A0A087XQS8_POEFO Loading...

AP-3 complex subunit beta

Subunit of non-clathrin- and clathrin-associated adaptor protein complex 3 (AP-3) that plays a role in protein sorting in the late-Golgi/trans-Golgi network (TGN) and/or endosomes. The AP complexes mediate both the recruitment of clathrin to membranes and the recognition of sorting signals within the cytosolic tails of transmembrane cargo molecules. AP-3 appears to be involved in the sorting of a subset of transmembrane proteins targeted to lysosomes and lysosome-related organelles. In concert with the BLOC-1 complex, AP-3 is required to target cargos into vesicles assembled at cell bodies for delivery into neurites and nerve terminals.

AlphaFold DB , UniProt , Accession A0A087XQS8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,121 aa.

						>A0A087XQS8_POEFO|A0A087XQS8
MSTTALYNDQQGGAEAAVEAGQETTATISSGGAAFGLFSTDFKKNEDLKEMLESNKESLKLEAMKRIVQLISKGKNASDLFPAVVKNVASKNIELKKLVYVYLVRYAEEQQDLALLSISTFQRALKDPNQFIRASALRVLSSIRVPIIVPIMMLAIKEAASDLSPYVRKTSAHAIQKLYSLDADQKEHLIEVIEKLLKDKSTLVAGSVVVAFEEVCPDRIDLIHRNYRKLCNLLVDVEEWGQVVIINMLTRYARTQFTSPWKEDGIFDESEKAFYDSDSEEKQGQREAKPYIMDPDHRLLLRNTKPLLQSRNTAVVMAVAQLYWHLAPKHEVSIVTKSLVRLLRSHREVQYVVLQNIATMSIQRKGMFEPYMKSFYVRSTDATHIKTLKLEILTNLANEANISTILREFQTYVKSQDKAFAAATIQAIGRCATNISEVTDTCLNGLVLLLSNRDETVVAESVVVIKKLLQTQPTQHCDIIKHMAKLFDNITVPMARASILWLMGEYCERVPKIAPDVLRKMAKTFTSEEDIVKLQTVNLAAKLYLTNSKQTKLLTQYILNLGKYDQNYDIRDRTRFIRQLIVPSEKSGALNKYARRILLASKPAPVLESAFKGQLGQTPLPWTNEMDRDRFQLGTLSHSLNIKTTGYQELSDWPATAPDPSVRNVEVIEPVQEWAPSLGKAKKPKSDKFYSDDEEEEEEEEGSGSGSEDDSSSSSSSSSSSGGSSEESGSASEEESSGGSEKTSSDSGKSSSGSEVSSSESESKQKKKKLTKKATPRKSKQTAADSDSDENGNGPVGKTSSSSAESSSDSESDSEEDSDSDSPAPQKKTVAKTKPKVEVKSKKEVSLLDLDDFSPAPPSAPKSSVFSSSLLSDLEGLSLSNVSSAMQVTSSSFGPVKTYELLHHMTGKGLSAKYHFPRQPCLYQPSMVAVQVILTNSSDHSLEEIHIGDRSPGSLNVHCFNTVERLEPGASVSVSMGIDFSDSTQAANFQLCTKEDQFSVSIQPAVGELLMPSTMKEPDFCSEQKKLMGMNETSATITMATANTSKQNISKQVLSVANVGVVSSDQNNLQRFAGRTVSSGALVLVTLELRESSTALLTINTEKTVMASMLLRDLKQALSQA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.4	Very low	24.6	Very low	234 Å²	234	145.7 Å²	145.7	100%	1.153	78%	0.777	S	S	*	*				0	108.9	0	-58.6	176.4	-171.6	0	0	105.4
2	S	23.9	Very low	24.4	Very low	109 Å²	109	140.5 Å²	140.5	76%	0.762	78%	0.784	S	S	*	*				76.3	122	89	-49.7	0	0	0	0	110.9
3	T	23.1	Very low	24.2	Very low	129 Å²	129	135.5 Å²	135.5	79%	0.791	78%	0.784	S	S	*	*			cis	-158.9	170.5	3	-5.8	0	0	0	0	111.7
4	T	23.4	Very low	24	Very low	129 Å²	129	133 Å²	133	79%	0.791	79%	0.787	S	S	*	*			trans	-36.7	162.9	163.6	46.6	0	0	0	0	115.7
5	A	25	Very low	23.9	Very low	77 Å²	77	136.7 Å²	136.7	64%	0.636	79%	0.793	S	S	*	*			cis	-172.1	152.5	47	0	0	0	0	0	117.1
6	L	23.5	Very low	23.9	Very low	148 Å²	148	134.6 Å²	134.6	78%	0.775	80%	0.796	S	S	*	*			trans	65.2	159.8	145.6	-62.6	164	0	0	0	119.4
7	Y	24.4	Very low	23.8	Very low	202 Å²	202	131.8 Å²	131.8	79%	0.792	79%	0.792	S	S	*	*			cis	-144.7	165.8	4.7	-135.9	-71.2	0	0	0	111.2
8	N	24.6	Very low	23.9	Very low	126 Å²	126	131.4 Å²	131.4	67%	0.674	79%	0.79	S	S	*	*			trans	-60.3	173.7	167.1	-87.2	38.3	0	0	0	114.1
9	D	24.3	Very low	23.9	Very low	114 Å²	114	134.2 Å²	134.2	61%	0.61	79%	0.794	S	S	*	*			cis	-160.4	171.5	10.4	-134.8	-43.1	0	0	0	113.6
10	Q	25.3	Very low	23.8	Very low	156 Å²	156	133 Å²	133	73%	0.729	80%	0.799	S	S	*	*			trans	55.8	177.5	151.8	-76.6	160.5	40.8	0	0	121.7
11	Q	23.6	Very low	23.8	Very low	179 Å²	179	130 Å²	130	84%	0.836	80%	0.796	S	S	*	*				-173.6	123.5	-57.5	179.6	171	13.3	0	0	110.7
12	G	22.5	Very low	23.7	Very low	83 Å²	83	127 Å²	127	86%	0.856	78%	0.779	S	S	*	*			trans	75.8	170.2	175.7	0	0	0	0	0	115.4
13	G	21.5	Very low	23.8	Very low	76 Å²	76	129 Å²	129	78%	0.784	78%	0.776	S	S	*	*			cis	168.2	148.3	-9.5	0	0	0	0	0	113.6
14	A	22.2	Very low	23.9	Very low	100 Å²	100	129.8 Å²	129.8	83%	0.826	78%	0.782	S	S	*	*			trans	68	121.8	165.2	0	0	0	0	0	122
15	E	22.4	Very low	24	Very low	189 Å²	189	129.4 Å²	129.4	88%	0.883	78%	0.779	S	S	*	*			trans	26.4	144.5	139.8	-57.3	-169.8	117.9	0	0	125.8
16	A	22.8	Very low	24	Very low	102 Å²	102	130 Å²	130	84%	0.843	78%	0.784	S	S	*	*			trans	71.1	152.4	146.4	0	0	0	0	0	120.1
17	A	23.6	Very low	24.1	Very low	87 Å²	87	129.2 Å²	129.2	72%	0.719	79%	0.785	S	S	*	*			cis	-170.6	179.6	-24.5	0	0	0	0	0	109.9
18	V	24	Very low	24.2	Very low	126 Å²	126	127 Å²	127	76%	0.764	79%	0.785	S	S	*	*			trans	86.7	121.9	159.2	-172.1	0	0	0	0	119.9
19	E	24	Very low	24.2	Very low	184 Å²	184	125.6 Å²	125.6	86%	0.86	79%	0.786	S	S	*	*			trans	19.1	126.6	151.9	-57.3	176.2	108.9	0	0	124.5
20	A	23.3	Very low	24.2	Very low	109 Å²	109	126.2 Å²	126.2	90%	0.901	80%	0.799	S	S	*	*				173.6	152.7	119	0	0	0	0	0	110
21	G	23.8	Very low	24.2	Very low	71 Å²	71	122.4 Å²	122.4	73%	0.732	80%	0.802	S	S	*	*			cis	170	136	-9.9	0	0	0	0	0	111.5
22	Q	27.3	Very low	24.2	Very low	170 Å²	170	117.8 Å²	117.8	79%	0.794	80%	0.802	S	S	*	*			trans	43.8	112.1	158.8	-68.4	-175.4	-88.5	0	0	120.6
23	E	24.6	Very low	24.7	Very low	151 Å²	151	119.2 Å²	119.2	71%	0.706	81%	0.806	S	S	*	*				85.9	128.2	84	-79	-177.4	133.9	0	0	116.2
24	T	25.7	Very low	25.1	Very low	147 Å²	147	119.8 Å²	119.8	90%	0.902	80%	0.803	S	S	*	*			trans	-147.6	126.2	139.7	30.9	0	0	0	0	110.6
25	T	24.9	Very low	25.5	Very low	121 Å²	121	125.2 Å²	125.2	74%	0.742	81%	0.808	S	S	*	*			trans	-73.1	150.4	175.1	44.5	0	0	0	0	111.9
26	A	26.7	Very low	25.9	Very low	88 Å²	88	120.1 Å²	120.1	73%	0.727	81%	0.806	S	S	*	*			cis	89.3	128.3	31.3	0	0	0	0	0	115.9
27	T	25.1	Very low	26.5	Very low	132 Å²	132	122.6 Å²	122.6	81%	0.81	81%	0.805	S	S	*	*			trans	-172	160.9	178.4	35.6	0	0	0	0	107
28	I	27.1	Very low	27	Very low	155 Å²	155	125.9 Å²	125.9	80%	0.795	80%	0.803	S	S	*	*			cis	-163.3	145	-24.2	-110.3	173.6	0	0	0	104.3
29	S	23.8	Very low	27.1	Very low	98 Å²	98	125 Å²	125	69%	0.685	80%	0.803	S	S	*	*			cis	-163.3	178.2	-10.8	65.2	0	0	0	0	109.4
30	S	24.4	Very low	28	Very low	126 Å²	126	121.1 Å²	121.1	88%	0.881	79%	0.792	S	S	*	*			trans	65.5	112.2	159.6	-166.1	0	0	0	0	118.7
31	G	24.5	Very low	29.2	Very low	77 Å²	77	120 Å²	120	79%	0.794	77%	0.77	S	S	*	*			trans	-170.4	-10.9	176.5	0	0	0	0	0	122.1
32	G	24	Very low	30.1	Very low	81 Å²	81	125.8 Å²	125.8	84%	0.835	78%	0.776	S	S	*	*			trans	67.9	111.3	170.6	0	0	0	0	0	117.3
33	A	32.2	Very low	31.2	Very low	113 Å²	113	125.7 Å²	125.7	93%	0.934	77%	0.773	S	S	*	*			trans	-74.9	140.1	-170.4	0	0	0	0	0	116.1
34	A	30.1	Very low	32.7	Very low	88 Å²	88	121.6 Å²	121.6	73%	0.727	75%	0.752	S	S	*	*			trans	-153.8	152	157.9	0	0	0	0	0	111.1
35	F	31.5	Very low	34.6	Very low	214 Å²	214	116.9 Å²	116.9	94%	0.939	72%	0.722	S	S	*	*			trans	55.7	101.1	173.6	-83.5	-92.5	0	0	0	118.4
36	G	31.2	Very low	36.8	Very low	82 Å²	82	118.2 Å²	118.2	85%	0.845	72%	0.72	S	S	*	*			trans	-169.3	36.7	172.5	0	0	0	0	0	115.5
37	L	34.1	Very low	39.4	Very low	155 Å²	155	117.8 Å²	117.8	81%	0.812	71%	0.705	S	S	*	*			trans	-149.4	69.4	-173	-155.9	145.3	0	0	0	113.9
38	F	33.8	Very low	42.1	Very low	156 Å²	156	112 Å²	112	68%	0.684	67%	0.669	S	S	*	*			trans	-154.1	113.3	159.4	-78.8	-59.1	0	0	0	112.3
39	S	28.1	Very low	44.8	Very low	107 Å²	107	109.6 Å²	109.6	75%	0.748	65%	0.653	S	S	*	*			trans	-105.3	170.8	150.7	-77.7	0	0	0	0	109.9	K44	S39-K44 WeakPolarHBondContact O-CE 3.3Å; S39-K44 PolarHBondContact O-NZ 3.39Å
40	T	42.6	Very low	47.6	Very low	103 Å²	103	112.1 Å²	112.1	63%	0.632	65%	0.654	S	S	*	*			trans	-117.3	163.2	170.3	69	0	0	0	0	108.2
41	D	47.6	Very low	50.4	Low	84 Å²	84	107.4 Å²	107.4	45%	0.449	62%	0.618	S	S	.	*	S	Bend	cis	-135.2	-168.7	11.3	-93.4	-80.4	0	0	0	111.3	K43 K75	D41-K43 PolarHBondContact O-N 3.25Å; D41-K75 IonicContact OD1-NZ 3.3Å; D41-K75 PolarHBondContact OD1-NZ 2.93Å
42	F	43.8	Very low	53.3	Low	194 Å²	194	103.8 Å²	103.8	85%	0.851	58%	0.581	S	S	*	*	S	Bend	trans	64.3	-50.1	169.9	-64.3	-76.6	0	0	0	119.2	K44	F42-K44 PolarHBondContact O-N 3.2Å
43	K	49.5	Very low	56.2	Low	167 Å²	167	103.5 Å²	103.5	73%	0.726	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-21.7	-180	-72.7	-165.6	173.6	-170.1	0	114.1	D41 N45 E46	D41-K43 PolarHBondContact O-N 3.25Å; K43-N45 PolarHBondContact O-N 2.93Å; K43-N45 VanDerWaalsContact O-N 3.07Å; K43-E46 PolarHBondContact O-N 2.89Å
44	K	56.3	Low	58.8	Low	65 Å²	65	99.6 Å²	99.6	28%	0.283	52%	0.523	S	S	.	.	H	α-helix	trans	-61.6	-18.1	-173.6	-62.8	-170.6	177	-175.9	0	115.8	S39 F42 D47 L48	S39-K44 WeakPolarHBondContact O-CE 3.3Å; S39-K44 PolarHBondContact O-NZ 3.39Å; F42-K44 PolarHBondContact O-N 3.2Å; K44-D47 WeakPolarHBondContact CA-OD2 3.35Å; K44-L48 WeakPolarHBondContact O-CB 3.38Å; K44-L48 WeakPolarHBondContact O-CD1 3.46Å; K44-L48 WeakPolarHBondContact O-CG 3.26Å; K44-L48 PolarHBondContact O-N 3.24Å; K44-L48 VanDerWaalsContact O-N 3.13Å
45	N	65.3	Low	61.3	Low	49 Å²	49	103.3 Å²	103.3	26%	0.262	53%	0.531	S	S	.	.	H	α-helix	trans	-72.7	-32	174.6	-77.4	8.4	0	0	0	111.7	K43 K49 L80	K43-N45 PolarHBondContact O-N 2.93Å; K43-N45 VanDerWaalsContact O-N 3.07Å; N45-K49 WeakPolarHBondContact O-CB 3.13Å; N45-K49 PolarHBondContact O-N 3.15Å; N45-L80 WeakPolarHBondContact O-CD2 3.4Å
46	E	70.7	Confident	64	Low	148 Å²	148	99.7 Å²	99.7	69%	0.692	52%	0.515	S	S	*	.	H	α-helix	trans	-73.2	-43.8	175.4	-59.7	-163.1	116.4	0	0	111	K43 L48 K49 E50	K43-E46 PolarHBondContact O-N 2.89Å; E46-L48 VanDerWaalsContact C-N 3.25Å; E46-L48 PolarHBondContact O-N 2.97Å; E46-K49 WeakPolarHBondContact O-CB 3.33Å; E46-K49 PolarHBondContact O-N 3.21Å; E46-K49 VanDerWaalsContact O-N 3.07Å; E46-E50 PolarHBondContact O-N 3.01Å
47	D	81.2	Confident	66.5	Low	80 Å²	80	99.9 Å²	99.9	43%	0.428	49%	0.494	S	S	.	.	H	α-helix	trans	-51.6	-45.8	171.2	-52	-21.1	0	0	0	111.4	K44 E50 M51	K44-D47 WeakPolarHBondContact CA-OD2 3.35Å; D47-E50 PolarHBondContact O-N 3.5Å; D47-M51 VanDerWaalsContact O-CG 3.27Å; D47-M51 WeakPolarHBondContact O-CG 3.21Å; D47-M51 PolarHBondContact O-N 3.27Å
48	L	82.6	Confident	69	Low	9 Å²	9	96.4 Å²	96.4	5%	0.047	48%	0.482	C	S	.	.	H	α-helix	trans	-68.3	-37.3	179.6	-74.1	170.2	0	0	0	112.4	K44 E46 M51 L52 A63 R66 I67 L70 L80	K44-L48 WeakPolarHBondContact O-CB 3.38Å; K44-L48 WeakPolarHBondContact O-CD1 3.46Å; K44-L48 WeakPolarHBondContact O-CG 3.26Å; K44-L48 PolarHBondContact O-N 3.24Å; K44-L48 VanDerWaalsContact O-N 3.13Å; E46-L48 VanDerWaalsContact C-N 3.25Å; E46-L48 PolarHBondContact O-N 2.97Å; L48-M51 PolarHBondContact O-N 3.1Å; L48-L52 WeakPolarHBondContact O-CB 3.33Å; L48-L52 VanDerWaalsContact O-CG 3.31Å; L48-L52 WeakPolarHBondContact O-CG 3.18Å; L48-L52 PolarHBondContact O-N 2.94Å; L48-A63 HydrophobicContact CD2-CB 3.97Å; L48-R66 HydrophobicContact CD2-CB 3.71Å; L48-R66 HydrophobicContact CD2-CG 4.37Å; L48-I67 HydrophobicContact CD1-CG1 4.1Å; L48-I67 HydrophobicContact CD2-CG1 4.45Å; L48-L70 HydrophobicContact CD1-CD1 3.88Å; L48-L80 HydrophobicContact CB-CD1 4.36Å; L48-L80 HydrophobicContact CD1-CD1 4.48Å
49	K	83.2	Confident	71.6	Confident	105 Å²	105	91.8 Å²	91.8	46%	0.457	47%	0.465	S	S	.	.	H	α-helix	trans	-63.7	-47.1	174.4	-175.4	-177.6	175.2	-173.5	0	110.8	N45 E46 M51 L52 E53 L80 A83	N45-K49 WeakPolarHBondContact O-CB 3.13Å; N45-K49 PolarHBondContact O-N 3.15Å; E46-K49 WeakPolarHBondContact O-CB 3.33Å; E46-K49 PolarHBondContact O-N 3.21Å; E46-K49 VanDerWaalsContact O-N 3.07Å; K49-M51 PolarHBondContact O-N 3.1Å; K49-L52 PolarHBondContact O-N 3.37Å; K49-E53 WeakPolarHBondContact CE-OE1 3.39Å; K49-E53 WeakPolarHBondContact O-CG 3.46Å; K49-E53 PolarHBondContact O-N 3.23Å; K49-L80 HydrophobicContact CB-CD2 4.1Å; K49-A83 HydrophobicContact CG-CB 4.19Å
50	E	83.1	Confident	74.5	Confident	152 Å²	152	88.2 Å²	88.2	71%	0.71	44%	0.436	S	S	*	.	H	α-helix	trans	-60.4	-45.2	176.2	-167.5	-173.4	167.2	0	0	111.3	E46 D47 L52 E53 S54	E46-E50 PolarHBondContact O-N 3.01Å; D47-E50 PolarHBondContact O-N 3.5Å; E50-L52 VanDerWaalsContact C-N 3.32Å; E50-L52 PolarHBondContact O-N 3Å; E50-E53 PolarHBondContact O-N 3.26Å; E50-S54 WeakPolarHBondContact O-CB 3.23Å; E50-S54 PolarHBondContact O-N 3.32Å
