986-N988 WeakPolarHBondContact CG-OD1 3.3Å; P986-N988 PolarHBondContact O-N 3.41Å; P986-N988 VanDerWaalsContact O-N 3.08Å; N988-E990 VanDerWaalsContact C-N 3.26Å; N988-E990 PolarHBondContact O-N 3.44Å
989	Y	26.7	Very low	26.2	Very low	149 Å²	149	160 Å²	160	58%	0.584	81%	0.805	S	S	*	*			trans	-83.4	57.7	-175.8	-126.6	-83.7	0	0	0	111.6	N827 F987	N827-Y989 PolarHBondContact ND2-OH 2.73Å; F987-Y989 PolarHBondContact O-N 2.89Å
990	E	26.3	Very low	26.3	Very low	153 Å²	153	159 Å²	159	72%	0.715	81%	0.806	S	S	*	*			trans	-150.3	88	-169.1	-127.5	173.9	-155	0	0	113.8	N988	N988-E990 VanDerWaalsContact C-N 3.26Å; N988-E990 PolarHBondContact O-N 3.44Å
991	Q	28.2	Very low	26.5	Very low	196 Å²	196	163.2 Å²	163.2	92%	0.916	81%	0.813	S	S	*	*	S	Bend	trans	173	53.3	151.1	-99	172.1	40.8	0	0	113.7
992	Q	29.7	Very low	26.8	Very low	194 Å²	194	167 Å²	167	91%	0.907	82%	0.818	S	S	*	*			trans	-152.2	33.5	169.3	-127.5	164	38.1	0	0	116.2
993	N	25.7	Very low	27	Very low	163 Å²	163	167.4 Å²	167.4	87%	0.872	82%	0.816	S	S	*	*			trans	-119.3	52.9	179.8	-126.3	-8.8	0	0	0	111.9
994	Q	27.4	Very low	27.2	Very low	187 Å²	187	165.5 Å²	165.5	87%	0.874	81%	0.812	S	S	*	*			trans	-162.2	59.4	178.4	-129	166	73.7	0	0	115.2
995	Q	29	Very low	27.5	Very low	181 Å²	181	166 Å²	166	85%	0.846	81%	0.805	S	S	*	*	S	Bend	trans	-161.4	140.4	153.9	-112.7	154	38	0	0	113.1
996	N	29.6	Very low	27.5	Very low	149 Å²	149	163.9 Å²	163.9	80%	0.797	80%	0.802	S	S	*	*			trans	60	80.2	161.1	-57.1	-1.8	0	0	0	118.1
997	Q	25.4	Very low	27.6	Very low	193 Å²	193	164.3 Å²	164.3	90%	0.902	81%	0.807	S	S	*	*			trans	-64.2	125.4	138.2	-62.1	168.3	-29.7	0	0	108.9
998	E	27.6	Very low	27.8	Very low	202 Å²	202	159.6 Å²	159.6	94%	0.944	81%	0.806	S	S	*	*			trans	176	142.1	147.2	-104.2	172.8	-160.9	0	0	109.2
999	G	28.6	Very low	27.8	Very low	77 Å²	77	158.8 Å²	158.8	79%	0.794	81%	0.811	S	S	*	*			trans	134	62	177.8	0	0	0	0	0	115.9	Y1001	G999-Y1001 PolarHBondContact O-N 2.92Å
1000	T	26.5	Very low	27.9	Very low	132 Å²	132	158.7 Å²	158.7	81%	0.81	82%	0.82	S	S	*	*			trans	-61.1	131.2	163.8	44.4	0	0	0	0	111.4
1001	Y	28.1	Very low	27.9	Very low	239 Å²	239	160.2 Å²	160.2	94%	0.937	83%	0.827	S	S	*	*			trans	-134	139.5	143.6	-103.9	-77.2	0	0	0	112.5	G999	G999-Y1001 PolarHBondContact O-N 2.92Å
1002	R	28	Very low	27.8	Very low	225 Å²	225	159.3 Å²	159.3	85%	0.849	82%	0.82	S	S	*	*			trans	-100.4	150.8	-175.1	-166.5	-178.5	-174.9	159.2	-0.3	108.5
1003	T	26.2	Very low	27.6	Very low	111 Å²	111	155.4 Å²	155.4	68%	0.681	81%	0.812	S	S	*	*			trans	-58	145.6	163.7	55.1	0	0	0	0	109.1
1004	D	30.9	Very low	27.4	Very low	133 Å²	133	152.4 Å²	152.4	71%	0.711	80%	0.804	S	S	*	*				-166.2	145.8	82.2	-84.7	-37	0	0	0	115.6
1005	Q	28.8	Very low	27.5	Very low	142 Å²	142	148.6 Å²	148.6	66%	0.664	80%	0.798	S	S	*	*			trans	17.5	137.8	151.1	-59.4	-166.3	11.2	0	0	123.6
1006	K	27.2	Very low	27.4	Very low	177 Å²	177	146.9 Å²	146.9	77%	0.77	79%	0.788	S	S	*	*			trans	74.2	142.7	148.2	-69.5	157.9	-179.3	154.5	0	117.9
1007	S	27.3	Very low	27.4	Very low	113 Å²	113	146.2 Å²	146.2	79%	0.79	78%	0.784	S	S	*	*			cis	-168.1	131.4	-17.2	45.7	0	0	0	0	110.6
1008	A	30.4	Very low	27.4	Very low	108 Å²	108	144.4 Å²	144.4	89%	0.893	78%	0.775	S	S	*	*			trans	-139.1	120.2	161	0	0	0	0	0	108.8
1009	S	25.7	Very low	27.5	Very low	110 Å²	110	139.3 Å²	139.3	77%	0.769	76%	0.762	S	S	*	*			trans	-87.2	120.9	-177.6	51.8	0	0	0	0	111.3
1010	L	30.5	Very low	27.4	Very low	148 Å²	148	141.9 Å²	141.9	78%	0.775	76%	0.758	S	S	*	*			trans	-128.3	82.4	163	-96.8	162.8	0	0	0	108.8	F1012	L1010-F1012 HydrophobicContact CD2-CD2 4.02Å; L1010-F1012 HydrophobicContact CD2-CE2 3.58Å; L1010-F1012 HydrophobicContact CD2-CZ 4.27Å; L1010-F1012 PolarHBondContact O-N 2.85Å
1011	Q	24.4	Very low	27.5	Very low	184 Å²	184	141.9 Å²	141.9	86%	0.86	75%	0.751	S	S	*	*			trans	-81.1	107.9	166.3	-70.3	179.7	-86.5	0	0	108.5
1012	F	27.8	Very low	27.4	Very low	177 Å²	177	135.8 Å²	135.8	78%	0.776	74%	0.744	S	S	*	*			trans	-110.8	156	161.3	-82.9	-55.3	0	0	0	109.5	L1010	L1010-F1012 HydrophobicContact CD2-CD2 4.02Å; L1010-F1012 HydrophobicContact CD2-CE2 3.58Å; L1010-F1012 HydrophobicContact CD2-CZ 4.27Å; L1010-F1012 PolarHBondContact O-N 2.85Å
1013	P	24	Very low	27.4	Very low	113 Å²	113	130.1 Å²	130.1	73%	0.734	75%	0.745	S	S	*	*			trans	-121.8	-170.4	-136.7	28.3	-6.8	0	0	0	114.2
1014	S	22.9	Very low	27.5	Very low	100 Å²	100	127.9 Å²	127.9	70%	0.699	74%	0.744	S	S	*	*			trans	-42.8	135.7	176.9	52.2	0	0	0	0	117.8
1015	S	28.7	Very low	27.4	Very low	107 Å²	107	129.3 Å²	129.3	75%	0.748	75%	0.75	S	S	*	*				-132.7	136.4	126.3	63.5	0	0	0	0	106.9
1016	F	26.2	Very low	27.3	Very low	145 Å²	145	127.9 Å²	127.9	64%	0.636	76%	0.756	S	S	*	*				58.5	130.6	57.2	-76.6	-86.7	0	0	0	112