51	M	83.9	Confident	76.7	Confident	27 Å²	27	84.6 Å²	84.6	13%	0.133	41%	0.412	C	S	.	.	H	α-helix	trans	-59.8	-38.7	175.5	-71.4	176.7	71.6	0	0	112.9	D47 L48 K49 S54 L59 E62 A63 R66	D47-M51 VanDerWaalsContact O-CG 3.27Å; D47-M51 WeakPolarHBondContact O-CG 3.21Å; D47-M51 PolarHBondContact O-N 3.27Å; L48-M51 PolarHBondContact O-N 3.1Å; K49-M51 PolarHBondContact O-N 3.1Å; M51-S54 PolarHBondContact O-OG 2.95Å; M51-L59 HydrophobicContact CB-CB 4.46Å; M51-L59 HydrophobicContact CE-CB 4.44Å; M51-L59 HydrophobicContact CE-CD2 4.25Å; M51-E62 HydrophobicContact CE-CB 4.06Å; M51-E62 HydrophobicContact CE-CG 4.44Å; M51-A63 HydrophobicContact CB-CB 3.72Å; M51-A63 HydrophobicContact CE-CB 4.37Å; M51-R66 PolarHBondContact SD-NH1 2.67Å; M51-R66 VanDerWaalsContact SD-NH1 3.35Å
52	L	84.6	Confident	78.6	Confident	0 Å²	0	84.7 Å²	84.7	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-69.4	-33.8	175.3	-76.6	179	0	0	0	113.7	L48 K49 E50 K60 A63 M64 I67 A83 V84 N87	L48-L52 WeakPolarHBondContact O-CB 3.33Å; L48-L52 VanDerWaalsContact O-CG 3.31Å; L48-L52 WeakPolarHBondContact O-CG 3.18Å; L48-L52 PolarHBondContact O-N 2.94Å; K49-L52 PolarHBondContact O-N 3.37Å; E50-L52 VanDerWaalsContact C-N 3.32Å; E50-L52 PolarHBondContact O-N 3Å; L52-K60 WeakPolarHBondContact O-CE 3.41Å; L52-A63 HydrophobicContact CD2-CB 3.93Å; L52-A63 HydrophobicContact CG-CB 3.99Å; L52-M64 HydrophobicContact CD2-CG 3.75Å; L52-M64 HydrophobicContact CD2-SD 3.7Å; L52-I67 HydrophobicContact CD1-CD1 3.64Å; L52-I67 HydrophobicContact CD2-CD1 4.38Å; L52-I67 HydrophobicContact CG-CD1 4.2Å; L52-A83 HydrophobicContact CB-CB 4.24Å; L52-A83 HydrophobicContact CD1-CB 3.91Å; L52-V84 HydrophobicContact CD1-CG2 3.7Å; L52-N87 PolarHBondContact O-ND2 2.95Å
53	E	85.2	Confident	80.9	Confident	76 Å²	76	75.4 Å²	75.4	36%	0.355	37%	0.369	S	S	.	.	H	α-helix	trans	-85.6	-20.9	-179.7	-66.5	-158.9	-133.1	0	0	113	K49 E50 A83 K86	K49-E53 WeakPolarHBondContact CE-OE1 3.39Å; K49-E53 WeakPolarHBondContact O-CG 3.46Å; K49-E53 PolarHBondContact O-N 3.23Å; E50-E53 PolarHBondContact O-N 3.26Å; E53-A83 HydrophobicContact CG-CB 4.34Å; E53-K86 IonicContact OE2-NZ 3.84Å; E53-K86 PolarHBondContact OE2-NZ 2.93Å
54	S	86.8	Confident	82.8	Confident	30 Å²	30	67.5 Å²	67.5	21%	0.21	34%	0.335	C	S	.	.	S	Bend	trans	-54.9	153.4	176.9	80.1	0	0	0	0	113.8	E50 M51 K56 K60	E50-S54 WeakPolarHBondContact O-CB 3.23Å; E50-S54 PolarHBondContact O-N 3.32Å; M51-S54 PolarHBondContact O-OG 2.95Å; S54-K56 VanDerWaalsContact C-N 3.25Å; S54-K56 PolarHBondContact O-N 3.03Å; S54-K60 WeakPolarHBondContact O-CE 3.47Å
55	N	82.8	Confident	84.5	Confident	166 Å²	166	69.4 Å²	69.4	89%	0.888	34%	0.343	S	S	*	.	S	Bend	trans	-75.9	-2.8	-179.7	-73.8	-31.3	0	0	0	115
56	K	87.8	Confident	85.6	Confident	138 Å²	138	70.7 Å²	70.7	60%	0.6	34%	0.344	S	S	*	.			trans	-98	111.8	-175.2	-66.7	178.4	-179.2	174.4	0	111	S54 S58 L59 K60	S54-K56 VanDerWaalsContact C-N 3.25Å; S54-K56 PolarHBondContact O-N 3.03Å; K56-S58 PolarHBondContact O-N 3.09Å; K56-S58 VanDerWaalsContact O-N 3.1Å; K56-L59 HydrophobicContact CB-CB 4.37Å; K56-L59 HydrophobicContact CB-CD1 4.08Å; K56-L59 HydrophobicContact CB-CG 4.03Å; K56-L59 HydrophobicContact CD-CD1 3.98Å; K56-L59 HydrophobicContact CD-CG 4.42Å; K56-L59 PolarHBondContact O-N 3.43Å; K56-K60 PolarHBondContact O-N 3.32Å
57	E	84.1	Confident	86.5	Confident	86 Å²	86	63.7 Å²	63.7	40%	0.402	31%	0.312	S	S	.	.	H	α-helix	trans	-56.2	-29.8	179.8	-67.2	-161.8	152.2	0	0	113.7	K60 L61 N92	E57-K60 PolarHBondContact O-N 2.97Å; E57-L61 VanDerWaalsContact O-CB 3.24Å; E57-L61 WeakPolarHBondContact O-CB 3.44Å; E57-L61 PolarHBondContact O-N 3.07Å; E57-N92 WeakPolarHBondContact OE2-CB 3.27Å
58	S	86.5	Confident	86.9	Confident	82 Å²	82	61.7 Å²	61.7	57%	0.573	30%	0.302	S	S	*	.	H	α-helix	trans	-63.5	-42.4	175.2	50.8	0	0	0	0	113.2	K56 L61 E62	K56-S58 PolarHBondContact O-N 3.09Å; K56-S58 VanDerWaalsContact O-N 3.1Å; S58-L61 PolarHBondContact O-N 3.03Å; S58-E62 PolarHBondContact O-N 3.31Å
59	L	87.6	Confident	87.1	Confident	60 Å²	60	66.4 Å²	66.4	31%	0.314	32%	0.324	S	S	.	.	H	α-helix	trans	-67.7	-40	176.7	-64.1	-179.7	0	0	0	111	M51 K56 L61 E62 A63	M51-L59 HydrophobicContact CB-CB 4.46Å; M51-L59 HydrophobicContact CE-CB 4.44Å; M51-L59 HydrophobicContact CE-CD2 4.25Å; K56-L59 HydrophobicContact CB-CB 4.37Å; K56-L59 HydrophobicContact CB-CD1 4.08Å; K56-L59 HydrophobicContact CB-CG 4.03Å; K56-L59 HydrophobicContact CD-CD1 3.98Å; K56-L59 HydrophobicContact CD-CG 4.42Å; K56-L59 PolarHBondContact O-N 3.43Å; L59-L61 VanDerWaalsContact C-N 3.34Å; L59-L61 PolarHBondContact O-N 2.95Å; L59-E62 PolarHBondContact O-N 2.9Å; L59-A63 WeakPolarHBondContact O-CB 3.4Å; L59-A63 PolarHBondContact O-N 2.95Å
60	K	89.5	Confident	87.3	Confident	32 Å²	32	63.1 Å²	63.1	14%	0.139	31%	0.311	C	S	.	.	H	α-helix	trans	-60.6	-43.4	174	-58.9	-171	176.3	-160.3	0	112.2	L52 S54 K56 E57 A63 M64 N87 L95	L52-K60 WeakPolarHBondContact O-CE 3.41Å; S54-K60 WeakPolarHBondContact O-CE 3.47Å; K56-K60 PolarHBondContact O-N 3.32Å; E57-K60 PolarHBondContact O-N 2.97Å; K60-A63 PolarHBondContact O-N 3.29Å; K60-M64 WeakPolarHBondContact O-CB 3.32Å; K60-M64 WeakPolarHBondContact O-CG 3.43Å; K60-M64 PolarHBondContact O-N 3.44Å; K60-N87 VanDerWaalsContact CD-OD1 3.27Å; K60-N87 WeakPolarHBondContact CD-OD1 3.28Å; K60-N87 WeakPolarHBondContact CE-OD1 3.47Å; K60-N87 PolarHBondContact NZ-OD1 3.45Å; K60-L95 HydrophobicContact CB-CD1 4.04Å; K60-L95 HydrophobicContact CB-CD2 3.85Å; K60-L95 HydrophobicContact CD-CD2 4.16Å
61	L	88.8	Confident	87.6	Confident	27 Å²	27	58.1 Å²	58.1	14%	0.141	29%	0.289	C	S	.	.	H	α-helix	trans	-68.6	-38.3	-179.6	-176	154.6	0	0	0	111.3	E57 S58 L59 K65 E94	E57-L61 VanDerWaalsContact O-CB 3.24Å; E57-L61 WeakPolarHBondContact O-CB 3.44Å; E57-L61 PolarHBondContact O-N 3.07Å; S58-L61 PolarHBondContact O-N 3.03Å; L59-L61 VanDerWaalsContact C-N 3.34Å; L59-L61 PolarHBondContact O-N 2.95Å; L61-K65 HydrophobicContact CD2-CD 3.89Å; L61-K65 VanDerWaalsContact CD2-CE 3.47Å; L61-K65 WeakPolarHBondContact O-CG 3.3Å; L61-K65 PolarHBondContact O-N 3.09Å; L61-E94 HydrophobicContact CD1-CB 3.91Å
62	E	88.4	Confident	87.9	Confident	85 Å²	85	61.4 Å²	61.4	40%	0.397	31%	0.314	S	S	.	.	H	α-helix	trans	-67.3	-44.7	171.5	-160.8	-167.7	166.9	0	0	112	M51 S58 L59 M64 K65 R66	M51-E62 HydrophobicContact CE-CB 4.06Å; M51-E62 HydrophobicContact CE-CG 4.44Å; S58-E62 PolarHBondContact O-N 3.31Å; L59-E62 PolarHBondContact O-N 2.9Å; E62-M64 PolarHBondContact O-N 3.04Å; E62-K65 PolarHBondContact O-N 3.33Å; E62-K65 VanDerWaalsContact O-N 3.14Å; E62-R66 VanDerWaalsContact CD-NH2 3.3Å; E62-R66 WeakPolarHBondContact O-CG 3.39Å; E62-R66 PolarHBondContact O-N 3.38Å; E62-R66 IonicContact OE1-CZ 2.68Å; E62-R66 VanDerWaalsContact OE1-CZ 3.23Å; E62-R66 IonicContact OE1-NE 3.85Å; E62-R66 PolarHBondContact OE1-NE 3.41Å; E62-R66 IonicContact OE1-NH2 2.65Å; E62-R66 PolarHBondContact OE1-NH2 3.28Å; E62-R66 IonicContact OE2-NH2 3.45Å
63	A	90.4	Very high	88.1	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58.7	-46.2	176.1	0	0	0	0	0	111.6	L48 M51 L52 L59 K60 K65 R66 I67	L48-A63 HydrophobicContact CD2-CB 3.97Å; M51-A63 HydrophobicContact CB-CB 3.72Å; M51-A63 HydrophobicContact CE-CB 4.37Å; L52-A63 HydrophobicContact CD2-CB 3.93Å; L52-A63 HydrophobicContact CG-CB 3.99Å; L59-A63 WeakPolarHBondContact O-CB 3.4Å; L59-A63 PolarHBondContact O-N 2.95Å; K60-A63 PolarHBondContact O-N 3.29Å; A63-K65 VanDerWaalsContact C-N 3.35Å; A63-K65 PolarHBondContact O-N 3.42Å; A63-R66 WeakPolarHBondContact O-CB 3.4Å; A63-R66 PolarHBondContact O-N 3.43Å; A63-I67 WeakPolarHBondContact O-CB 3Å; A63-I67 WeakPolarHBondContact O-CD1 3.4Å; A63-I67 VanDerWaalsContact O-CG1 3.24Å; A63-I67 WeakPolarHBondContact O-CG1 3.35Å; A63-I67 PolarHBondContact O-N 2.86Å
64	M	91.1	Very high	88.1	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-63.2	-36.9	174.6	-75.4	-54	-56.7	0	0	113	L52 K60 E62 I67 V68 V84 L95 L98 V99 Y102	L52-M64 HydrophobicContact CD2-CG 3.75Å; L52-M64 HydrophobicContact CD2-SD 3.7Å; K60-M64 WeakPolarHBondContact O-CB 3.32Å; K60-M64 WeakPolarHBondContact O-CG 3.43Å; K60-M64 PolarHBondContact O-N 3.44Å; E62-M64 PolarHBondContact O-N 3.04Å; M64-I67 PolarHBondContact O-N 3.34Å; M64-I67 HydrophobicContact SD-CD1 4.1Å; M64-V68 WeakPolarHBondContact O-CG2 3.49Å; M64-V68 PolarHBondContact O-N 3.5Å; M64-V84 HydrophobicContact CE-CG1 3.99Å; M64-V84 HydrophobicContact CE-CG2 4.47Å; M64-V84 HydrophobicContact SD-CB 4.48Å; M64-V84 HydrophobicContact SD-CG1 3.98Å; M64-V84 HydrophobicContact SD-CG2 3.78Å; M64-L95 HydrophobicContact CB-CD1 4.1Å; M64-L95 HydrophobicContact CG-CD1 3.55Å; M64-L98 HydrophobicContact CB-CB 3.92Å; M64-L98 HydrophobicContact CB-CD1 3.86Å; M64-L98 HydrophobicContact CE-CB 4.17Å; M64-V99 HydrophobicContact CE-CG2 4.12Å; M64-V99 HydrophobicContact CG-CG2 4.21Å; M64-V99 HydrophobicContact SD-CG2 4.19Å; M64-Y102 HydrophobicContact CE-CG 4.38Å
65	K	90.9	Very high	88.1	Confident	105 Å²	105	70.6 Å²	70.6	46%	0.457	37%	0.367	S	S	.	.	H	α-helix	trans	-63.5	-42.6	172.4	-75.9	177.4	-177.6	176.2	0	111.4	L61 E62 A63 Q69 E94 L98	L61-K65 HydrophobicContact CD2-CD 3.89Å; L61-K65 VanDerWaalsContact CD2-CE 3.47Å; L61-K65 WeakPolarHBondContact O-CG 3.3Å; L61-K65 PolarHBondContact O-N 3.09Å; E62-K65 PolarHBondContact O-N 3.33Å; E62-K65 VanDerWaalsContact O-N 3.14Å; A63-K65 VanDerWaalsContact C-N 3.35Å; A63-K65 PolarHBondContact O-N 3.42Å; K65-Q69 WeakPolarHBondContact O-CB 3.14Å; K65-Q69 PolarHBondContact O-N 3.26Å; K65-E94 IonicContact NZ-OE2 3.39Å; K65-E94 PolarHBondContact NZ-OE2 2.88Å; K65-L98 HydrophobicContact CG-CD1 3.77Å
66	R	88.8	Confident	88.1	Confident	77 Å²	77	68.8 Å²	68.8	29%	0.291	36%	0.358	S	S	.	.	H	α-helix	trans	-63.7	-42	174.7	-67.5	171.3	-177.3	-168.9	3.4	112	L48 M51 E62 A63 Q69 L70	L48-R66 HydrophobicContact CD2-CB 3.71Å; L48-R66 HydrophobicContact CD2-CG 4.37Å; M51-R66 PolarHBondContact SD-NH1 2.67Å; M51-R66 VanDerWaalsContact SD-NH1 3.35Å; E62-R66 VanDerWaalsContact CD-NH2 3.3Å; E62-R66 WeakPolarHBondContact O-CG 3.39Å; E62-R66 PolarHBondContact O-N 3.38Å; E62-R66 IonicContact OE1-CZ 2.68Å; E62-R66 VanDerWaalsContact OE1-CZ 3.23Å; E62-R66 IonicContact OE1-NE 3.85Å; E62-R66 PolarHBondContact OE1-NE 3.41Å; E62-R66 IonicContact OE1-NH2 2.65Å; E62-R66 PolarHBondContact OE1-NH2 3.28Å; E62-R66 IonicContact OE2-NH2 3.45Å; A63-R66 WeakPolarHBondContact O-CB 3.4Å; A63-R66 PolarHBondContact O-N 3.43Å; R66-Q69 CarbonylContact O-C 3.58Å; R66-Q69 WeakPolarHBondContact O-CA 3.29Å; R66-Q69 WeakPolarHBondContact O-CB 3.2Å; R66-Q69 PolarHBondContact O-N 2.94Å; R66-Q69 VanDerWaalsContact O-N 3.16Å; R66-L70 PolarHBondContact O-N 2.91Å
67	I	90.1	Very high	87.9	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-64.7	-45.5	177.5	-69.2	162.5	0	0	0	111.3	L48 L52 A63 M64 Q69 L70 I71 A77 L80 V84 Y102	L48-I67 HydrophobicContact CD1-CG1 4.1Å; L48-I67 HydrophobicContact CD2-CG1 4.45Å; L52-I67 HydrophobicContact CD1-CD1 3.64Å; L52-I67 HydrophobicContact CD2-CD1 4.38Å; L52-I67 HydrophobicContact CG-CD1 4.2Å; A63-I67 WeakPolarHBondContact O-CB 3Å; A63-I67 WeakPolarHBondContact O-CD1 3.4Å; A63-I67 VanDerWaalsContact O-CG1 3.24Å; A63-I67 WeakPolarHBondContact O-CG1 3.35Å; A63-I67 PolarHBondContact O-N 2.86Å; M64-I67 PolarHBondContact O-N 3.34Å; M64-I67 HydrophobicContact SD-CD1 4.1Å; I67-Q69 PolarHBondContact O-N 2.89Å; I67-L70 WeakPolarHBondContact O-CB 3.22Å; I67-L70 PolarHBondContact O-N 3.28Å; I67-I71 HydrophobicContact CG2-CD1 4.13Å; I67-I71 WeakPolarHBondContact O-CG1 3.38Å; I67-I71 PolarHBondContact O-N 2.73Å; I67-A77 HydrophobicContact CG2-CB 4.25Å; I67-L80 HydrophobicContact CD1-CD1 3.71Å; I67-L80 HydrophobicContact CG1-CD1 3.72Å; I67-V84 HydrophobicContact CD1-CG2 4.48Å; I67-Y102 HydrophobicContact CG2-CD2 3.71Å; I67-Y102 HydrophobicContact CG2-CE2 3.79Å
68	V	88.9	Confident	87.9	Confident	39 Å²	39	59.6 Å²	59.6	24%	0.236	32%	0.32	C	S	.	.	H	α-helix	trans	-63.9	-29.9	174.2	174.2	0	0	0	0	111.4	M64 I71 S72 L98	M64-V68 WeakPolarHBondContact O-CG2 3.49Å; M64-V68 PolarHBondContact O-N 3.5Å; V68-I71 PolarHBondContact O-N 3.28Å; V68-S72 PolarHBondContact O-N 3.49Å; V68-S72 PolarHBondContact O-OG 3.24Å; V68-L98 HydrophobicContact CG2-CD2 4.15Å
69	Q	87.6	Confident	87.8	Confident	107 Å²	107	61.6 Å²	61.6	50%	0.5	32%	0.324	S	S	.	.	H	α-helix	trans	-72.6	-22	171.2	-153	-155.8	41.9	0	0	114	K65 R66 I67 S72 K73	K65-Q69 WeakPolarHBondContact O-CB 3.14Å; K65-Q69 PolarHBondContact O-N 3.26Å; R66-Q69 CarbonylContact O-C 3.58Å; R66-Q69 WeakPolarHBondContact O-CA 3.29Å; R66-Q69 WeakPolarHBondContact O-CB 3.2Å; R66-Q69 PolarHBondContact O-N 2.94Å; R66-Q69 VanDerWaalsContact O-N 3.16Å; I67-Q69 PolarHBondContact O-N 2.89Å; Q69-S72 PolarHBondContact O-OG 3.33Å; Q69-K73 VanDerWaalsContact O-CD 3.27Å; Q69-K73 WeakPolarHBondContact O-CD 3.41Å; Q69-K73 VanDerWaalsContact O-CG 3.24Å; Q69-K73 WeakPolarHBondContact O-CG 3.47Å; Q69-K73 VanDerWaalsContact OE1-NZ 3.09Å
70	L	87.4	Confident	87.7	Confident	36 Å²	36	59 Å²	59	19%	0.188	31%	0.311	C	S	.	.	H	α-helix	trans	-76.1	-43.8	169.8	-68.4	170.2	0	0	0	110.2	L48 R66 I67 S72 K73 G74 K75	L48-L70 HydrophobicContact CD1-CD1 3.88Å; R66-L70 PolarHBondContact O-N 2.91Å; I67-L70 WeakPolarHBondContact O-CB 3.22Å; I67-L70 PolarHBondContact O-N 3.28Å; L70-S72 PolarHBondContact O-N 2.91Å; L70-K73 CarbonylContact O-C 3.52Å; L70-K73 WeakPolarHBondContact O-CA 3.09Å; L70-K73 WeakPolarHBondContact O-CB 3.34Å; L70-K73 PolarHBondContact O-N 3.16Å; L70-G74 PolarHBondContact O-N 3.29Å; L70-K75 HydrophobicContact CB-CB 4.29Å; L70-K75 HydrophobicContact CD2-CB 4.47Å; L70-K75 HydrophobicContact CD2-CD 4.01Å; L70-K75 PolarHBondContact O-N 3.42Å
71	I	89	Confident	87.6	Confident	48 Å²	48	57.4 Å²	57.4	25%	0.246	30%	0.304	C	S	.	.	H	α-helix	trans	-61.3	-44.1	176.7	-63.2	164.5	0	0	0	111.1	I67 V68 K73 G74 A77 Y102 Y106	I67-I71 HydrophobicContact CG2-CD1 4.13Å; I67-I71 WeakPolarHBondContact O-CG1 3.38Å; I67-I71 PolarHBondContact O-N 2.73Å; V68-I71 PolarHBondContact O-N 3.28Å; I71-K73 PolarHBondContact O-N 3.33Å; I71-G74 PolarHBondContact O-N 2.88Å; I71-A77 HydrophobicContact CG1-CB 4.38Å; I71-Y102 HydrophobicContact CD1-CD2 3.74Å; I71-Y102 HydrophobicContact CD1-CE2 4.28Å; I71-Y106 HydrophobicContact CD1-CE2 3.77Å; I71-Y106 HydrophobicContact CG1-CE2 4.05Å
72	S	89.8	Confident	87.5	Confident	95 Å²	95	59.6 Å²	59.6	66%	0.664	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-10.1	176.6	69.1	0	0	0	0	114.4	V68 Q69 L70	V68-S72 PolarHBondContact O-N 3.49Å; V68-S72 PolarHBondContact O-OG 3.24Å; Q69-S72 PolarHBondContact O-OG 3.33Å; L70-S72 PolarHBondContact O-N 2.91Å
73	K	89.7	Confident	87.4	Confident	131 Å²	131	55.8 Å²	55.8	57%	0.57	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	5.7	169	-69.4	170.7	-175.2	166.9	0	112.8	Q69 L70 I71 K75	Q69-K73 VanDerWaalsContact O-CD 3.27Å; Q69-K73 WeakPolarHBondContact O-CD 3.41Å; Q69-K73 VanDerWaalsContact O-CG 3.24Å; Q69-K73 WeakPolarHBondContact O-CG 3.47Å; Q69-K73 VanDerWaalsContact OE1-NZ 3.09Å; L70-K73 CarbonylContact O-C 3.52Å; L70-K73 WeakPolarHBondContact O-CA 3.09Å; L70-K73 WeakPolarHBondContact O-CB 3.34Å; L70-K73 PolarHBondContact O-N 3.16Å; I71-K73 PolarHBondContact O-N 3.33Å; K73-K75 VanDerWaalsContact C-N 3.27Å; K73-K75 PolarHBondContact O-N 2.95Å
74	G	85.3	Confident	87.3	Confident	63 Å²	63	55.8 Å²	55.8	65%	0.649	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	18.9	-177.6	0	0	0	0	0	114.6	L70 I71	L70-G74 PolarHBondContact O-N 3.29Å; I71-G74 PolarHBondContact O-N 2.88Å
75	K	86	Confident	87.1	Confident	105 Å²	105	56.7 Å²	56.7	46%	0.457	31%	0.308	S	S	.	.			trans	-87.4	131	173.3	-71.5	-164.9	171.9	-164.5	0	110.3	D41 L70 K73	D41-K75 IonicContact OD1-NZ 3.3Å; D41-K75 PolarHBondContact OD1-NZ 2.93Å; L70-K75 HydrophobicContact CB-CB 4.29Å; L70-K75 HydrophobicContact CD2-CB 4.47Å; L70-K75 HydrophobicContact CD2-CD 4.01Å; L70-K75 PolarHBondContact O-N 3.42Å; K73-K75 VanDerWaalsContact C-N 3.27Å; K73-K75 PolarHBondContact O-N 2.95Å
76	N	82.4	Confident	86.8	Confident	129 Å²	129	57.9 Å²	57.9	69%	0.69	31%	0.314	S	S	*	.			trans	-61	140	174.5	-64.7	0.3	0	0	0	110.6
77	A	84.3	Confident	86.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.301	C	S	.	.			trans	-141.7	23.6	-178.7	0	0	0	0	0	112.1	I67 I71 D79 L80 Y102 Y106	I67-A77 HydrophobicContact CG2-CB 4.25Å; I71-A77 HydrophobicContact CG1-CB 4.38Å; A77-D79 VanDerWaalsContact C-N 3.35Å; A77-L80 PolarHBondContact O-N 3.02Å; A77-Y102 HydrophobicContact CB-CE2 4.4Å; A77-Y102 PolarHBondContact O-OH 2.72Å; A77-Y106 HydrophobicContact CB-CE2 4.43Å; A77-Y106 PolarHBondContact N-OH 2.69Å
78	S	83.6	Confident	86.5	Confident	30 Å²	30	54.6 Å²	54.6	21%	0.21	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-66.6	-30.8	-179.2	38.4	0	0	0	0	113	L80 F81	S78-L80 PolarHBondContact O-N 3.31Å; S78-F81 WeakPolarHBondContact O-CB 3.47Å; S78-F81 PolarHBondContact O-N 2.93Å
79	D	84.6	Confident	86.3	Confident	124 Å²	124	55.3 Å²	55.3	66%	0.663	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-55.1	-25.4	175.7	-46.5	-41.8	0	0	0	113.6	A77 F81	A77-D79 VanDerWaalsContact C-N 3.35Å; D79-F81 VanDerWaalsContact C-N 3.34Å
80	L	86.2	Confident	86.2	Confident	5 Å²	5	51 Å²	51	3%	0.026	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-85.9	-4.1	-178.4	-58.8	175.1	0	0	0	113.1	N45 L48 K49 I67 A77 S78 P82 A83 V84	N45-L80 WeakPolarHBondContact O-CD2 3.4Å; L48-L80 HydrophobicContact CB-CD1 4.36Å; L48-L80 HydrophobicContact CD1-CD1 4.48Å; K49-L80 HydrophobicContact CB-CD2 4.1Å; I67-L80 HydrophobicContact CD1-CD1 3.71Å; I67-L80 HydrophobicContact CG1-CD1 3.72Å; A77-L80 PolarHBondContact O-N 3.02Å; S78-L80 PolarHBondContact O-N 3.31Å; L80-P82 VanDerWaalsContact C-CD 3.5Å; L80-A83 PolarHBondContact O-N 3.42Å; L80-V84 HydrophobicContact CB-CG2 4.43Å; L80-V84 WeakPolarHBondContact O-CG2 3.39Å; L80-V84 PolarHBondContact O-N 3Å
81	F	86.8	Confident	86	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-53.6	-44.9	-171.8	-165.9	-86.5	0	0	0	114	S78 D79 A83 V84 V85 Y102 L103 A107 Q110 L113 A114	S78-F81 WeakPolarHBondContact O-CB 3.47Å; S78-F81 PolarHBondContact O-N 2.93Å; D79-F81 VanDerWaalsContact C-N 3.34Å; F81-A83 PolarHBondContact O-N 2.91Å; F81-V84 PolarHBondContact O-N 3.26Å; F81-V85 HydrophobicContact CD1-CG2 3.65Å; F81-V85 HydrophobicContact CE1-CG2 3.39Å; F81-V85 HydrophobicContact CG-CG2 4.46Å; F81-V85 HydrophobicContact CZ-CG2 4.03Å; F81-V85 WeakPolarHBondContact O-CG2 3.31Å; F81-V85 PolarHBondContact O-N 2.74Å; F81-Y102 VanDerWaalsContact CA-OH 3.29Å; F81-Y102 WeakPolarHBondContact CA-OH 3.4Å; F81-Y102 HydrophobicContact CB-CE1 4.26Å; F81-Y102 HydrophobicContact CD2-CD1 4.41Å; F81-Y102 AromaticContact CD2-CE1 3.52Å; F81-Y102 HydrophobicContact CD2-CE1 3.52Å; F81-Y102 HydrophobicContact CE2-CE1 4.21Å; F81-Y102 HydrophobicContact CG-CE1 4.18Å; F81-Y102 PolarHBondContact N-OH 3.39Å; F81-Y102 VanDerWaalsContact N-OH 3.09Å; F81-L103 HydrophobicContact CE1-CD2 4.37Å; F81-L103 HydrophobicContact CE2-CD2 3.7Å; F81-L103 HydrophobicContact CZ-CD2 3.59Å; F81-A107 HydrophobicContact CZ-CB 4.49Å; F81-Q110 HydrophobicContact CD1-CB 3.93Å; F81-Q110 HydrophobicContact CD2-CB 4.27Å; F81-Q110 HydrophobicContact CE1-CB 3.93Å; F81-Q110 HydrophobicContact CE2-CB 4.28Å; F81-Q110 HydrophobicContact CG-CB 4.11Å; F81-Q110 HydrophobicContact CG-CG 4.35Å; F81-Q110 HydrophobicContact CZ-CB 4.11Å; F81-L113 HydrophobicContact CD1-CB 3.71Å; F81-L113 HydrophobicContact CD1-CD1 4.08Å; F81-L113 HydrophobicContact CE1-CB 3.55Å; F81-A114 HydrophobicContact CZ-CB 4.11Å
82	P	86.6	Confident	85.9	Confident	73 Å²	73	58.4 Å²	58.4	47%	0.474	32%	0.324	S	S	.	.	H	α-helix	trans	-61.7	-40	177.5	-20.3	31.7	0	0	0	113.3	L80 V84 K86 L113	L80-P82 VanDerWaalsContact C-CD 3.5Å; P82-V84 VanDerWaalsContact C-N 3.33Å; P82-K86 PolarHBondContact O-N 2.98Å; P82-K86 VanDerWaalsContact O-N 3.17Å; P82-L113 HydrophobicContact CG-CD1 4.06Å
83	A	85.8	Confident	85.7	Confident	4 Å²	4	57.6 Å²	57.6	3%	0.033	31%	0.312	C	S	.	.	H	α-helix	trans	-71.7	-29.1	179.3	0	0	0	0	0	112.1	K49 L52 E53 L80 F81 N87	K49-A83 HydrophobicContact CG-CB 4.19Å; L52-A83 HydrophobicContact CB-CB 4.24Å; L52-A83 HydrophobicContact CD1-CB 3.91Å; E53-A83 HydrophobicContact CG-CB 4.34Å; L80-A83 PolarHBondContact O-N 3.42Å; F81-A83 PolarHBondContact O-N 2.91Å; A83-N87 PolarHBondContact O-ND2 3.09Å
84	V	88.1	Confident	85.6	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-76.4	-43.1	173.7	179.4	0	0	0	0	111.5	L52 M64 I67 L80 F81 P82 K86 N87 V99 Y102	L52-V84 HydrophobicContact CD1-CG2 3.7Å; M64-V84 HydrophobicContact CE-CG1 3.99Å; M64-V84 HydrophobicContact CE-CG2 4.47Å; M64-V84 HydrophobicContact SD-CB 4.48Å; M64-V84 HydrophobicContact SD-CG1 3.98Å; M64-V84 HydrophobicContact SD-CG2 3.78Å; I67-V84 HydrophobicContact CD1-CG2 4.48Å; L80-V84 HydrophobicContact CB-CG2 4.43Å; L80-V84 WeakPolarHBondContact O-CG2 3.39Å; L80-V84 PolarHBondContact O-N 3Å; F81-V84 PolarHBondContact O-N 3.26Å; P82-V84 VanDerWaalsContact C-N 3.33Å; V84-K86 VanDerWaalsContact C-N 3.31Å; V84-K86 PolarHBondContact O-N 2.99Å; V84-N87 PolarHBondContact O-N 3.4Å; V84-V99 HydrophobicContact CG1-CB 4.33Å; V84-V99 HydrophobicContact CG1-CG1 3.89Å; V84-V99 HydrophobicContact CG1-CG2 4.15Å; V84-Y102 HydrophobicContact CB-CD1 3.89Å; V84-Y102 HydrophobicContact CB-CE1 3.76Å; V84-Y102 HydrophobicContact CG1-CD1 3.39Å; V84-Y102 HydrophobicContact CG1-CE1 3.83Å; V84-Y102 HydrophobicContact CG1-CG 3.83Å; V84-Y102 HydrophobicContact CG2-CD1 4.21Å; V84-Y102 HydrophobicContact CG2-CD2 4.44Å; V84-Y102 HydrophobicContact CG2-CE1 3.96Å; V84-Y102 HydrophobicContact CG2-CE2 4.25Å; V84-Y102 HydrophobicContact CG2-CG 4.44Å
85	V	86.5	Confident	85.8	Confident	20 Å²	20	53.4 Å²	53.4	12%	0.121	28%	0.277	C	S	.	.	H	α-helix	trans	-56.3	-42.8	175.6	165.8	0	0	0	0	111.8	F81 N87 V88 L103 L116	F81-V85 HydrophobicContact CD1-CG2 3.65Å; F81-V85 HydrophobicContact CE1-CG2 3.39Å; F81-V85 HydrophobicContact CG-CG2 4.46Å; F81-V85 HydrophobicContact CZ-CG2 4.03Å; F81-V85 WeakPolarHBondContact O-CG2 3.31Å; F81-V85 PolarHBondContact O-N 2.74Å; V85-N87 PolarHBondContact O-N 3.18Å; V85-V88 WeakPolarHBondContact O-CB 3.43Å; V85-V88 WeakPolarHBondContact O-CG2 3.22Å; V85-V88 PolarHBondContact O-N 2.75Å; V85-V88 VanDerWaalsContact O-N 3.13Å; V85-L103 HydrophobicContact CG2-CD2 3.91Å; V85-L116 HydrophobicContact CG1-CB 4.21Å
86	K	85.8	Confident	85.9	Confident	130 Å²	130	49.6 Å²	49.6	57%	0.565	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-22.7	175.3	-170.2	174.8	177.2	177.7	0	113.5	E53 P82 V84	E53-K86 IonicContact OE2-NZ 3.84Å; E53-K86 PolarHBondContact OE2-NZ 2.93Å; P82-K86 PolarHBondContact O-N 2.98Å; P82-K86 VanDerWaalsContact O-N 3.17Å; V84-K86 VanDerWaalsContact C-N 3.31Å; V84-K86 PolarHBondContact O-N 2.99Å
87	N	87.3	Confident	86.3	Confident	5 Å²	5	49.6 Å²	49.6	3%	0.027	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-0.7	-175.8	-73	-57.2	0	0	0	115.1	L52 K60 A83 V84 V85 A89 S90 V99	L52-N87 PolarHBondContact O-ND2 2.95Å; K60-N87 VanDerWaalsContact CD-OD1 3.27Å; K60-N87 WeakPolarHBondContact CD-OD1 3.28Å; K60-N87 WeakPolarHBondContact CE-OD1 3.47Å; K60-N87 PolarHBondContact NZ-OD1 3.45Å; A83-N87 PolarHBondContact O-ND2 3.09Å; V84-N87 PolarHBondContact O-N 3.4Å; V85-N87 PolarHBondContact O-N 3.18Å; N87-A89 PolarHBondContact O-N 3.43Å; N87-S90 VanDerWaalsContact O-CB 3.26Å; N87-S90 WeakPolarHBondContact O-CB 3.31Å; N87-S90 PolarHBondContact O-N 3.09Å; N87-S90 VanDerWaalsContact O-N 3.1Å; N87-S90 PolarHBondContact O-OG 2.9Å; N87-S90 VanDerWaalsContact O-OG 3.09Å; N87-V99 HydrophobicContact CB-CG2 4.28Å
88	V	86	Confident	86.6	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.012	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-32.7	176.2	-178.3	0	0	0	0	112.1	V85 S90 K96 V99 Y100 L103 T120 F121	V85-V88 WeakPolarHBondContact O-CB 3.43Å; V85-V88 WeakPolarHBondContact O-CG2 3.22Å; V85-V88 PolarHBondContact O-N 2.75Å; V85-V88 VanDerWaalsContact O-N 3.13Å; V88-S90 VanDerWaalsContact C-N 3.26Å; V88-S90 PolarHBondContact O-N 3.35Å; V88-K96 WeakPolarHBondContact O-CE 3.39Å; V88-V99 HydrophobicContact CB-CG1 4.23Å; V88-V99 HydrophobicContact CG2-CG1 3.46Å; V88-V99 VanDerWaalsContact CG2-CG1 3.46Å; V88-Y100 HydrophobicContact CG1-CE1 4.25Å; V88-L103 HydrophobicContact CG2-CD1 3.62Å; V88-T120 HydrophobicContact CB-CG2 4.39Å; V88-T120 HydrophobicContact CG1-CG2 3.76Å; V88-F121 HydrophobicContact CG1-CE1 4.48Å; V88-F121 HydrophobicContact CG1-CZ 4.32Å
89	A	83.6	Confident	86.9	Confident	55 Å²	55	49.8 Å²	49.8	46%	0.455	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	5.2	179.6	0	0	0	0	0	114.7	N87 T120	N87-A89 PolarHBondContact O-N 3.43Å; A89-T120 HydrophobicContact CB-CG2 4.01Å