1017	D	30.8	Very low	27.6	Very low	135 Å²	135	124.8 Å²	124.8	72%	0.722	76%	0.756	S	S	*	*			cis	-119.8	159.2	5.7	-56.7	-63.6	0	0	0	111
1018	Q	25.7	Very low	27.7	Very low	154 Å²	154	125.6 Å²	125.6	72%	0.72	75%	0.752	S	S	*	*			cis	72.7	68.3	4.4	-155.7	173.2	10.9	0	0	119
1019	S	28	Very low	27.9	Very low	96 Å²	96	126.3 Å²	126.3	67%	0.671	75%	0.747	S	S	*	*			trans	178.7	157.4	151.9	30.2	0	0	0	0	111.1
1020	D	27.8	Very low	28.1	Very low	130 Å²	130	128.5 Å²	128.5	70%	0.695	75%	0.745	S	S	*	*			cis	-160.2	145.6	-28	-110.9	-14.7	0	0	0	113.4
1021	I	27.7	Very low	28.3	Very low	132 Å²	132	125.9 Å²	125.9	68%	0.677	74%	0.737	S	S	*	*			trans	49.4	100.8	131.6	-61.4	170.7	0	0	0	120
1022	S	25.6	Very low	28.7	Very low	111 Å²	111	126.5 Å²	126.5	78%	0.776	74%	0.74	S	S	*	*				72.4	155.3	121.6	-55.9	0	0	0	0	123.9
1023	A	28.6	Very low	28.6	Very low	107 Å²	107	123 Å²	123	88%	0.884	73%	0.734	S	S	*	*			trans	69.2	141.9	168.3	0	0	0	0	0	117.5
1024	G	29.7	Very low	29.1	Very low	63 Å²	63	128.8 Å²	128.8	65%	0.649	74%	0.742	S	S	*	*			cis	178.3	157.4	-9.8	0	0	0	0	0	115
1025	I	27.4	Very low	29.5	Very low	163 Å²	163	130.6 Å²	130.6	84%	0.836	74%	0.744	S	S	*	*			trans	45.6	109.5	141.4	-52.2	172.1	0	0	0	118.2
1026	S	27.2	Very low	29.7	Very low	113 Å²	113	129.8 Å²	129.8	79%	0.79	74%	0.744	S	S	*	*			trans	67.2	152.7	160.3	78.9	0	0	0	0	116.4
1027	S	32.9	Very low	29.8	Very low	111 Å²	111	133.1 Å²	133.1	78%	0.776	75%	0.752	S	S	*	*			cis	-151.6	153.4	21	44.2	0	0	0	0	113.3
1028	D	30.3	Very low	29.8	Very low	130 Å²	130	133 Å²	133	70%	0.695	75%	0.747	S	S	*	*			trans	-56.6	158.8	156.8	-117.8	-56.7	0	0	0	110.2	Q1030	D1028-Q1030 PolarHBondContact OD1-N 3.2Å; D1028-Q1030 VanDerWaalsContact OD1-N 3.16Å
1029	P	34.8	Very low	30	Very low	124 Å²	124	132.3 Å²	132.3	81%	0.805	74%	0.744	S	S	*	*				-147.6	146.7	59.3	42.9	-23.6	0	0	0	119.1
1030	Q	29.5	Very low	30.2	Very low	155 Å²	155	134 Å²	134	72%	0.724	74%	0.741	S	S	*	*			trans	-34.3	-178.4	134.3	-78.8	-136.3	-10.6	0	0	116.9	D1028	D1028-Q1030 PolarHBondContact OD1-N 3.2Å; D1028-Q1030 VanDerWaalsContact OD1-N 3.16Å
1031	P	35.3	Very low	30.4	Very low	94 Å²	94	134 Å²	134	61%	0.61	74%	0.737	S	S	*	*			cis	-135.7	171	-42.1	36.4	-21.6	0	0	0	112.2
1032	Q	31.6	Very low	30.6	Very low	196 Å²	196	135.2 Å²	135.2	92%	0.916	74%	0.739	S	S	*	*			trans	-137.9	118.1	147.4	-75.4	-157.6	-5.2	0	0	113.1
1033	T	26.4	Very low	31	Very low	104 Å²	104	135.5 Å²	135.5	64%	0.638	74%	0.739	S	S	*	*			trans	-78.7	152.5	171.3	52.8	0	0	0	0	111.9
1034	Y	35	Very low	31	Very low	234 Å²	234	137 Å²	137	92%	0.918	74%	0.737	S	S	*	*			trans	-142.2	146.9	142.3	-115.6	-80.5	0	0	0	112.2
1035	N	29.6	Very low	31	Very low	138 Å²	138	140.4 Å²	140.4	74%	0.738	75%	0.749	S	S	*	*			trans	-113.7	138.4	-166.1	-69.6	-80.9	0	0	0	113.5
1036	A	34.3	Very low	30.9	Very low	90 Å²	90	139.1 Å²	139.1	74%	0.744	74%	0.744	S	S	*	*			trans	-158.4	127	137.9	0	0	0	0	0	107.2
1037	R	27.8	Very low	31.2	Very low	216 Å²	216	141.6 Å²	141.6	82%	0.815	75%	0.747	S	S	*	*				64.2	132	58.6	-68.3	-170.6	177.5	-170	1.8	111.9
1038	Q	31	Very low	31	Very low	131 Å²	131	144.5 Å²	144.5	61%	0.612	75%	0.748	S	S	*	*			cis	-162.6	150.1	17.8	-126	161.9	-82.3	0	0	112.4
1039	Q	29	Very low	30.9	Very low	141 Å²	141	143.4 Å²	143.4	66%	0.659	75%	0.751	S	S	*	*			trans	64.4	157.1	148.2	-68.2	159	-47.5	0	0	118.5
1040	Q	32	Very low	30.8	Very low	131 Å²	131	147.9 Å²	147.9	61%	0.612	75%	0.753	S	S	*	*			cis	-157	169.5	-10.6	-111.6	158.1	-105.5	0	0	105.6
1041	H	33.3	Very low	30.8	Very low	131 Å²	131	149.8 Å²	149.8	61%	0.606	76%	0.762	S	S	*	*			cis	-164.7	145.4	9.6	-122.8	-36.3	0	0	0	109.8
1042	H	32	Very low	30.6	Very low	156 Å²	156	152.5 Å²	152.5	72%	0.722	77%	0.767	S	S	*	*			trans	56.2	160	148.9	-69.3	-52.7	0	0	0	123.1
1043	P	34	Very low	30.7	Very low	118 Å²	118	152 Å²	152	77%	0.766	77%	0.769	S	S	*	*			cis	-130	171.8	-32.5	36.3	-20	0	0	0	113.9
1044	T	27	Very low	30.9	Very low	137 Å²	137	152.9 Å²	152.9	84%	0.84	77%	0.766	S	S	*	*			trans	-79.1	150.5	-178.5	49.6	0	0	0	0	114.9
1045	C	29.7	Very low	30.6	Very low	135 Å²	135	149.4 Å²	149.4	91%	0.912	76%	0.758	S	S	*	*			trans	-128.9	151	144.8	-160.1	0	0	0	0	109.2
1046	N	26	Very low	30.7	Very low	136 Å²	136	151.1 Å²	151.1	73%	0.727	76%	0.761	S	S	*	*			trans	-136.1	145.7	-163.7	-167.1	13.6	0	0	0	109.9
1047	I	34.6	Very low	30.6	Very low	166 Å²	166	155.8 Å²	155.8	85%	0.851	77%	0.767	S	S	*	*			trans	176.5	148.3	152.1	-95.4	152	0	0	0	109.7
1048	Q	27.1	Very low	30.8	Very low	172 Å²	172	150.4 Å²	150.4	80%	0.804	76%	0.76	S	S	*	*			trans	-101.4	151	-168.5	-55.5	147.2	-69.3	0	0	112.7
1049	S	29.9	Very low	30.9	Very low	106 Å²	106	155.2 Å²	155.2	74%	0.741	77%	0.774	S	S	*	*			trans	169.7	170.9	131.5	47.9	0	0	0	0	112.5