90	S	84.9	Confident	87.2	Confident	16 Å²	16	44.1 Å²	44.1	11%	0.112	22%	0.222	C	C	.	.			trans	-60.4	150.7	178.2	69.5	0	0	0	0	113.3	N87 V88	N87-S90 VanDerWaalsContact O-CB 3.26Å; N87-S90 WeakPolarHBondContact O-CB 3.31Å; N87-S90 PolarHBondContact O-N 3.09Å; N87-S90 VanDerWaalsContact O-N 3.1Å; N87-S90 PolarHBondContact O-OG 2.9Å; N87-S90 VanDerWaalsContact O-OG 3.09Å; V88-S90 VanDerWaalsContact C-N 3.26Å; V88-S90 PolarHBondContact O-N 3.35Å
91	K	84.3	Confident	87.3	Confident	197 Å²	197	47.8 Å²	47.8	86%	0.857	25%	0.245	S	C	*	.	S	Bend	trans	-82.3	-27.8	177.3	-66.8	-177.5	178.9	179.8	0	112.3	I93	K91-I93 PolarHBondContact O-N 3.24Å
92	N	87.3	Confident	87.5	Confident	43 Å²	43	47.8 Å²	47.8	23%	0.23	25%	0.245	C	C	.	.			trans	-69.3	117.1	-178.5	-175.4	-41.4	0	0	0	112	E57 E94 L95 K96	E57-N92 WeakPolarHBondContact OE2-CB 3.27Å; N92-E94 VanDerWaalsContact C-N 3.34Å; N92-E94 PolarHBondContact O-N 3.42Å; N92-E94 WeakPolarHBondContact OD1-CB 3.06Å; N92-E94 PolarHBondContact OD1-N 3.12Å; N92-L95 HydrophobicContact CB-CB 3.98Å; N92-L95 PolarHBondContact O-N 3.36Å; N92-L95 PolarHBondContact OD1-N 3.07Å; N92-K96 WeakPolarHBondContact O-CB 3.49Å; N92-K96 PolarHBondContact O-N 3.4Å
93	I	85	Confident	87.6	Confident	77 Å²	77	44.3 Å²	44.3	40%	0.395	22%	0.222	S	C	.	.	H	α-helix	trans	-66.1	-32	-174.9	-58.8	174.8	0	0	0	112.3	K91 K97 I132	K91-I93 PolarHBondContact O-N 3.24Å; I93-K97 HydrophobicContact CG2-CD 4.31Å; I93-K97 WeakPolarHBondContact O-CB 3.42Å; I93-K97 VanDerWaalsContact O-CG 3.25Å; I93-K97 WeakPolarHBondContact O-CG 3.48Å; I93-K97 PolarHBondContact O-N 3.09Å; I93-I132 HydrophobicContact CD1-CD1 4.28Å; I93-I132 HydrophobicContact CG1-CD1 4.26Å
94	E	87.9	Confident	87.7	Confident	105 Å²	105	46.9 Å²	46.9	49%	0.491	24%	0.238	S	C	.	.	H	α-helix	trans	-69.1	-49.1	175	-69.3	-167	-168	0	0	111.4	L61 K65 N92 K96 K97 L98	L61-E94 HydrophobicContact CD1-CB 3.91Å; K65-E94 IonicContact NZ-OE2 3.39Å; K65-E94 PolarHBondContact NZ-OE2 2.88Å; N92-E94 VanDerWaalsContact C-N 3.34Å; N92-E94 PolarHBondContact O-N 3.42Å; N92-E94 WeakPolarHBondContact OD1-CB 3.06Å; N92-E94 PolarHBondContact OD1-N 3.12Å; E94-K96 VanDerWaalsContact C-N 3.3Å; E94-K96 PolarHBondContact O-N 2.98Å; E94-K97 WeakPolarHBondContact O-CB 3.34Å; E94-K97 PolarHBondContact O-N 2.8Å; E94-L98 WeakPolarHBondContact O-CG 3.49Å; E94-L98 PolarHBondContact O-N 2.92Å
95	L	89.7	Confident	87.7	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-57.7	-47.1	177.3	-179.7	59	0	0	0	110.2	K60 M64 N92 K97 L98 V99	K60-L95 HydrophobicContact CB-CD1 4.04Å; K60-L95 HydrophobicContact CB-CD2 3.85Å; K60-L95 HydrophobicContact CD-CD2 4.16Å; M64-L95 HydrophobicContact CB-CD1 4.1Å; M64-L95 HydrophobicContact CG-CD1 3.55Å; N92-L95 HydrophobicContact CB-CB 3.98Å; N92-L95 PolarHBondContact O-N 3.36Å; N92-L95 PolarHBondContact OD1-N 3.07Å; L95-K97 PolarHBondContact O-N 3.48Å; L95-L98 PolarHBondContact O-N 3.49Å; L95-L98 VanDerWaalsContact O-N 3.17Å; L95-V99 HydrophobicContact CD1-CG2 4.3Å; L95-V99 HydrophobicContact CG-CG2 4.49Å; L95-V99 VanDerWaalsContact O-CG2 3.3Å; L95-V99 WeakPolarHBondContact O-CG2 3.33Å; L95-V99 PolarHBondContact O-N 3.37Å
96	K	88.2	Confident	87.8	Confident	25 Å²	25	51.7 Å²	51.7	11%	0.109	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-42.7	177.1	-156.1	176	-162.2	-175.7	0	112.4	V88 N92 E94 V99 Y100	V88-K96 WeakPolarHBondContact O-CE 3.39Å; N92-K96 WeakPolarHBondContact O-CB 3.49Å; N92-K96 PolarHBondContact O-N 3.4Å; E94-K96 VanDerWaalsContact C-N 3.3Å; E94-K96 PolarHBondContact O-N 2.98Å; K96-V99 PolarHBondContact O-N 2.75Å; K96-Y100 HydrophobicContact CD-CE1 4.27Å; K96-Y100 VanDerWaalsContact CE-OH 3.26Å; K96-Y100 WeakPolarHBondContact CE-OH 3.26Å; K96-Y100 HydrophobicContact CG-CD1 4.1Å; K96-Y100 HydrophobicContact CG-CE1 3.59Å; K96-Y100 VanDerWaalsContact O-CB 3.25Å; K96-Y100 WeakPolarHBondContact O-CB 3.44Å; K96-Y100 WeakPolarHBondContact O-CD1 3.28Å; K96-Y100 PolarHBondContact O-N 2.94Å
97	K	89.3	Confident	87.8	Confident	129 Å²	129	45.6 Å²	45.6	56%	0.561	23%	0.227	S	C	*	.	H	α-helix	trans	-61.8	-41.2	174.6	-78.3	169.4	179.2	176.8	0	112.9	I93 E94 L95 Y100 V101	I93-K97 HydrophobicContact CG2-CD 4.31Å; I93-K97 WeakPolarHBondContact O-CB 3.42Å; I93-K97 VanDerWaalsContact O-CG 3.25Å; I93-K97 WeakPolarHBondContact O-CG 3.48Å; I93-K97 PolarHBondContact O-N 3.09Å; E94-K97 WeakPolarHBondContact O-CB 3.34Å; E94-K97 PolarHBondContact O-N 2.8Å; L95-K97 PolarHBondContact O-N 3.48Å; K97-Y100 PolarHBondContact O-N 3.44Å; K97-V101 WeakPolarHBondContact O-CG2 3.41Å; K97-V101 PolarHBondContact O-N 3.47Å; K97-V101 VanDerWaalsContact O-N 3.08Å
98	L	90.4	Very high	87.6	Confident	34 Å²	34	48.5 Å²	48.5	18%	0.178	24%	0.241	C	C	.	.	H	α-helix	trans	-68.6	-43.3	178.1	-65	168.7	0	0	0	111.6	M64 K65 V68 E94 L95 Y100 V101 Y102	M64-L98 HydrophobicContact CB-CB 3.92Å; M64-L98 HydrophobicContact CB-CD1 3.86Å; M64-L98 HydrophobicContact CE-CB 4.17Å; K65-L98 HydrophobicContact CG-CD1 3.77Å; V68-L98 HydrophobicContact CG2-CD2 4.15Å; E94-L98 WeakPolarHBondContact O-CG 3.49Å; E94-L98 PolarHBondContact O-N 2.92Å; L95-L98 PolarHBondContact O-N 3.49Å; L95-L98 VanDerWaalsContact O-N 3.17Å; L98-Y100 VanDerWaalsContact C-N 3.33Å; L98-Y100 PolarHBondContact O-N 3.43Å; L98-V101 PolarHBondContact O-N 2.91Å; L98-Y102 PolarHBondContact O-N 2.84Å
99	V	90.6	Very high	87.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-42.6	174.6	172	0	0	0	0	110.8	M64 V84 N87 V88 L95 K96 V101 Y102 L103	M64-V99 HydrophobicContact CE-CG2 4.12Å; M64-V99 HydrophobicContact CG-CG2 4.21Å; M64-V99 HydrophobicContact SD-CG2 4.19Å; V84-V99 HydrophobicContact CG1-CB 4.33Å; V84-V99 HydrophobicContact CG1-CG1 3.89Å; V84-V99 HydrophobicContact CG1-CG2 4.15Å; N87-V99 HydrophobicContact CB-CG2 4.28Å; V88-V99 HydrophobicContact CB-CG1 4.23Å; V88-V99 HydrophobicContact CG2-CG1 3.46Å; V88-V99 VanDerWaalsContact CG2-CG1 3.46Å; L95-V99 HydrophobicContact CD1-CG2 4.3Å; L95-V99 HydrophobicContact CG-CG2 4.49Å; L95-V99 VanDerWaalsContact O-CG2 3.3Å; L95-V99 WeakPolarHBondContact O-CG2 3.33Å; L95-V99 PolarHBondContact O-N 3.37Å; K96-V99 PolarHBondContact O-N 2.75Å; V99-V101 PolarHBondContact O-N 3.3Å; V99-Y102 PolarHBondContact O-N 2.7Å; V99-L103 HydrophobicContact CG1-CD1 4.38Å; V99-L103 WeakPolarHBondContact O-CG 3.49Å; V99-L103 PolarHBondContact O-N 3.26Å
100	Y	91	Very high	87.7	Confident	5 Å²	5	54.7 Å²	54.7	2%	0.02	26%	0.26	C	S	.	.	H	α-helix	trans	-59.5	-43.3	175.1	-81.8	17.9	0	0	0	112.6	V88 K96 K97 L98 V104 F121 V139	V88-Y100 HydrophobicContact CG1-CE1 4.25Å; K96-Y100 HydrophobicContact CD-CE1 4.27Å; K96-Y100 VanDerWaalsContact CE-OH 3.26Å; K96-Y100 WeakPolarHBondContact CE-OH 3.26Å; K96-Y100 HydrophobicContact CG-CD1 4.1Å; K96-Y100 HydrophobicContact CG-CE1 3.59Å; K96-Y100 VanDerWaalsContact O-CB 3.25Å; K96-Y100 WeakPolarHBondContact O-CB 3.44Å; K96-Y100 WeakPolarHBondContact O-CD1 3.28Å; K96-Y100 PolarHBondContact O-N 2.94Å; K97-Y100 PolarHBondContact O-N 3.44Å; L98-Y100 VanDerWaalsContact C-N 3.33Å; L98-Y100 PolarHBondContact O-N 3.43Å; Y100-V104 WeakPolarHBondContact O-CG2 3.41Å; Y100-V104 PolarHBondContact O-N 3.18Å; Y100-F121 AromaticContact CD1-CE1 3.89Å; Y100-F121 HydrophobicContact CD1-CE1 3.89Å; Y100-F121 HydrophobicContact CD1-CZ 4.4Å; Y100-F121 HydrophobicContact CE1-CD1 4.2Å; Y100-F121 AromaticContact CE1-CE1 3.44Å; Y100-F121 HydrophobicContact CE1-CE1 3.44Å; Y100-F121 VanDerWaalsContact CE1-CE1 3.44Å; Y100-F121 HydrophobicContact CE1-CZ 4.27Å; Y100-F121 HydrophobicContact CE2-CE1 4.43Å; Y100-F121 AromaticContact CZ-CE1 3.74Å; Y100-V139 HydrophobicContact CD2-CB 4.5Å; Y100-V139 HydrophobicContact CD2-CG2 3.61Å; Y100-V139 HydrophobicContact CE2-CG2 4.36Å; Y100-V139 HydrophobicContact CG-CG2 3.75Å
101	V	88.6	Confident	87.8	Confident	82 Å²	82	58 Å²	58	50%	0.497	27%	0.274	S	S	.	.	H	α-helix	trans	-66.2	-40	176.3	169.4	0	0	0	0	111.7	K97 L98 V99	K97-V101 WeakPolarHBondContact O-CG2 3.41Å; K97-V101 PolarHBondContact O-N 3.47Å; K97-V101 VanDerWaalsContact O-N 3.08Å; L98-V101 PolarHBondContact O-N 2.91Å; V99-V101 PolarHBondContact O-N 3.3Å
102	Y	90.8	Very high	87.8	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62	-46.7	176	177.7	-82.6	0	0	0	112	M64 I67 I71 A77 F81 V84 L98 V99 V104 R105 Y106	M64-Y102 HydrophobicContact CE-CG 4.38Å; I67-Y102 HydrophobicContact CG2-CD2 3.71Å; I67-Y102 HydrophobicContact CG2-CE2 3.79Å; I71-Y102 HydrophobicContact CD1-CD2 3.74Å; I71-Y102 HydrophobicContact CD1-CE2 4.28Å; A77-Y102 HydrophobicContact CB-CE2 4.4Å; A77-Y102 PolarHBondContact O-OH 2.72Å; F81-Y102 VanDerWaalsContact CA-OH 3.29Å; F81-Y102 WeakPolarHBondContact CA-OH 3.4Å; F81-Y102 HydrophobicContact CB-CE1 4.26Å; F81-Y102 HydrophobicContact CD2-CD1 4.41Å; F81-Y102 AromaticContact CD2-CE1 3.52Å; F81-Y102 HydrophobicContact CD2-CE1 3.52Å; F81-Y102 HydrophobicContact CE2-CE1 4.21Å; F81-Y102 HydrophobicContact CG-CE1 4.18Å; F81-Y102 PolarHBondContact N-OH 3.39Å; F81-Y102 VanDerWaalsContact N-OH 3.09Å; V84-Y102 HydrophobicContact CB-CD1 3.89Å; V84-Y102 HydrophobicContact CB-CE1 3.76Å; V84-Y102 HydrophobicContact CG1-CD1 3.39Å; V84-Y102 HydrophobicContact CG1-CE1 3.83Å; V84-Y102 HydrophobicContact CG1-CG 3.83Å; V84-Y102 HydrophobicContact CG2-CD1 4.21Å; V84-Y102 HydrophobicContact CG2-CD2 4.44Å; V84-Y102 HydrophobicContact CG2-CE1 3.96Å; V84-Y102 HydrophobicContact CG2-CE2 4.25Å; V84-Y102 HydrophobicContact CG2-CG 4.44Å; L98-Y102 PolarHBondContact O-N 2.84Å; V99-Y102 PolarHBondContact O-N 2.7Å; Y102-V104 PolarHBondContact O-N 3.21Å; Y102-R105 PolarHBondContact O-N 3.41Å; Y102-R105 VanDerWaalsContact O-N 3.12Å; Y102-Y106 HydrophobicContact CD1-CD2 4.24Å; Y102-Y106 AromaticContact CD2-CD2 3.86Å; Y102-Y106 HydrophobicContact CD2-CD2 3.86Å; Y102-Y106 HydrophobicContact CD2-CE2 4.02Å; Y102-Y106 AromaticContact CE1-CD2 3.98Å; Y102-Y106 HydrophobicContact CE1-CD2 3.98Å; Y102-Y106 AromaticContact CE2-CD2 3.54Å; Y102-Y106 HydrophobicContact CE2-CD2 3.54Å; Y102-Y106 AromaticContact CE2-CE2 3.63Å; Y102-Y106 HydrophobicContact CE2-CE2 3.63Å; Y102-Y106 HydrophobicContact CG-CD2 4.18Å; Y102-Y106 AromaticContact CZ-CD2 3.6Å; Y102-Y106 PolarHBondContact O-N 3.49Å; Y102-Y106 VanDerWaalsContact O-N 3.16Å
103	L	89.1	Confident	87.6	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-62	-40.8	179.7	-73.9	179.9	0	0	0	112.8	F81 V85 V88 V99 R105 Y106 A107 F121	F81-L103 HydrophobicContact CE1-CD2 4.37Å; F81-L103 HydrophobicContact CE2-CD2 3.7Å; F81-L103 HydrophobicContact CZ-CD2 3.59Å; V85-L103 HydrophobicContact CG2-CD2 3.91Å; V88-L103 HydrophobicContact CG2-CD1 3.62Å; V99-L103 HydrophobicContact CG1-CD1 4.38Å; V99-L103 WeakPolarHBondContact O-CG 3.49Å; V99-L103 PolarHBondContact O-N 3.26Å; L103-R105 PolarHBondContact O-N 3.14Å; L103-R105 VanDerWaalsContact O-N 3.15Å; L103-Y106 PolarHBondContact O-N 2.93Å; L103-A107 WeakPolarHBondContact O-CB 3.49Å; L103-A107 PolarHBondContact O-N 2.87Å; L103-F121 HydrophobicContact CD1-CE2 4.18Å; L103-F121 HydrophobicContact CD1-CZ 3.76Å
104	V	87.6	Confident	87.6	Confident	58 Å²	58	52 Å²	52	35%	0.352	25%	0.252	S	S	.	.	H	α-helix	trans	-62.5	-21.4	177.8	174	0	0	0	0	112.6	Y100 Y102 V139	Y100-V104 WeakPolarHBondContact O-CG2 3.41Å; Y100-V104 PolarHBondContact O-N 3.18Å; Y102-V104 PolarHBondContact O-N 3.21Å; V104-V139 HydrophobicContact CG2-CB 4.32Å; V104-V139 HydrophobicContact CG2-CG1 3.9Å; V104-V139 HydrophobicContact CG2-CG2 4.06Å
105	R	87.7	Confident	87.4	Confident	112 Å²	112	49.9 Å²	49.9	42%	0.423	24%	0.244	S	C	.	.	H	α-helix	trans	-87.9	-40.1	174.1	-178.8	57.5	-178.5	-168.1	3.3	113.6	Y102 L103	Y102-R105 PolarHBondContact O-N 3.41Å; Y102-R105 VanDerWaalsContact O-N 3.12Å; L103-R105 PolarHBondContact O-N 3.14Å; L103-R105 VanDerWaalsContact O-N 3.15Å