1050	Y	32.7	Very low	31.1	Very low	218 Å²	218	154.7 Å²	154.7	86%	0.855	78%	0.781	S	S	*	*			trans	68.6	53.6	173	-69.4	-78.9	0	0	0	118.9
1051	Q	28.4	Very low	31.1	Very low	195 Å²	195	156.8 Å²	156.8	91%	0.911	79%	0.791	S	S	*	*			trans	-111.6	97.4	133.1	-84.5	-169.6	-25	0	0	109.4
1052	Q	31.7	Very low	31	Very low	152 Å²	152	158.5 Å²	158.5	71%	0.71	80%	0.804	S	S	*	*			trans	-169.9	115.9	154.2	-116.9	173.3	1.2	0	0	112.8	Q1054	Q1052-Q1054 HydrophobicContact CG-CG 4.47Å
1053	L	32.3	Very low	30.9	Very low	185 Å²	185	159 Å²	159	97%	0.969	81%	0.807	S	S	*	*			trans	-150.5	70.9	149.4	-115.5	176.8	0	0	0	107.2
1054	Q	30.7	Very low	30.9	Very low	123 Å²	123	159.6 Å²	159.6	58%	0.575	81%	0.809	S	S	*	*			trans	-85.5	134.5	-176	-74.9	178.4	-91.6	0	0	112	Q1052	Q1052-Q1054 HydrophobicContact CG-CG 4.47Å
1055	Q	29.5	Very low	31.1	Very low	160 Å²	160	159.8 Å²	159.8	75%	0.748	81%	0.805	S	S	*	*				34.1	96.3	129.1	-57.5	166.2	-51.7	0	0	117.9
1056	H	32.3	Very low	31.2	Very low	175 Å²	175	159.9 Å²	159.9	81%	0.81	79%	0.794	S	S	*	*			trans	-140.1	103.1	149.8	-95.8	-16.7	0	0	0	111
1057	H	32.1	Very low	31.6	Very low	188 Å²	188	161.8 Å²	161.8	87%	0.87	80%	0.796	S	S	*	*			trans	-169.7	89.4	145.4	-99	-58.1	0	0	0	109.8
1058	P	32.4	Very low	31.3	Very low	102 Å²	102	164.3 Å²	164.3	66%	0.662	80%	0.795	S	S	*	*			trans	-88.1	132.3	164.5	33.6	-28.4	0	0	0	110
1059	Y	33.2	Very low	31.6	Very low	232 Å²	232	166.6 Å²	166.6	91%	0.91	80%	0.803	S	S	*	*			trans	-144.2	127.4	148.6	-97.7	-70.2	0	0	0	109.6
1060	T	33.1	Very low	31.6	Very low	131 Å²	131	166.6 Å²	166.6	80%	0.804	80%	0.799	S	S	*	*			trans	-89	170.8	-175.3	46.1	0	0	0	0	112.1
1061	H	30.7	Very low	31.6	Very low	174 Å²	174	164.7 Å²	164.7	81%	0.806	80%	0.799	S	S	*	*			trans	-41.3	140	166.4	-90.6	-110	0	0	0	113.4
1062	N	32.7	Very low	32	Very low	167 Å²	167	161.3 Å²	161.3	89%	0.893	79%	0.794	S	S	*	*			trans	-152.5	155.5	134.9	-108.9	-12.4	0	0	0	109.6
1063	E	29.3	Very low	32.3	Very low	167 Å²	167	159.4 Å²	159.4	78%	0.78	80%	0.795	S	S	*	*			trans	-95.1	-176.9	-175.2	-61.2	175.7	99.6	0	0	112.6
1064	T	32.7	Very low	32.4	Very low	131 Å²	131	156 Å²	156	80%	0.804	79%	0.787	S	S	*	*			trans	82.6	157.5	162.6	68.7	0	0	0	0	119.4
1065	D	32.7	Very low	32.6	Very low	141 Å²	141	156.6 Å²	156.6	75%	0.754	80%	0.799	S	S	*	*			trans	55.1	107.7	-178	-66.3	-21.8	0	0	0	118.6
1066	I	32.1	Very low	32.8	Very low	136 Å²	136	155.6 Å²	155.6	70%	0.697	80%	0.803	S	S	*	*			cis	77	126.2	35.1	-49.7	176.4	0	0	0	114.4
1067	K	33.3	Very low	32.8	Very low	177 Å²	177	158.3 Å²	158.3	77%	0.77	81%	0.806	S	S	*	*			trans	74.2	106.2	-179.2	-64.9	138.4	-172.2	170.1	0	114.3
1068	R	28.7	Very low	33	Very low	219 Å²	219	153.6 Å²	153.6	83%	0.826	79%	0.794	S	S	*	*				68.6	107.1	81.2	-74.3	-175.2	-175.5	-178.8	2.2	113.7
1069	F	32.3	Very low	33.1	Very low	219 Å²	219	155.1 Å²	155.1	96%	0.961	80%	0.797	S	S	*	*			trans	-126.8	140.6	138.8	-102	-89.2	0	0	0	108.6
1070	T	31.3	Very low	33	Very low	107 Å²	107	152.9 Å²	152.9	66%	0.656	79%	0.792	S	S	*	*			trans	-152.4	149.7	-167.8	45.6	0	0	0	0	111.4
1071	M	31.7	Very low	33.1	Very low	177 Å²	177	153.1 Å²	153.1	87%	0.872	79%	0.789	S	S	*	*			trans	70.9	163.7	163.5	-77.1	-178.5	-179	0	0	115.8
1072	P	37.1	Very low	33.2	Very low	124 Å²	124	150.9 Å²	150.9	81%	0.805	79%	0.787	S	S	*	*			cis	-127.8	174.4	16.8	39.9	-22.8	0	0	0	118.2
1073	P	38.6	Very low	33.2	Very low	112 Å²	112	146.6 Å²	146.6	73%	0.727	78%	0.783	S	S	*	*			trans	-121.4	168.2	-174.5	42.7	-31	0	0	0	116.3
1074	S	35.1	Very low	33.3	Very low	113 Å²	113	144.5 Å²	144.5	79%	0.79	78%	0.781	S	S	*	*			trans	-160	115.7	160.2	53.2	0	0	0	0	109.5
1075	V	34.2	Very low	33.4	Very low	136 Å²	136	145.2 Å²	145.2	82%	0.824	79%	0.785	S	S	*	*				90.8	114.4	63.7	165.3	0	0	0	0	113.7
1076	V	34.2	Very low	33.2	Very low	139 Å²	139	145.5 Å²	145.5	84%	0.842	79%	0.787	S	S	*	*			trans	-161.5	117.6	141.9	149.8	0	0	0	0	110.1
1077	R	32.6	Very low	33.2	Very low	233 Å²	233	147.3 Å²	147.3	88%	0.879	80%	0.795	S	S	*	*			trans	11.4	157.2	142.3	-76.2	-178.4	177.5	167.2	-1	122.9
1078	S	35.2	Very low	32.9	Very low	88 Å²	88	146.5 Å²	146.5	62%	0.615	80%	0.799	S	S	*	*			cis	-175.5	149.6	-2.9	45.2	0	0	0	0	115.6
1079	N	34.1	Very low	32.9	Very low	135 Å²	135	139.5 Å²	139.5	72%	0.722	79%	0.794	S	S	*	*			trans	65.6	152.8	147.5	-59.6	11.2	0	0	0	118.5
1080	F	32.2	Very low	32.8	Very low	185 Å²	185	136.9 Å²	136.9	81%	0.811	79%	0.791	S	S	*	*			cis	-143	171.8	35.2	-125.4	-91	0	0	0	116.4
1081	N	33.9	Very low	32.5	Very low	136 Å²	136	137 Å²	137	73%	0.727	80%	0.795	S	S	*	*			trans	-70.8	179.6	-176.6	-71.9	-4.1	0	0	0	115.9
1082	V	33.5	Very low	32.5	Very low	126 Å²	126	136.2 Å²	136.2	76%	0.764	79%	0.789	S	S	*	*			cis	-171.1	149.7	-27.7	147.5	0	0	0	0	105.6