106	Y	88.3	Confident	87.2	Confident	8 Å²	8	55.1 Å²	55.1	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-107.4	-8.3	-168.3	-71	-70.4	0	0	0	115.2	I71 A77 Y102 L103 E108 E109 Q110	I71-Y106 HydrophobicContact CD1-CE2 3.77Å; I71-Y106 HydrophobicContact CG1-CE2 4.05Å; A77-Y106 HydrophobicContact CB-CE2 4.43Å; A77-Y106 PolarHBondContact N-OH 2.69Å; Y102-Y106 HydrophobicContact CD1-CD2 4.24Å; Y102-Y106 AromaticContact CD2-CD2 3.86Å; Y102-Y106 HydrophobicContact CD2-CD2 3.86Å; Y102-Y106 HydrophobicContact CD2-CE2 4.02Å; Y102-Y106 AromaticContact CE1-CD2 3.98Å; Y102-Y106 HydrophobicContact CE1-CD2 3.98Å; Y102-Y106 AromaticContact CE2-CD2 3.54Å; Y102-Y106 HydrophobicContact CE2-CD2 3.54Å; Y102-Y106 AromaticContact CE2-CE2 3.63Å; Y102-Y106 HydrophobicContact CE2-CE2 3.63Å; Y102-Y106 HydrophobicContact CG-CD2 4.18Å; Y102-Y106 AromaticContact CZ-CD2 3.6Å; Y102-Y106 PolarHBondContact O-N 3.49Å; Y102-Y106 VanDerWaalsContact O-N 3.16Å; L103-Y106 PolarHBondContact O-N 2.93Å; Y106-E108 PolarHBondContact O-N 2.95Å; Y106-E109 WeakPolarHBondContact CD1-OE2 3.48Å; Y106-E109 PolarHBondContact O-N 3Å; Y106-E109 VanDerWaalsContact O-N 3.17Å; Y106-Q110 PolarHBondContact O-N 3.25Å; Y106-Q110 VanDerWaalsContact O-N 3.15Å
107	A	85.6	Confident	87.1	Confident	2 Å²	2	54 Å²	54	2%	0.017	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-22.5	-179.3	0	0	0	0	0	113.7	F81 L103 Q111 A114 I143	F81-A107 HydrophobicContact CZ-CB 4.49Å; L103-A107 WeakPolarHBondContact O-CB 3.49Å; L103-A107 PolarHBondContact O-N 2.87Å; A107-Q111 WeakPolarHBondContact O-CA 3.33Å; A107-Q111 PolarHBondContact O-N 2.99Å; A107-A114 HydrophobicContact CB-CB 3.78Å; A107-I143 HydrophobicContact CB-CG1 4.08Å; A107-I143 HydrophobicContact CB-CG2 4.16Å
108	E	84.8	Confident	87	Confident	67 Å²	67	48.7 Å²	48.7	31%	0.313	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-34	174.5	-59.6	-175.9	158.2	0	0	111.7	Y106 Q111 R144	Y106-E108 PolarHBondContact O-N 2.95Å; E108-Q111 WeakPolarHBondContact O-CG 3.29Å; E108-Q111 PolarHBondContact O-NE2 2.88Å; E108-R144 HydrophobicContact CG-CB 4.43Å; E108-R144 WeakPolarHBondContact OE1-CB 3.35Å; E108-R144 WeakPolarHBondContact OE1-CD 3.34Å; E108-R144 WeakPolarHBondContact OE1-CG 3.48Å; E108-R144 IonicContact OE1-CZ 3.84Å; E108-R144 IonicContact OE1-NE 3.53Å; E108-R144 IonicContact OE1-NH1 2.8Å; E108-R144 PolarHBondContact OE1-NH1 2.91Å; E108-R144 IonicContact OE2-NH1 2.76Å; E108-R144 PolarHBondContact OE2-NH1 2.72Å
109	E	86.1	Confident	86.8	Confident	102 Å²	102	50.4 Å²	50.4	48%	0.477	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-27.3	175.6	-64.3	179.5	-160.5	0	0	113	Y106	Y106-E109 WeakPolarHBondContact CD1-OE2 3.48Å; Y106-E109 PolarHBondContact O-N 3Å; Y106-E109 VanDerWaalsContact O-N 3.17Å
110	Q	85	Confident	86.8	Confident	84 Å²	84	51.4 Å²	51.4	39%	0.393	27%	0.265	S	S	.	.	S	Bend	trans	-133.9	58.8	-170.8	-68.7	-65.6	-76.3	0	0	112	F81 Y106 D112 L113 A114	F81-Q110 HydrophobicContact CD1-CB 3.93Å; F81-Q110 HydrophobicContact CD2-CB 4.27Å; F81-Q110 HydrophobicContact CE1-CB 3.93Å; F81-Q110 HydrophobicContact CE2-CB 4.28Å; F81-Q110 HydrophobicContact CG-CB 4.11Å; F81-Q110 HydrophobicContact CG-CG 4.35Å; F81-Q110 HydrophobicContact CZ-CB 4.11Å; Y106-Q110 PolarHBondContact O-N 3.25Å; Y106-Q110 VanDerWaalsContact O-N 3.15Å; Q110-D112 PolarHBondContact O-N 2.86Å; Q110-L113 PolarHBondContact O-N 3.31Å; Q110-A114 PolarHBondContact O-N 3.01Å
111	Q	85.8	Confident	86.7	Confident	87 Å²	87	51.1 Å²	51.1	41%	0.407	26%	0.264	S	S	.	.	H	α-helix	trans	-59.7	-46.9	-168.6	-55.4	-171.9	12.8	0	0	113.4	A107 E108 L113 A114 L115 V145	A107-Q111 WeakPolarHBondContact O-CA 3.33Å; A107-Q111 PolarHBondContact O-N 2.99Å; E108-Q111 WeakPolarHBondContact O-CG 3.29Å; E108-Q111 PolarHBondContact O-NE2 2.88Å; Q111-L113 VanDerWaalsContact C-N 3.34Å; Q111-L113 PolarHBondContact O-N 2.85Å; Q111-A114 WeakPolarHBondContact O-CA 3.4Å; Q111-A114 VanDerWaalsContact O-CB 3.3Å; Q111-A114 WeakPolarHBondContact O-CB 3.44Å; Q111-A114 PolarHBondContact O-N 2.76Å; Q111-L115 PolarHBondContact O-N 2.86Å; Q111-L115 VanDerWaalsContact O-N 3.14Å; Q111-V145 HydrophobicContact CB-CG2 4Å; Q111-V145 HydrophobicContact CG-CG2 3.91Å
112	D	84.8	Confident	86.8	Confident	133 Å²	133	51.2 Å²	51.2	71%	0.711	26%	0.259	S	S	*	.	H	α-helix	trans	-59.9	-42.4	-178.5	-60.4	-47.4	0	0	0	112.7	Q110 A114 L115	Q110-D112 PolarHBondContact O-N 2.86Å; D112-A114 VanDerWaalsContact C-N 3.32Å; D112-L115 WeakPolarHBondContact O-CB 3.12Å; D112-L115 PolarHBondContact O-N 2.86Å
113	L	83.5	Confident	86.7	Confident	55 Å²	55	59 Å²	59	29%	0.288	29%	0.289	S	S	.	.	H	α-helix	trans	-72.5	-27.4	176.9	-66.5	176	0	0	0	111.9	F81 P82 Q110 Q111 L115 L116	F81-L113 HydrophobicContact CD1-CB 3.71Å; F81-L113 HydrophobicContact CD1-CD1 4.08Å; F81-L113 HydrophobicContact CE1-CB 3.55Å; P82-L113 HydrophobicContact CG-CD1 4.06Å; Q110-L113 PolarHBondContact O-N 3.31Å; Q111-L113 VanDerWaalsContact C-N 3.34Å; Q111-L113 PolarHBondContact O-N 2.85Å; L113-L115 VanDerWaalsContact C-N 3.32Å; L113-L116 HydrophobicContact CD2-CD1 4.17Å; L113-L116 WeakPolarHBondContact O-CB 3.39Å
114	A	84	Confident	86.8	Confident	3 Å²	3	59.2 Å²	59.2	3%	0.025	29%	0.29	C	S	.	.	H	α-helix	trans	-67	-32.8	173.5	0	0	0	0	0	111.9	F81 A107 Q110 Q111 D112 L116 S117	F81-A114 HydrophobicContact CZ-CB 4.11Å; A107-A114 HydrophobicContact CB-CB 3.78Å; Q110-A114 PolarHBondContact O-N 3.01Å; Q111-A114 WeakPolarHBondContact O-CA 3.4Å; Q111-A114 VanDerWaalsContact O-CB 3.3Å; Q111-A114 WeakPolarHBondContact O-CB 3.44Å; Q111-A114 PolarHBondContact O-N 2.76Å; D112-A114 VanDerWaalsContact C-N 3.32Å; A114-L116 PolarHBondContact O-N 2.91Å; A114-S117 VanDerWaalsContact O-CB 3.31Å; A114-S117 WeakPolarHBondContact O-CB 3.31Å; A114-S117 PolarHBondContact O-N 3.02Å
115	L	84.9	Confident	86.9	Confident	60 Å²	60	57.4 Å²	57.4	31%	0.314	28%	0.278	S	S	.	.	H	α-helix	trans	-55.8	-37.1	177.9	-59	-177.5	0	0	0	112.5	Q111 D112 L113 S117 I118 V145 I148	Q111-L115 PolarHBondContact O-N 2.86Å; Q111-L115 VanDerWaalsContact O-N 3.14Å; D112-L115 WeakPolarHBondContact O-CB 3.12Å; D112-L115 PolarHBondContact O-N 2.86Å; L113-L115 VanDerWaalsContact C-N 3.32Å; L115-S117 PolarHBondContact O-N 2.73Å; L115-S117 VanDerWaalsContact O-N 3.13Å; L115-I118 HydrophobicContact CB-CD1 4.27Å; L115-I118 HydrophobicContact CD2-CD1 3.66Å; L115-I118 WeakPolarHBondContact O-CB 3.38Å; L115-I118 WeakPolarHBondContact O-CG1 3.45Å; L115-I118 PolarHBondContact O-N 3.24Å; L115-V145 HydrophobicContact CD2-CG1 4.12Å; L115-I148 HydrophobicContact CD2-CG2 4.22Å
116	L	84.3	Confident	87	Confident	111 Å²	111	58.8 Å²	58.8	58%	0.581	29%	0.287	S	S	*	.	H	α-helix	trans	-56.9	-29.5	176.8	-59.8	174.2	0	0	0	112.7	V85 L113 A114 S119	V85-L116 HydrophobicContact CG1-CB 4.21Å; L113-L116 HydrophobicContact CD2-CD1 4.17Å; L113-L116 WeakPolarHBondContact O-CB 3.39Å; A114-L116 PolarHBondContact O-N 2.91Å; L116-S119 PolarHBondContact O-OG 3.13Å
117	S	86.4	Confident	87.1	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.014	30%	0.297	C	S	.	.	H	α-helix	trans	-76.9	-22.4	179.9	-57.5	0	0	0	0	113.4	A114 L115 S119 T120 F121	A114-S117 VanDerWaalsContact O-CB 3.31Å; A114-S117 WeakPolarHBondContact O-CB 3.31Å; A114-S117 PolarHBondContact O-N 3.02Å; L115-S117 PolarHBondContact O-N 2.73Å; L115-S117 VanDerWaalsContact O-N 3.13Å; S117-S119 PolarHBondContact O-N 3.13Å; S117-T120 WeakPolarHBondContact O-CA 3.46Å; S117-T120 WeakPolarHBondContact O-CB 3.38Å; S117-T120 PolarHBondContact O-N 3.35Å; S117-F121 WeakPolarHBondContact O-CD2 3.49Å; S117-F121 PolarHBondContact O-N 3.46Å
118	I	87.1	Confident	87.3	Confident	16 Å²	16	66.3 Å²	66.3	8%	0.082	34%	0.335	C	S	.	.	H	α-helix	trans	-59.4	-44.5	-173.8	-60.5	170.5	0	0	0	111.5	L115 T120 F121 Q122 L140 I148 I151	L115-I118 HydrophobicContact CB-CD1 4.27Å; L115-I118 HydrophobicContact CD2-CD1 3.66Å; L115-I118 WeakPolarHBondContact O-CB 3.38Å; L115-I118 WeakPolarHBondContact O-CG1 3.45Å; L115-I118 PolarHBondContact O-N 3.24Å; I118-T120 PolarHBondContact O-N 3.3Å; I118-F121 PolarHBondContact O-N 3.24Å; I118-Q122 HydrophobicContact CG2-CG 4.36Å; I118-Q122 WeakPolarHBondContact O-CG 3.38Å; I118-Q122 PolarHBondContact O-N 2.9Å; I118-L140 HydrophobicContact CG2-CD1 4.4Å; I118-I148 HydrophobicContact CD1-CB 4.23Å; I118-I148 HydrophobicContact CD1-CG2 3.38Å; I118-I148 HydrophobicContact CG1-CG2 4.41Å; I118-I151 HydrophobicContact CG2-CD1 4.12Å; I118-I151 HydrophobicContact CG2-CG2 4.14Å
119	S	87.3	Confident	87.6	Confident	71 Å²	71	65.7 Å²	65.7	50%	0.497	33%	0.334	S	S	.	.	H	α-helix	trans	-56.2	-35.4	175.9	64.6	0	0	0	0	112.8	L116 S117 R123	L116-S119 PolarHBondContact O-OG 3.13Å; S117-S119 PolarHBondContact O-N 3.13Å; S119-R123 PolarHBondContact O-N 2.93Å
120	T	89.3	Confident	87.9	Confident	20 Å²	20	64.2 Å²	64.2	12%	0.123	33%	0.327	C	S	.	.	H	α-helix	trans	-78.8	-33.3	177.9	-64.7	0	0	0	0	111.8	V88 A89 S117 I118 A124	V88-T120 HydrophobicContact CB-CG2 4.39Å; V88-T120 HydrophobicContact CG1-CG2 3.76Å; A89-T120 HydrophobicContact CB-CG2 4.01Å; S117-T120 WeakPolarHBondContact O-CA 3.46Å; S117-T120 WeakPolarHBondContact O-CB 3.38Å; S117-T120 PolarHBondContact O-N 3.35Å; I118-T120 PolarHBondContact O-N 3.3Å; T120-A124 VanDerWaalsContact O-CB 3.31Å; T120-A124 WeakPolarHBondContact O-CB 3.38Å; T120-A124 PolarHBondContact O-N 3.24Å
121	F	90.1	Very high	88.1	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-65.7	-45.6	169.6	-67.9	-60.9	0	0	0	112	V88 Y100 L103 S117 I118 R123 A124 L125 A136 V139 L140 I143	V88-F121 HydrophobicContact CG1-CE1 4.48Å; V88-F121 HydrophobicContact CG1-CZ 4.32Å; Y100-F121 AromaticContact CD1-CE1 3.89Å; Y100-F121 HydrophobicContact CD1-CE1 3.89Å; Y100-F121 HydrophobicContact CD1-CZ 4.4Å; Y100-F121 HydrophobicContact CE1-CD1 4.2Å; Y100-F121 AromaticContact CE1-CE1 3.44Å; Y100-F121 HydrophobicContact CE1-CE1 3.44Å; Y100-F121 VanDerWaalsContact CE1-CE1 3.44Å; Y100-F121 HydrophobicContact CE1-CZ 4.27Å; Y100-F121 HydrophobicContact CE2-CE1 4.43Å; Y100-F121 AromaticContact CZ-CE1 3.74Å; L103-F121 HydrophobicContact CD1-CE2 4.18Å; L103-F121 HydrophobicContact CD1-CZ 3.76Å; S117-F121 WeakPolarHBondContact O-CD2 3.49Å; S117-F121 PolarHBondContact O-N 3.46Å; I118-F121 PolarHBondContact O-N 3.24Å; F121-R123 VanDerWaalsContact C-N 3.3Å; F121-R123 PolarHBondContact O-N 2.79Å; F121-A124 CarbonylContact O-C 3.58Å; F121-A124 WeakPolarHBondContact O-CA 3.48Å; F121-A124 PolarHBondContact O-N 2.7Å; F121-L125 WeakPolarHBondContact O-CG 3.15Å; F121-L125 PolarHBondContact O-N 2.7Å; F121-A136 HydrophobicContact CD1-CB 4.26Å; F121-V139 HydrophobicContact CE1-CB 3.85Å; F121-V139 HydrophobicContact CE1-CG1 3.53Å; F121-V139 HydrophobicContact CE2-CG1 4.14Å; F121-V139 HydrophobicContact CZ-CB 4.16Å; F121-V139 HydrophobicContact CZ-CG1 3.32Å; F121-L140 HydrophobicContact CB-CD1 4.43Å; F121-I143 HydrophobicContact CE2-CD1 3.93Å
122	Q	90	Very high	88.3	Confident	84 Å²	84	62.2 Å²	62.2	39%	0.393	32%	0.316	S	S	.	.	H	α-helix	trans	-55	-43.6	174.6	-74	174.6	-33.4	0	0	112	I118 L125 I151	I118-Q122 HydrophobicContact CG2-CG 4.36Å; I118-Q122 WeakPolarHBondContact O-CG 3.38Å; I118-Q122 PolarHBondContact O-N 2.9Å; Q122-L125 PolarHBondContact O-N 3.06Å; Q122-I151 HydrophobicContact CG-CG2 4.11Å; Q122-I151 VanDerWaalsContact NE2-CG2 3.32Å
123	R	89.7	Confident	88.7	Confident	164 Å²	164	57.7 Å²	57.7	62%	0.619	29%	0.289	S	S	*	.	H	α-helix	trans	-66.5	-38.8	173.4	-176.7	171.5	57.6	179.1	-5.5	112.6	S119 F121 L125 K126	S119-R123 PolarHBondContact O-N 2.93Å; F121-R123 VanDerWaalsContact C-N 3.3Å; F121-R123 PolarHBondContact O-N 2.79Å; R123-L125 VanDerWaalsContact C-N 3.3Å; R123-L125 PolarHBondContact O-N 2.86Å; R123-K126 PolarHBondContact O-N 2.98Å; R123-K126 VanDerWaalsContact O-N 3.12Å
124	A	89.9	Confident	89.1	Confident	4 Å²	4	55.1 Å²	55.1	3%	0.033	28%	0.276	C	S	.	.	H	α-helix	trans	-70.8	-21.7	178.4	0	0	0	0	0	113.8	T120 F121 K126 D127 I132 A136	T120-A124 VanDerWaalsContact O-CB 3.31Å; T120-A124 WeakPolarHBondContact O-CB 3.38Å; T120-A124 PolarHBondContact O-N 3.24Å; F121-A124 CarbonylContact O-C 3.58Å; F121-A124 WeakPolarHBondContact O-CA 3.48Å; F121-A124 PolarHBondContact O-N 2.7Å; A124-K126 PolarHBondContact O-N 2.76Å; A124-D127 VanDerWaalsContact O-CB 3.31Å; A124-D127 WeakPolarHBondContact O-CB 3.39Å; A124-D127 PolarHBondContact O-N 2.97Å; A124-I132 HydrophobicContact CB-CG2 4.22Å; A124-A136 HydrophobicContact CB-CB 3.71Å
125	L	89.7	Confident	89.4	Confident	21 Å²	21	56.3 Å²	56.3	11%	0.11	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-16.6	168.9	-70.3	172.1	0	0	0	113	F121 Q122 R123 R133 A136 L137 L140 A155	F121-L125 WeakPolarHBondContact O-CG 3.15Å; F121-L125 PolarHBondContact O-N 2.7Å; Q122-L125 PolarHBondContact O-N 3.06Å; R123-L125 VanDerWaalsContact C-N 3.3Å; R123-L125 PolarHBondContact O-N 2.86Å; L125-R133 WeakPolarHBondContact O-CD 3.35Å; L125-R133 WeakPolarHBondContact O-CG 3.18Å; L125-A136 HydrophobicContact CD2-CB 4.22Å; L125-A136 HydrophobicContact CG-CB 4.42Å; L125-L137 HydrophobicContact CD2-CB 3.69Å; L125-L137 HydrophobicContact CD2-CD1 4.14Å; L125-L137 HydrophobicContact CD2-CG 4.48Å; L125-L140 HydrophobicContact CD1-CD2 4.09Å; L125-A155 HydrophobicContact CD1-CB 3.53Å
126	K	91.2	Very high	89.7	Confident	140 Å²	140	53.4 Å²	53.4	61%	0.609	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	17.4	179.6	-51.8	-164.4	179.5	-160.4	0	112.5	R123 A124 E158	R123-K126 PolarHBondContact O-N 2.98Å; R123-K126 VanDerWaalsContact O-N 3.12Å; A124-K126 PolarHBondContact O-N 2.76Å; K126-E158 WeakPolarHBondContact CE-OE2 3.34Å; K126-E158 VanDerWaalsContact NZ-CD 3.27Å; K126-E158 IonicContact NZ-OE1 2.68Å; K126-E158 PolarHBondContact NZ-OE1 2.96Å; K126-E158 IonicContact NZ-OE2 2.54Å; K126-E158 PolarHBondContact NZ-OE2 3.25Å
127	D	90.3	Very high	90.1	Very high	43 Å²	43	48.2 Å²	48.2	23%	0.23	24%	0.242	C	C	.	.			trans	-72.6	140.5	174.2	-169.3	-67.7	0	0	0	111	A124 N129 I132 R133	A124-D127 VanDerWaalsContact O-CB 3.31Å; A124-D127 WeakPolarHBondContact O-CB 3.39Å; A124-D127 PolarHBondContact O-N 2.97Å; D127-N129 PolarHBondContact O-N 3.45Å; D127-N129 VanDerWaalsContact OD1-CB 3.28Å; D127-N129 WeakPolarHBondContact OD1-CB 3.09Å; D127-N129 PolarHBondContact OD1-N 3.18Å; D127-I132 HydrophobicContact CB-CB 4.14Å; D127-I132 HydrophobicContact CB-CG2 3.85Å; D127-R133 HydrophobicContact CB-CG 4.4Å; D127-R133 WeakPolarHBondContact O-CD 3.48Å; D127-R133 WeakPolarHBondContact O-CG 3.02Å; D127-R133 PolarHBondContact O-NH1 3.44Å
128	P	89.4	Confident	90.4	Very high	126 Å²	126	54.8 Å²	54.8	82%	0.818	27%	0.266	S	S	*	.	S	Bend	trans	-60.7	-25.6	178.3	24.6	-35.3	0	0	0	113.7	Q130 R133	P128-Q130 PolarHBondContact O-N 2.84Å; P128-R133 PolarHBondContact O-NH1 3.03Å
129	N	90.8	Very high	90.6	Very high	54 Å²	54	54.1 Å²	54.1	29%	0.289	26%	0.263	S	S	.	.			trans	-83.2	113.9	-178.7	-173.5	-21.6	0	0	0	112	D127 F131 I132 R133	D127-N129 PolarHBondContact O-N 3.45Å; D127-N129 VanDerWaalsContact OD1-CB 3.28Å; D127-N129 WeakPolarHBondContact OD1-CB 3.09Å; D127-N129 PolarHBondContact OD1-N 3.18Å; N129-F131 PolarHBondContact O-N 3.28Å; N129-F131 VanDerWaalsContact O-N 3.09Å; N129-F131 WeakPolarHBondContact OD1-CB 3.24Å; N129-F131 WeakPolarHBondContact OD1-CD2 3.24Å; N129-F131 PolarHBondContact OD1-N 2.93Å; N129-I132 HydrophobicContact CB-CB 4.22Å; N129-I132 HydrophobicContact CB-CD1 3.96Å; N129-I132 HydrophobicContact CB-CG1 3.94Å; N129-I132 WeakPolarHBondContact O-CA 3.46Å; N129-I132 PolarHBondContact O-N 3.08Å; N129-R133 PolarHBondContact O-N 3.37Å
130	Q	92.1	Very high	90.7	Very high	70 Å²	70	50.8 Å²	50.8	33%	0.327	24%	0.239	S	C	.	.	H	α-helix	trans	-50.7	-34.1	176.7	65.7	-177.9	-0.9	0	0	114.2	P128 A134 S164 V167	P128-Q130 PolarHBondContact O-N 2.84Å; Q130-A134 VanDerWaalsContact O-CB 3.27Å; Q130-A134 WeakPolarHBondContact O-CB 3.33Å; Q130-A134 PolarHBondContact O-N 3.41Å; Q130-S164 PolarHBondContact OE1-OG 2.65Å; Q130-V167 HydrophobicContact CB-CG2 4.1Å; Q130-V167 WeakPolarHBondContact O-CG2 3.24Å
131	F	90.4	Very high	90.8	Very high	113 Å²	113	50.1 Å²	50.1	50%	0.496	24%	0.236	S	C	.	.	H	α-helix	trans	-74.4	-28.6	179.1	-58.9	-67.8	0	0	0	112	N129 S135 Y166	N129-F131 PolarHBondContact O-N 3.28Å; N129-F131 VanDerWaalsContact O-N 3.09Å; N129-F131 WeakPolarHBondContact OD1-CB 3.24Å; N129-F131 WeakPolarHBondContact OD1-CD2 3.24Å; N129-F131 PolarHBondContact OD1-N 2.93Å; F131-S135 WeakPolarHBondContact O-CB 3.27Å; F131-S135 PolarHBondContact O-N 2.91Å; F131-S135 PolarHBondContact O-OG 2.92Å; F131-Y166 HydrophobicContact CD1-CD1 4.01Å; F131-Y166 AromaticContact CD1-CE1 3.69Å; F131-Y166 HydrophobicContact CD1-CE1 3.69Å; F131-Y166 HydrophobicContact CE1-CD1 4.26Å; F131-Y166 HydrophobicContact CE1-CE1 4.17Å
132	I	90.2	Very high	90.8	Very high	17 Å²	17	51.3 Å²	51.3	9%	0.087	24%	0.244	C	C	.	.	H	α-helix	trans	-75.6	-43	174.4	-60.6	-178.4	0	0	0	109.8	I93 A124 D127 N129 S135 A136	I93-I132 HydrophobicContact CD1-CD1 4.28Å; I93-I132 HydrophobicContact CG1-CD1 4.26Å; A124-I132 HydrophobicContact CB-CG2 4.22Å; D127-I132 HydrophobicContact CB-CB 4.14Å; D127-I132 HydrophobicContact CB-CG2 3.85Å; N129-I132 HydrophobicContact CB-CB 4.22Å; N129-I132 HydrophobicContact CB-CD1 3.96Å; N129-I132 HydrophobicContact CB-CG1 3.94Å; N129-I132 WeakPolarHBondContact O-CA 3.46Å; N129-I132 PolarHBondContact O-N 3.08Å; I132-S135 PolarHBondContact O-N 3.24Å; I132-S135 PolarHBondContact O-OG 3.43Å; I132-A136 VanDerWaalsContact O-CB 3.29Å; I132-A136 WeakPolarHBondContact O-CB 3.19Å; I132-A136 PolarHBondContact O-N 2.59Å
133	R	92	Very high	90.7	Very high	37 Å²	37	47.7 Å²	47.7	14%	0.14	23%	0.227	C	C	.	.	H	α-helix	trans	-58.7	-54.1	173.3	-60.3	-161.6	-63.9	-87.3	11.3	112	L125 D127 P128 N129 S135 A136 L137 D162 V167	L125-R133 WeakPolarHBondContact O-CD 3.35Å; L125-R133 WeakPolarHBondContact O-CG 3.18Å; D127-R133 HydrophobicContact CB-CG 4.4Å; D127-R133 WeakPolarHBondContact O-CD 3.48Å; D127-R133 WeakPolarHBondContact O-CG 3.02Å; D127-R133 PolarHBondContact O-NH1 3.44Å; P128-R133 PolarHBondContact O-NH1 3.03Å; N129-R133 PolarHBondContact O-N 3.37Å; R133-S135 PolarHBondContact O-N 3.17Å; R133-A136 PolarHBondContact O-N 3.46Å; R133-L137 PolarHBondContact O-N 3.41Å; R133-D162 IonicContact CZ-OD1 3.79Å; R133-D162 IonicContact CZ-OD2 3.97Å; R133-D162 VanDerWaalsContact CZ-OD2 3.29Å; R133-D162 IonicContact NE-OD1 3.91Å; R133-D162 IonicContact NE-OD2 3.41Å; R133-D162 PolarHBondContact NE-OD2 3.4Å; R133-D162 IonicContact NH2-OD1 2.83Å; R133-D162 PolarHBondContact NH2-OD1 2.87Å; R133-D162 IonicContact NH2-OD2 2.57Å; R133-D162 PolarHBondContact NH2-OD2 2.79Å; R133-D162 VanDerWaalsContact NH2-OD2 3.08Å; R133-V167 HydrophobicContact CB-CG2 4.14Å
134	A	91.9	Very high	90.4	Very high	2 Å²	2	47 Å²	47	2%	0.017	23%	0.225	C	C	.	.	H	α-helix	trans	-61.1	-43.5	179.1	0	0	0	0	0	112.6	Q130 A136 L137 R138 Y166 V167 T170	Q130-A134 VanDerWaalsContact O-CB 3.27Å; Q130-A134 WeakPolarHBondContact O-CB 3.33Å; Q130-A134 PolarHBondContact O-N 3.41Å; A134-A136 PolarHBondContact O-N 3.16Å; A134-L137 PolarHBondContact O-N 3.49Å; A134-R138 WeakPolarHBondContact O-CB 3.44Å; A134-R138 PolarHBondContact O-N 3.34Å; A134-Y166 HydrophobicContact CB-CD1 3.65Å; A134-Y166 HydrophobicContact CB-CE1 3.52Å; A134-V167 HydrophobicContact CB-CG2 4.22Å; A134-T170 HydrophobicContact CB-CG2 4.3Å; A134-T170 WeakPolarHBondContact O-CG2 3.36Å
135	S	90.4	Very high	90.2	Very high	27 Å²	27	46.9 Å²	46.9	19%	0.189	22%	0.224	C	C	.	.	H	α-helix	trans	-68.9	-33.1	178.5	59.6	0	0	0	0	113.1	F131 I132 R133 V139	F131-S135 WeakPolarHBondContact O-CB 3.27Å; F131-S135 PolarHBondContact O-N 2.91Å; F131-S135 PolarHBondContact O-OG 2.92Å; I132-S135 PolarHBondContact O-N 3.24Å; I132-S135 PolarHBondContact O-OG 3.43Å; R133-S135 PolarHBondContact O-N 3.17Å; S135-V139 WeakPolarHBondContact O-CG2 3.35Å; S135-V139 PolarHBondContact O-N 3.32Å
136	A	91.8	Very high	90	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-48.2	171.2	0	0	0	0	0	111.4	F121 A124 L125 I132 R133 A134 R138 V139 L140	F121-A136 HydrophobicContact CD1-CB 4.26Å; A124-A136 HydrophobicContact CB-CB 3.71Å; L125-A136 HydrophobicContact CD2-CB 4.22Å; L125-A136 HydrophobicContact CG-CB 4.42Å; I132-A136 VanDerWaalsContact O-CB 3.29Å; I132-A136 WeakPolarHBondContact O-CB 3.19Å; I132-A136 PolarHBondContact O-N 2.59Å; R133-A136 PolarHBondContact O-N 3.46Å; A134-A136 PolarHBondContact O-N 3.16Å; A136-R138 VanDerWaalsContact C-N 3.32Å; A136-R138 PolarHBondContact O-N 3.07Å; A136-V139 PolarHBondContact O-N 3.21Å; A136-L140 WeakPolarHBondContact O-CB 3.45Å; A136-L140 PolarHBondContact O-N 2.92Å
137	L	92.6	Very high	89.8	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-59.7	-41.9	177.2	-173.2	63.6	0	0	0	112.1	L125 R133 A134 V139 S141 A155 I156 A159 T170 A174	L125-L137 HydrophobicContact CD2-CB 3.69Å; L125-L137 HydrophobicContact CD2-CD1 4.14Å; L125-L137 HydrophobicContact CD2-CG 4.48Å; R133-L137 PolarHBondContact O-N 3.41Å; A134-L137 PolarHBondContact O-N 3.49Å; L137-V139 VanDerWaalsContact C-N 3.29Å; L137-V139 PolarHBondContact O-N 3.04Å; L137-S141 WeakPolarHBondContact O-CB 3.33Å; L137-S141 PolarHBondContact O-N 2.84Å; L137-S141 PolarHBondContact O-OG 3.44Å; L137-A155 HydrophobicContact CD1-CB 4.15Å; L137-I156 HydrophobicContact CD1-CG1 4.33Å; L137-A159 HydrophobicContact CD1-CB 4.46Å; L137-A159 HydrophobicContact CD2-CB 3.48Å; L137-A159 VanDerWaalsContact CD2-CB 3.48Å; L137-T170 HydrophobicContact CB-CG2 4.45Å; L137-T170 HydrophobicContact CD2-CG2 4.3Å; L137-A174 HydrophobicContact CG-CB 4.31Å
138	R	91.8	Very high	89.7	Confident	141 Å²	141	47.3 Å²	47.3	53%	0.532	24%	0.236	S	C	.	.	H	α-helix	trans	-65.2	-31.8	179	-168.1	-176	68.7	127	5.1	112.5	A134 A136 S141 S142 T170	A134-R138 WeakPolarHBondContact O-CB 3.44Å; A134-R138 PolarHBondContact O-N 3.34Å; A136-R138 VanDerWaalsContact C-N 3.32Å; A136-R138 PolarHBondContact O-N 3.07Å; R138-S141 PolarHBondContact O-OG 3.35Å; R138-S142 PolarHBondContact O-N 3.21Å; R138-S142 PolarHBondContact O-OG 3.07Å; R138-T170 HydrophobicContact CB-CG2 4.07Å
139	V	91.1	Very high	89.7	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.012	20%	0.198	C	C	.	.	H	α-helix	trans	-81.5	-46.5	176.7	174.3	0	0	0	0	111.2	Y100 V104 F121 S135 A136 L137 S141 S142 I143	Y100-V139 HydrophobicContact CD2-CB 4.5Å; Y100-V139 HydrophobicContact CD2-CG2 3.61Å; Y100-V139 HydrophobicContact CE2-CG2 4.36Å; Y100-V139 HydrophobicContact CG-CG2 3.75Å; V104-V139 HydrophobicContact CG2-CB 4.32Å; V104-V139 HydrophobicContact CG2-CG1 3.9Å; V104-V139 HydrophobicContact CG2-CG2 4.06Å; F121-V139 HydrophobicContact CE1-CB 3.85Å; F121-V139 HydrophobicContact CE1-CG1 3.53Å; F121-V139 HydrophobicContact CE2-CG1 4.14Å; F121-V139 HydrophobicContact CZ-CB 4.16Å; F121-V139 HydrophobicContact CZ-CG1 3.32Å; S135-V139 WeakPolarHBondContact O-CG2 3.35Å; S135-V139 PolarHBondContact O-N 3.32Å; A136-V139 PolarHBondContact O-N 3.21Å; L137-V139 VanDerWaalsContact C-N 3.29Å; L137-V139 PolarHBondContact O-N 3.04Å; V139-S141 PolarHBondContact O-N 3.3Å; V139-S142 WeakPolarHBondContact O-CA 3.5Å; V139-S142 PolarHBondContact O-N 3.38Å; V139-I143 HydrophobicContact CG1-CD1 4.32Å; V139-I143 PolarHBondContact O-N 2.95Å
140	L	90.8	Very high	89.6	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-53	-43.6	174.7	-176.4	66.5	0	0	0	111.2	I118 F121 L125 A136 S142 I143 I148 A155	I118-L140 HydrophobicContact CG2-CD1 4.4Å; F121-L140 HydrophobicContact CB-CD1 4.43Å; L125-L140 HydrophobicContact CD1-CD2 4.09Å; A136-L140 WeakPolarHBondContact O-CB 3.45Å; A136-L140 PolarHBondContact O-N 2.92Å; L140-S142 VanDerWaalsContact C-N 3.27Å; L140-S142 PolarHBondContact O-N 3.35Å; L140-I143 PolarHBondContact O-N 3.11Å; L140-I148 HydrophobicContact CD1-CD1 4.26Å; L140-A155 HydrophobicContact CD2-CB 3.95Å
141	S	90.5	Very high	89.5	Confident	7 Å²	7	42.8 Å²	42.8	5%	0.049	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-3.7	175.6	59.1	0	0	0	0	115.8	L137 R138 V139 M152 K177	L137-S141 WeakPolarHBondContact O-CB 3.33Å; L137-S141 PolarHBondContact O-N 2.84Å; L137-S141 PolarHBondContact O-OG 3.44Å; R138-S141 PolarHBondContact O-OG 3.35Å; V139-S141 PolarHBondContact O-N 3.3Å; S141-M152 VanDerWaalsContact CA-SD 3.53Å; S141-K177 WeakPolarHBondContact O-CB 3.43Å; S141-K177 WeakPolarHBondContact O-CD 3.28Å
142	S	90.3	Very high	89.5	Confident	25 Å²	25	37.5 Å²	37.5	18%	0.175	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	2.2	174.1	-51.3	0	0	0	0	113.3	R138 V139 L140 K177	R138-S142 PolarHBondContact O-N 3.21Å; R138-S142 PolarHBondContact O-OG 3.07Å; V139-S142 WeakPolarHBondContact O-CA 3.5Å; V139-S142 PolarHBondContact O-N 3.38Å; L140-S142 VanDerWaalsContact C-N 3.27Å; L140-S142 PolarHBondContact O-N 3.35Å; S142-K177 PolarHBondContact OG-NZ 2.99Å