1083	G	33.2	Very low	32.1	Very low	78 Å²	78	136.6 Å²	136.6	80%	0.804	78%	0.783	S	S	*	*			trans	-175.2	104	165.8	0	0	0	0	0	113.6
1084	T	31.4	Very low	31.5	Very low	123 Å²	123	141.7 Å²	141.7	76%	0.755	79%	0.788	S	S	*	*			trans	-118.6	140.3	-171	52	0	0	0	0	113.6
1085	T	33.7	Very low	31.3	Very low	145 Å²	145	143.7 Å²	143.7	89%	0.89	79%	0.785	S	S	*	*			trans	-153.1	140.8	147.5	9.2	0	0	0	0	110.7
1086	N	30	Very low	31.2	Very low	147 Å²	147	143.3 Å²	143.3	79%	0.786	78%	0.777	S	S	*	*			trans	-97.9	150.1	171.2	-69.4	-26.9	0	0	0	109.4
1087	M	30.4	Very low	31.1	Very low	174 Å²	174	143.7 Å²	143.7	86%	0.857	77%	0.774	S	S	*	*				173.4	156.3	101.3	-90.9	-164.5	-179	0	0	113.5
1088	N	28.6	Very low	31.1	Very low	161 Å²	161	145.3 Å²	145.3	86%	0.861	79%	0.792	S	S	*	*			trans	-33.3	150.7	170	-43.3	-15.1	0	0	0	116.3
1089	G	28.7	Very low	30.9	Very low	71 Å²	71	148.2 Å²	148.2	73%	0.732	80%	0.801	S	S	*	*			trans	165.9	115.2	160.1	0	0	0	0	0	113.4
1090	D	29.5	Very low	30.7	Very low	165 Å²	165	148.9 Å²	148.9	88%	0.882	81%	0.805	S	S	*	*			trans	-17.3	155.9	153.8	-51.7	-45.2	0	0	0	116.5
1091	C	25.4	Very low	30.6	Very low	110 Å²	110	146.9 Å²	146.9	74%	0.743	81%	0.805	S	S	*	*			cis	169.6	-175.1	-7.5	-173.3	0	0	0	0	104.3
1092	E	30	Very low	30.4	Very low	160 Å²	160	147.5 Å²	147.5	75%	0.748	81%	0.809	S	S	*	*			trans	74.4	136.2	159.1	-62.4	-141.8	128.6	0	0	121.8
1093	L	29.2	Very low	30.3	Very low	132 Å²	132	148.9 Å²	148.9	69%	0.691	81%	0.812	S	S	*	*			trans	52.1	114	154.1	-80.3	71.5	0	0	0	119.9
1094	W	27.2	Very low	30.1	Very low	219 Å²	219	153.6 Å²	153.6	83%	0.83	81%	0.813	S	S	*	*				92.1	138.3	56.6	-94	103.9	0	0	0	113.5
1095	Q	30.9	Very low	30	Very low	155 Å²	155	155.8 Å²	155.8	72%	0.724	82%	0.817	S	S	*	*			trans	71.5	145.7	162.3	-68.6	-168.2	-8.8	0	0	117.3
1096	I	31.9	Very low	29.7	Very low	127 Å²	127	156.6 Å²	156.6	65%	0.651	81%	0.811	S	S	*	*			cis	-161.5	160.8	-15.2	-125.2	168.1	0	0	0	110.5
1097	N	31.3	Very low	29.6	Very low	148 Å²	148	157.4 Å²	157.4	79%	0.791	81%	0.813	S	S	*	*			trans	51.6	118.3	165.5	-67.4	-0.3	0	0	0	120.6
1098	Q	32.6	Very low	29.6	Very low	267 Å²	267	155.9 Å²	155.9	100%	1.248	81%	0.809	S	S	*	*				-140.6	0	95.4	-142.2	177.2	25	0	0	110.8

Retrieved 1,098 of 1,098 residues in 692.4 ms (Link to these results)

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