143	I	87.8	Confident	89.5	Confident	7 Å²	7	37.3 Å²	37.3	4%	0.036	19%	0.187	C	C	.	.			trans	-92.9	104.9	175.5	-65.6	165.7	0	0	0	107.5	A107 F121 V139 L140 V145 I148	A107-I143 HydrophobicContact CB-CG1 4.08Å; A107-I143 HydrophobicContact CB-CG2 4.16Å; F121-I143 HydrophobicContact CE2-CD1 3.93Å; V139-I143 HydrophobicContact CG1-CD1 4.32Å; V139-I143 PolarHBondContact O-N 2.95Å; L140-I143 PolarHBondContact O-N 3.11Å; I143-V145 HydrophobicContact CG2-CB 4.04Å; I143-V145 HydrophobicContact CG2-CG2 3.65Å; I143-V145 PolarHBondContact O-N 2.93Å; I143-I148 HydrophobicContact CB-CD1 3.95Å; I143-I148 HydrophobicContact CG2-CD1 3.99Å; I143-I148 VanDerWaalsContact O-CD1 3.32Å; I143-I148 WeakPolarHBondContact O-CD1 3.44Å
144	R	84.1	Confident	89.4	Confident	149 Å²	149	40.8 Å²	40.8	56%	0.562	21%	0.208	S	C	*	.			trans	-78.7	59.1	-179	-61	-170.6	-170.8	119.2	-22.8	112.8	E108 L181	E108-R144 HydrophobicContact CG-CB 4.43Å; E108-R144 WeakPolarHBondContact OE1-CB 3.35Å; E108-R144 WeakPolarHBondContact OE1-CD 3.34Å; E108-R144 WeakPolarHBondContact OE1-CG 3.48Å; E108-R144 IonicContact OE1-CZ 3.84Å; E108-R144 IonicContact OE1-NE 3.53Å; E108-R144 IonicContact OE1-NH1 2.8Å; E108-R144 PolarHBondContact OE1-NH1 2.91Å; E108-R144 IonicContact OE2-NH1 2.76Å; E108-R144 PolarHBondContact OE2-NH1 2.72Å; R144-L181 HydrophobicContact CB-CD1 4.06Å
145	V	86.1	Confident	89.4	Confident	2 Å²	2	41 Å²	41	1%	0.012	21%	0.21	C	C	.	.			trans	-114	106.7	177.5	176.3	0	0	0	0	108.9	Q111 L115 I143 I147 I148	Q111-V145 HydrophobicContact CB-CG2 4Å; Q111-V145 HydrophobicContact CG-CG2 3.91Å; L115-V145 HydrophobicContact CD2-CG1 4.12Å; I143-V145 HydrophobicContact CG2-CB 4.04Å; I143-V145 HydrophobicContact CG2-CG2 3.65Å; I143-V145 PolarHBondContact O-N 2.93Å; V145-I147 HydrophobicContact CG1-CB 4.29Å; V145-I147 PolarHBondContact O-N 2.77Å; V145-I148 HydrophobicContact CB-CG2 4.09Å; V145-I148 HydrophobicContact CG1-CG2 4.09Å; V145-I148 WeakPolarHBondContact O-CG1 3.41Å; V145-I148 PolarHBondContact O-N 3.45Å
146	P	84.1	Confident	89.5	Confident	81 Å²	81	39.7 Å²	39.7	53%	0.526	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-54.8	-31.8	-171.3	-30.2	36.2	0	0	0	115.2	I148 V149 L181	P146-I148 PolarHBondContact O-N 3.4Å; P146-V149 WeakPolarHBondContact O-CB 3.49Å; P146-V149 WeakPolarHBondContact O-CG2 3.19Å; P146-V149 PolarHBondContact O-N 3.4Å; P146-L181 HydrophobicContact CG-CD1 4.21Å
147	I	87.3	Confident	89.6	Confident	130 Å²	130	43 Å²	43	67%	0.667	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-55.7	-25.5	178.4	-57.4	173.5	0	0	0	112.3	V145	V145-I147 HydrophobicContact CG1-CB 4.29Å; V145-I147 PolarHBondContact O-N 2.77Å
148	I	88.1	Confident	89.5	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.01	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-86.3	-8.1	-176.9	89.6	-173.9	0	0	0	113.5	L115 I118 L140 I143 V145 P146 I151 M152	L115-I148 HydrophobicContact CD2-CG2 4.22Å; I118-I148 HydrophobicContact CD1-CB 4.23Å; I118-I148 HydrophobicContact CD1-CG2 3.38Å; I118-I148 HydrophobicContact CG1-CG2 4.41Å; L140-I148 HydrophobicContact CD1-CD1 4.26Å; I143-I148 HydrophobicContact CB-CD1 3.95Å; I143-I148 HydrophobicContact CG2-CD1 3.99Å; I143-I148 VanDerWaalsContact O-CD1 3.32Å; I143-I148 WeakPolarHBondContact O-CD1 3.44Å; V145-I148 HydrophobicContact CB-CG2 4.09Å; V145-I148 HydrophobicContact CG1-CG2 4.09Å; V145-I148 WeakPolarHBondContact O-CG1 3.41Å; V145-I148 PolarHBondContact O-N 3.45Å; P146-I148 PolarHBondContact O-N 3.4Å; I148-I151 WeakPolarHBondContact O-CB 3.44Å; I148-I151 PolarHBondContact O-N 3.35Å; I148-M152 HydrophobicContact CG1-CE 4.44Å; I148-M152 PolarHBondContact O-N 2.99Å
149	V	88.9	Confident	89.5	Confident	6 Å²	6	40.5 Å²	40.5	4%	0.036	21%	0.211	C	C	.	.	H	α-helix	trans	-52.7	-48.1	-172.1	160.5	0	0	0	0	113.7	P146 I151 M152 M153 L178 L181 D182 Q185	P146-V149 WeakPolarHBondContact O-CB 3.49Å; P146-V149 WeakPolarHBondContact O-CG2 3.19Å; P146-V149 PolarHBondContact O-N 3.4Å; V149-I151 VanDerWaalsContact C-N 3.3Å; V149-I151 PolarHBondContact O-N 3.09Å; V149-M152 HydrophobicContact CG2-CE 4.4Å; V149-M152 PolarHBondContact O-N 2.86Å; V149-M152 VanDerWaalsContact O-N 3.16Å; V149-M153 PolarHBondContact O-N 3.42Å; V149-L178 HydrophobicContact CB-CD1 4.33Å; V149-L178 HydrophobicContact CG1-CD1 3.72Å; V149-L178 HydrophobicContact CG2-CD1 4.06Å; V149-L181 HydrophobicContact CG2-CD2 3.75Å; V149-L181 HydrophobicContact CG2-CG 4.07Å; V149-D182 HydrophobicContact CG1-CB 4.04Å; V149-D182 WeakPolarHBondContact CG1-OD2 3.35Å; V149-D182 HydrophobicContact CG2-CB 3.99Å; V149-Q185 HydrophobicContact CG1-CG 3.9Å
150	P	90.1	Very high	89.6	Confident	93 Å²	93	40.7 Å²	40.7	60%	0.604	21%	0.212	S	C	*	.	H	α-helix	trans	-62.8	-35.5	178.2	-24.1	35.2	0	0	0	113.3	L154	P150-L154 PolarHBondContact O-N 2.93Å; P150-L154 VanDerWaalsContact O-N 3.11Å
151	I	89.4	Confident	89.6	Confident	56 Å²	56	43.7 Å²	43.7	29%	0.287	23%	0.234	S	C	.	.	H	α-helix	trans	-68.9	-41.1	176.4	-63.3	170.8	0	0	0	110.3	I118 Q122 I148 V149 A155	I118-I151 HydrophobicContact CG2-CD1 4.12Å; I118-I151 HydrophobicContact CG2-CG2 4.14Å; Q122-I151 HydrophobicContact CG-CG2 4.11Å; Q122-I151 VanDerWaalsContact NE2-CG2 3.32Å; I148-I151 WeakPolarHBondContact O-CB 3.44Å; I148-I151 PolarHBondContact O-N 3.35Å; V149-I151 VanDerWaalsContact C-N 3.3Å; V149-I151 PolarHBondContact O-N 3.09Å; I151-A155 WeakPolarHBondContact O-CB 3.43Å; I151-A155 PolarHBondContact O-N 3.25Å
152	M	90.4	Very high	89.7	Confident	2 Å²	2	44.4 Å²	44.4	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-65.7	-42.6	176.2	171.8	160.8	48.1	0	0	111.9	S141 I148 V149 A155 I156 L178 L181	S141-M152 VanDerWaalsContact CA-SD 3.53Å; I148-M152 HydrophobicContact CG1-CE 4.44Å; I148-M152 PolarHBondContact O-N 2.99Å; V149-M152 HydrophobicContact CG2-CE 4.4Å; V149-M152 PolarHBondContact O-N 2.86Å; V149-M152 VanDerWaalsContact O-N 3.16Å; M152-A155 PolarHBondContact O-N 3.45Å; M152-I156 HydrophobicContact CG-CD1 3.76Å; M152-I156 HydrophobicContact CG-CG1 4.46Å; M152-I156 WeakPolarHBondContact O-CB 3.48Å; M152-I156 VanDerWaalsContact O-CG1 3.31Å; M152-I156 WeakPolarHBondContact O-CG1 3.34Å; M152-I156 PolarHBondContact O-N 3.03Å; M152-L178 HydrophobicContact CE-CB 4.07Å; M152-L178 HydrophobicContact CE-CD1 3.9Å; M152-L178 HydrophobicContact CG-CB 4.36Å; M152-L178 HydrophobicContact CG-CD2 4.36Å; M152-L178 HydrophobicContact SD-CB 4.06Å; M152-L181 HydrophobicContact CE-CD2 3.75Å
153	M	90.1	Very high	89.7	Confident	13 Å²	13	51 Å²	51	6%	0.064	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-46.2	175.9	-174.9	71.6	-94.5	0	0	111.1	V149 A155 I156 K157 L178 Q185 H188 L189 V192	V149-M153 PolarHBondContact O-N 3.42Å; M153-A155 PolarHBondContact O-N 2.97Å; M153-I156 HydrophobicContact CE-CB 4.15Å; M153-I156 HydrophobicContact CE-CG2 3.87Å; M153-I156 PolarHBondContact O-N 2.85Å; M153-K157 HydrophobicContact CE-CD 4.44Å; M153-K157 HydrophobicContact CE-CG 3.77Å; M153-K157 WeakPolarHBondContact O-CG 3.39Å; M153-K157 PolarHBondContact O-N 2.85Å; M153-L178 HydrophobicContact CB-CD2 4.09Å; M153-L178 HydrophobicContact CE-CD2 4.32Å; M153-L178 HydrophobicContact SD-CD2 3.74Å; M153-Q185 HydrophobicContact SD-CB 4.42Å; M153-H188 HydrophobicContact CG-CB 4.4Å; M153-H188 HydrophobicContact SD-CB 3.69Å; M153-L189 HydrophobicContact CE-CD2 3.84Å; M153-L189 HydrophobicContact SD-CD2 3.97Å; M153-L189 HydrophobicContact SD-CG 4.35Å; M153-V192 HydrophobicContact CE-CG2 4.02Å
154	L	90.4	Very high	89.9	Confident	110 Å²	110	51 Å²	51	58%	0.576	27%	0.27	S	S	*	.	H	α-helix	trans	-59.9	-46.3	175.3	-173.1	71.8	0	0	0	111.7	P150 I156 K157 E158	P150-L154 PolarHBondContact O-N 2.93Å; P150-L154 VanDerWaalsContact O-N 3.11Å; L154-I156 VanDerWaalsContact C-N 3.28Å; L154-I156 PolarHBondContact O-N 2.86Å; L154-K157 PolarHBondContact O-N 2.82Å; L154-E158 PolarHBondContact O-N 2.97Å
155	A	91.7	Very high	90.3	Very high	6 Å²	6	45.8 Å²	45.8	5%	0.05	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-36.2	177	0	0	0	0	0	112.9	L125 L137 L140 I151 M152 M153 A159	L125-A155 HydrophobicContact CD1-CB 3.53Å; L137-A155 HydrophobicContact CD1-CB 4.15Å; L140-A155 HydrophobicContact CD2-CB 3.95Å; I151-A155 WeakPolarHBondContact O-CB 3.43Å; I151-A155 PolarHBondContact O-N 3.25Å; M152-A155 PolarHBondContact O-N 3.45Å; M153-A155 PolarHBondContact O-N 2.97Å; A155-A159 WeakPolarHBondContact O-CB 3.26Å; A155-A159 PolarHBondContact O-N 2.86Å
156	I	93	Very high	90.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.9	-42.5	175.6	-74	168	0	0	0	111.1	L137 M152 M153 L154 A159 A160 S171 A174 I175 L178 V192	L137-I156 HydrophobicContact CD1-CG1 4.33Å; M152-I156 HydrophobicContact CG-CD1 3.76Å; M152-I156 HydrophobicContact CG-CG1 4.46Å; M152-I156 WeakPolarHBondContact O-CB 3.48Å; M152-I156 VanDerWaalsContact O-CG1 3.31Å; M152-I156 WeakPolarHBondContact O-CG1 3.34Å; M152-I156 PolarHBondContact O-N 3.03Å; M153-I156 HydrophobicContact CE-CB 4.15Å; M153-I156 HydrophobicContact CE-CG2 3.87Å; M153-I156 PolarHBondContact O-N 2.85Å; L154-I156 VanDerWaalsContact C-N 3.28Å; L154-I156 PolarHBondContact O-N 2.86Å; I156-A159 PolarHBondContact O-N 2.87Å; I156-A160 VanDerWaalsContact O-CB 3.28Å; I156-A160 WeakPolarHBondContact O-CB 3.34Å; I156-A160 PolarHBondContact O-N 2.76Å; I156-S171 PolarHBondContact O-OG 3.5Å; I156-S171 VanDerWaalsContact O-OG 3.08Å; I156-A174 HydrophobicContact CD1-CB 3.8Å; I156-A174 HydrophobicContact CG1-CB 3.86Å; I156-I175 HydrophobicContact CG2-CD1 4.43Å; I156-I175 HydrophobicContact CG2-CG1 3.82Å; I156-L178 HydrophobicContact CD1-CB 4.11Å; I156-L178 HydrophobicContact CD1-CD2 3.8Å; I156-V192 HydrophobicContact CG2-CG1 4.1Å
157	K	92.6	Very high	91.1	Very high	69 Å²	69	47.3 Å²	47.3	30%	0.3	25%	0.252	S	S	.	.	H	α-helix	trans	-64.9	-39.5	175.4	-63	-157.6	-177.9	-174.3	0	112.2	M153 L154 S161 E191 V192	M153-K157 HydrophobicContact CE-CD 4.44Å; M153-K157 HydrophobicContact CE-CG 3.77Å; M153-K157 WeakPolarHBondContact O-CG 3.39Å; M153-K157 PolarHBondContact O-N 2.85Å; L154-K157 PolarHBondContact O-N 2.82Å; K157-S161 PolarHBondContact O-OG 3.43Å; K157-E191 IonicContact NZ-OE2 3.73Å; K157-E191 PolarHBondContact NZ-OE2 3.3Å; K157-V192 HydrophobicContact CD-CG2 4.39Å; K157-V192 HydrophobicContact CG-CG2 3.79Å
158	E	91.4	Very high	91.5	Very high	83 Å²	83	42.9 Å²	42.9	39%	0.388	23%	0.226	S	C	.	.	H	α-helix	trans	-62.3	-54.6	170.4	-72.9	-168.3	164.6	0	0	111	K126 L154 A160 S161	K126-E158 WeakPolarHBondContact CE-OE2 3.34Å; K126-E158 VanDerWaalsContact NZ-CD 3.27Å; K126-E158 IonicContact NZ-OE1 2.68Å; K126-E158 PolarHBondContact NZ-OE1 2.96Å; K126-E158 IonicContact NZ-OE2 2.54Å; K126-E158 PolarHBondContact NZ-OE2 3.25Å; L154-E158 PolarHBondContact O-N 2.97Å; E158-A160 VanDerWaalsContact C-N 3.33Å; E158-A160 PolarHBondContact O-N 2.93Å; E158-S161 WeakPolarHBondContact O-CA 3.49Å; E158-S161 VanDerWaalsContact O-CB 3.26Å; E158-S161 WeakPolarHBondContact O-CB 3.34Å; E158-S161 PolarHBondContact O-N 2.92Å
159	A	92.2	Very high	91.7	Very high	8 Å²	8	44.2 Å²	44.2	7%	0.066	23%	0.232	C	C	.	.	H	α-helix	trans	-67.3	-26.6	-174.2	0	0	0	0	0	114.7	L137 A155 I156 S161 D162 V167	L137-A159 HydrophobicContact CD1-CB 4.46Å; L137-A159 HydrophobicContact CD2-CB 3.48Å; L137-A159 VanDerWaalsContact CD2-CB 3.48Å; A155-A159 WeakPolarHBondContact O-CB 3.26Å; A155-A159 PolarHBondContact O-N 2.86Å; I156-A159 PolarHBondContact O-N 2.87Å; A159-S161 PolarHBondContact O-N 3.35Å; A159-D162 WeakPolarHBondContact O-CB 3.44Å; A159-D162 PolarHBondContact O-N 3.07Å; A159-V167 HydrophobicContact CB-CG1 3.99Å
160	A	91.9	Very high	92	Very high	5 Å²	5	44.7 Å²	44.7	4%	0.041	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-12.5	170.6	0	0	0	0	0	113.1	I156 E158 R168 V192 L196	I156-A160 VanDerWaalsContact O-CB 3.28Å; I156-A160 WeakPolarHBondContact O-CB 3.34Å; I156-A160 PolarHBondContact O-N 2.76Å; E158-A160 VanDerWaalsContact C-N 3.33Å; E158-A160 PolarHBondContact O-N 2.93Å; A160-R168 WeakPolarHBondContact O-CD 3.47Å; A160-V192 HydrophobicContact CB-CG1 3.53Å; A160-L196 HydrophobicContact CB-CD1 4.15Å; A160-L196 HydrophobicContact CB-CD2 3.97Å; A160-L196 HydrophobicContact CB-CG 4.09Å
161	S	91.1	Very high	92.2	Very high	64 Å²	64	40.3 Å²	40.3	45%	0.448	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	1	177.9	-43.8	0	0	0	0	113.2	K157 E158 A159 K195	K157-S161 PolarHBondContact O-OG 3.43Å; E158-S161 WeakPolarHBondContact O-CA 3.49Å; E158-S161 VanDerWaalsContact O-CB 3.26Å; E158-S161 WeakPolarHBondContact O-CB 3.34Å; E158-S161 PolarHBondContact O-N 2.92Å; A159-S161 PolarHBondContact O-N 3.35Å; S161-K195 PolarHBondContact OG-NZ 2.98Å
162	D	93	Very high	92.4	Very high	22 Å²	22	37.6 Å²	37.6	12%	0.118	19%	0.193	C	C	.	.			trans	-64.6	143.2	-176.1	-163.5	-65	0	0	0	111.9	R133 A159 S164 V167 R168	R133-D162 IonicContact CZ-OD1 3.79Å; R133-D162 IonicContact CZ-OD2 3.97Å; R133-D162 VanDerWaalsContact CZ-OD2 3.29Å; R133-D162 IonicContact NE-OD1 3.91Å; R133-D162 IonicContact NE-OD2 3.41Å; R133-D162 PolarHBondContact NE-OD2 3.4Å; R133-D162 IonicContact NH2-OD1 2.83Å; R133-D162 PolarHBondContact NH2-OD1 2.87Å; R133-D162 IonicContact NH2-OD2 2.57Å; R133-D162 PolarHBondContact NH2-OD2 2.79Å; R133-D162 VanDerWaalsContact NH2-OD2 3.08Å; A159-D162 WeakPolarHBondContact O-CB 3.44Å; A159-D162 PolarHBondContact O-N 3.07Å; D162-S164 PolarHBondContact O-N 3.36Å; D162-S164 WeakPolarHBondContact OD1-CB 3.47Å; D162-S164 PolarHBondContact OD1-N 2.91Å; D162-V167 HydrophobicContact CB-CB 3.76Å; D162-V167 HydrophobicContact CB-CG1 3.69Å; D162-V167 WeakPolarHBondContact OD2-CG1 3.47Å; D162-R168 HydrophobicContact CB-CG 4.35Å; D162-R168 VanDerWaalsContact O-CD 3.3Å; D162-R168 WeakPolarHBondContact O-CD 3.03Å; D162-R168 WeakPolarHBondContact O-CG 3.46Å; D162-R168 PolarHBondContact O-NH1 3.3Å
163	L	89.3	Confident	92.5	Very high	163 Å²	163	40.9 Å²	40.9	85%	0.853	21%	0.208	S	C	*	.	S	Bend	trans	-59.4	-33.8	176.6	-70.5	75.1	0	0	0	111.7	P165 R168	L163-P165 WeakPolarHBondContact O-CD 3.24Å; L163-R168 VanDerWaalsContact C-NH1 3.35Å; L163-R168 PolarHBondContact O-NH1 2.93Å
164	S	93.2	Very high	92.6	Very high	8 Å²	8	40.2 Å²	40.2	6%	0.056	21%	0.205	C	C	.	.			trans	-79.7	122.4	-178.9	179.5	0	0	0	0	112.7	Q130 D162 Y166 V167 R168	Q130-S164 PolarHBondContact OE1-OG 2.65Å; D162-S164 PolarHBondContact O-N 3.36Å; D162-S164 WeakPolarHBondContact OD1-CB 3.47Å; D162-S164 PolarHBondContact OD1-N 2.91Å; S164-Y166 PolarHBondContact O-N 2.72Å; S164-Y166 VanDerWaalsContact O-N 3.16Å; S164-Y166 PolarHBondContact OG-N 2.92Å; S164-V167 PolarHBondContact O-N 3.02Å; S164-V167 VanDerWaalsContact O-N 3.14Å; S164-R168 PolarHBondContact O-N 2.95Å; S164-R168 VanDerWaalsContact O-N 3.17Å
165	P	92.4	Very high	92.7	Very high	39 Å²	39	35 Å²	35	25%	0.253	18%	0.177	S	C	.	.	H	α-helix	trans	-56.9	-28.4	169.8	-24	34.1	0	0	0	113.4	L163 R168 K169 S201 L203 V204	L163-P165 WeakPolarHBondContact O-CD 3.24Å; P165-R168 PolarHBondContact O-N 3.23Å; P165-K169 VanDerWaalsContact O-CB 3.25Å; P165-K169 WeakPolarHBondContact O-CB 3.25Å; P165-K169 PolarHBondContact O-N 3.31Å; P165-S201 WeakPolarHBondContact CB-OG 3.38Å; P165-L203 HydrophobicContact CB-CD1 4.41Å; P165-V204 HydrophobicContact CB-CG2 3.94Å; P165-V204 VanDerWaalsContact O-CG2 3.32Å; P165-V204 WeakPolarHBondContact O-CG2 3.32Å
166	Y	93.3	Very high	92.7	Very high	113 Å²	113	36.4 Å²	36.4	44%	0.443	18%	0.183	S	C	.	.	H	α-helix	trans	-68.4	-36.4	179.1	-174.2	-105	0	0	0	112.4	F131 A134 S164 T170	F131-Y166 HydrophobicContact CD1-CD1 4.01Å; F131-Y166 AromaticContact CD1-CE1 3.69Å; F131-Y166 HydrophobicContact CD1-CE1 3.69Å; F131-Y166 HydrophobicContact CE1-CD1 4.26Å; F131-Y166 HydrophobicContact CE1-CE1 4.17Å; A134-Y166 HydrophobicContact CB-CD1 3.65Å; A134-Y166 HydrophobicContact CB-CE1 3.52Å; S164-Y166 PolarHBondContact O-N 2.72Å; S164-Y166 VanDerWaalsContact O-N 3.16Å; S164-Y166 PolarHBondContact OG-N 2.92Å; Y166-T170 PolarHBondContact O-N 3.44Å; Y166-T170 VanDerWaalsContact O-N 3.14Å; Y166-T170 PolarHBondContact O-OG1 3.15Å
167	V	94.4	Very high	92.6	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.012	20%	0.197	C	C	.	.	H	α-helix	trans	-72.6	-43.4	174.5	-178.9	0	0	0	0	110.1	Q130 R133 A134 A159 D162 S164 K169 T170 S171	Q130-V167 HydrophobicContact CB-CG2 4.1Å; Q130-V167 WeakPolarHBondContact O-CG2 3.24Å; R133-V167 HydrophobicContact CB-CG2 4.14Å; A134-V167 HydrophobicContact CB-CG2 4.22Å; A159-V167 HydrophobicContact CB-CG1 3.99Å; D162-V167 HydrophobicContact CB-CB 3.76Å; D162-V167 HydrophobicContact CB-CG1 3.69Å; D162-V167 WeakPolarHBondContact OD2-CG1 3.47Å; S164-V167 PolarHBondContact O-N 3.02Å; S164-V167 VanDerWaalsContact O-N 3.14Å; V167-K169 PolarHBondContact O-N 3.29Å; V167-T170 CarbonylContact O-C 3.58Å; V167-T170 WeakPolarHBondContact O-CA 3.28Å; V167-T170 WeakPolarHBondContact O-CB 3.33Å; V167-T170 PolarHBondContact O-N 2.94Å; V167-S171 PolarHBondContact O-N 3.04Å
168	R	94.5	Very high	92.5	Very high	36 Å²	36	36.4 Å²	36.4	14%	0.136	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-42.7	176.1	-61.8	-163.7	-55.8	-90.4	8.9	112.8	A160 D162 L163 S164 P165 T170 S171 A172 L196 D199 V204	A160-R168 WeakPolarHBondContact O-CD 3.47Å; D162-R168 HydrophobicContact CB-CG 4.35Å; D162-R168 VanDerWaalsContact O-CD 3.3Å; D162-R168 WeakPolarHBondContact O-CD 3.03Å; D162-R168 WeakPolarHBondContact O-CG 3.46Å; D162-R168 PolarHBondContact O-NH1 3.3Å; L163-R168 VanDerWaalsContact C-NH1 3.35Å; L163-R168 PolarHBondContact O-NH1 2.93Å; S164-R168 PolarHBondContact O-N 2.95Å; S164-R168 VanDerWaalsContact O-N 3.17Å; P165-R168 PolarHBondContact O-N 3.23Å; R168-T170 VanDerWaalsContact C-N 3.29Å; R168-T170 PolarHBondContact O-N 2.96Å; R168-S171 WeakPolarHBondContact O-CB 3.45Å; R168-S171 PolarHBondContact O-N 3.34Å; R168-S171 VanDerWaalsContact O-N 3.11Å; R168-A172 PolarHBondContact O-N 2.89Å; R168-L196 HydrophobicContact CB-CD2 4.07Å; R168-D199 IonicContact CZ-OD1 3.6Å; R168-D199 IonicContact CZ-OD2 3.57Å; R168-D199 IonicContact NE-OD2 3.64Å; R168-D199 PolarHBondContact NE-OD2 2.9Å; R168-D199 VanDerWaalsContact NH2-CG 3.31Å; R168-D199 IonicContact NH2-OD1 3.04Å; R168-D199 PolarHBondContact NH2-OD1 3.33Å; R168-D199 IonicContact NH2-OD2 3.29Å; R168-D199 PolarHBondContact NH2-OD2 3.28Å; R168-V204 HydrophobicContact CB-CG1 4.39Å; R168-V204 HydrophobicContact CB-CG2 4.07Å
169	K	93.4	Very high	92.4	Very high	30 Å²	30	35.1 Å²	35.1	13%	0.13	18%	0.175	C	C	.	.	H	α-helix	trans	-56.2	-42.7	170.6	-173.2	-165.5	-177.8	92	0	111.7	P165 V167 S171 A172 H173 L203 V204 S207 E238	P165-K169 VanDerWaalsContact O-CB 3.25Å; P165-K169 WeakPolarHBondContact O-CB 3.25Å; P165-K169 PolarHBondContact O-N 3.31Å; V167-K169 PolarHBondContact O-N 3.29Å; K169-S171 VanDerWaalsContact C-N 3.34Å; K169-A172 PolarHBondContact O-N 3.36Å; K169-H173 PolarHBondContact O-CD2 3.35Å; K169-H173 PolarHBondContact O-N 3.34Å; K169-L203 WeakPolarHBondContact CD-O 3.43Å; K169-L203 WeakPolarHBondContact CG-O 3.3Å; K169-L203 PolarHBondContact NZ-O 2.92Å; K169-V204 HydrophobicContact CB-CG2 4.29Å; K169-S207 WeakPolarHBondContact CE-OG 3.48Å; K169-S207 WeakPolarHBondContact CG-OG 3.34Å; K169-E238 IonicContact NZ-OE1 2.75Å; K169-E238 PolarHBondContact NZ-OE1 3.26Å; K169-E238 IonicContact NZ-OE2 3.26Å; K169-E238 PolarHBondContact NZ-OE2 3.21Å
170	T	93.9	Very high	92.3	Very high	17 Å²	17	38.9 Å²	38.9	10%	0.104	20%	0.2	C	C	.	.	H	α-helix	trans	-69.2	-33.1	177.6	-53.9	0	0	0	0	111.9	A134 L137 R138 Y166 V167 R168 H173 A174	A134-T170 HydrophobicContact CB-CG2 4.3Å; A134-T170 WeakPolarHBondContact O-CG2 3.36Å; L137-T170 HydrophobicContact CB-CG2 4.45Å; L137-T170 HydrophobicContact CD2-CG2 4.3Å; R138-T170 HydrophobicContact CB-CG2 4.07Å; Y166-T170 PolarHBondContact O-N 3.44Å; Y166-T170 VanDerWaalsContact O-N 3.14Å; Y166-T170 PolarHBondContact O-OG1 3.15Å; V167-T170 CarbonylContact O-C 3.58Å; V167-T170 WeakPolarHBondContact O-CA 3.28Å; V167-T170 WeakPolarHBondContact O-CB 3.33Å; V167-T170 PolarHBondContact O-N 2.94Å; R168-T170 VanDerWaalsContact C-N 3.29Å; R168-T170 PolarHBondContact O-N 2.96Å; T170-H173 PolarHBondContact O-N 3.09Å; T170-A174 PolarHBondContact O-N 2.71Å
171	S	94.7	Very high	92.1	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-43.3	173.3	-158.1	0	0	0	0	111.7	I156 V167 R168 K169 H173 A174 I175	I156-S171 PolarHBondContact O-OG 3.5Å; I156-S171 VanDerWaalsContact O-OG 3.08Å; V167-S171 PolarHBondContact O-N 3.04Å; R168-S171 WeakPolarHBondContact O-CB 3.45Å; R168-S171 PolarHBondContact O-N 3.34Å; R168-S171 VanDerWaalsContact O-N 3.11Å; K169-S171 VanDerWaalsContact C-N 3.34Å; S171-H173 VanDerWaalsContact C-N 3.32Å; S171-H173 PolarHBondContact O-N 3.06Å; S171-A174 WeakPolarHBondContact O-CA 3.23Å; S171-A174 WeakPolarHBondContact O-CB 3.49Å; S171-A174 PolarHBondContact O-N 3.4Å; S171-I175 WeakPolarHBondContact O-CG1 3.42Å; S171-I175 PolarHBondContact O-N 2.86Å; S171-I175 VanDerWaalsContact O-N 3.14Å
172	A	93.3	Very high	91.9	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-57	-42.4	174	0	0	0	0	0	112.8	R168 K169 A174 I175 L196 V208 A211	R168-A172 PolarHBondContact O-N 2.89Å; K169-A172 PolarHBondContact O-N 3.36Å; A172-A174 VanDerWaalsContact C-N 3.29Å; A172-A174 PolarHBondContact O-N 3.5Å; A172-I175 WeakPolarHBondContact O-CB 3.41Å; A172-I175 PolarHBondContact O-N 3.33Å; A172-L196 HydrophobicContact CB-CD1 4.32Å; A172-V208 HydrophobicContact CB-CG2 3.85Å; A172-A211 WeakPolarHBondContact O-CB 3.37Å
173	H	92.4	Very high	91.6	Very high	70 Å²	70	40.9 Å²	40.9	32%	0.324	21%	0.212	S	C	.	.	H	α-helix	trans	-72.7	-15.9	174	-73.4	-60.2	0	0	0	114.8	K169 T170 S171 Q176 S207	K169-H173 PolarHBondContact O-CD2 3.35Å; K169-H173 PolarHBondContact O-N 3.34Å; T170-H173 PolarHBondContact O-N 3.09Å; S171-H173 VanDerWaalsContact C-N 3.32Å; S171-H173 PolarHBondContact O-N 3.06Å; H173-Q176 PolarHBondContact ND1-OE1 3Å; H173-S207 PolarHBondContact CD2-OG 2.96Å; H173-S207 WeakPolarHBondContact NE2-CB 2.96Å; H173-S207 PolarHBondContact NE2-OG 2.64Å
174	A	93.2	Very high	91.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-80.8	-30	173.8	0	0	0	0	0	111.9	L137 I156 T170 S171 A172 Q176 K177 L178	L137-A174 HydrophobicContact CG-CB 4.31Å; I156-A174 HydrophobicContact CD1-CB 3.8Å; I156-A174 HydrophobicContact CG1-CB 3.86Å; T170-A174 PolarHBondContact O-N 2.71Å; S171-A174 WeakPolarHBondContact O-CA 3.23Å; S171-A174 WeakPolarHBondContact O-CB 3.49Å; S171-A174 PolarHBondContact O-N 3.4Å; A172-A174 VanDerWaalsContact C-N 3.29Å; A172-A174 PolarHBondContact O-N 3.5Å; A174-Q176 PolarHBondContact O-N 3.48Å; A174-K177 PolarHBondContact O-N 2.94Å; A174-L178 PolarHBondContact O-N 2.71Å
175	I	92.7	Very high	91	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-56.9	-46.9	176.6	-68.7	170.9	0	0	0	111.4	I156 S171 A172 K177 L178 Y179 L189 V192 I193 L196 A211 V215	I156-I175 HydrophobicContact CG2-CD1 4.43Å; I156-I175 HydrophobicContact CG2-CG1 3.82Å; S171-I175 WeakPolarHBondContact O-CG1 3.42Å; S171-I175 PolarHBondContact O-N 2.86Å; S171-I175 VanDerWaalsContact O-N 3.14Å; A172-I175 WeakPolarHBondContact O-CB 3.41Å; A172-I175 PolarHBondContact O-N 3.33Å; I175-K177 VanDerWaalsContact C-N 3.28Å; I175-K177 PolarHBondContact O-N 3.18Å; I175-L178 PolarHBondContact O-N 3.46Å; I175-Y179 PolarHBondContact O-N 2.87Å; I175-L189 HydrophobicContact CB-CD2 4.16Å; I175-L189 HydrophobicContact CG1-CD2 4Å; I175-L189 HydrophobicContact CG2-CB 4.17Å; I175-L189 HydrophobicContact CG2-CD1 4.3Å; I175-L189 HydrophobicContact CG2-CD2 3.75Å; I175-L189 HydrophobicContact CG2-CG 4.29Å; I175-V192 HydrophobicContact CD1-CB 4.19Å; I175-V192 HydrophobicContact CD1-CG1 3.77Å; I175-I193 HydrophobicContact CD1-CG1 4.03Å; I175-I193 HydrophobicContact CG2-CD1 4.16Å; I175-I193 HydrophobicContact CG2-CG1 4.39Å; I175-L196 HydrophobicContact CD1-CD1 4.22Å; I175-A211 HydrophobicContact CB-CB 4.41Å; I175-A211 HydrophobicContact CG2-CB 4.33Å; I175-V215 HydrophobicContact CG2-CG2 3.89Å
176	Q	90.4	Very high	90.7	Very high	35 Å²	35	43 Å²	43	16%	0.164	22%	0.218	C	C	.	.	H	α-helix	trans	-53.9	-44.3	176.7	-68.2	159.8	-12.4	0	0	112.2	H173 A174 Y179 S180 V210 A211 E214	H173-Q176 PolarHBondContact ND1-OE1 3Å; A174-Q176 PolarHBondContact O-N 3.48Å; Q176-Y179 PolarHBondContact O-N 2.93Å; Q176-S180 PolarHBondContact O-N 3.18Å; Q176-V210 PolarHBondContact NE2-O 3.12Å; Q176-A211 HydrophobicContact CG-CB 4.3Å; Q176-E214 HydrophobicContact CG-CB 4.29Å; Q176-E214 HydrophobicContact CG-CG 4.42Å
177	K	90.3	Very high	90.4	Very high	69 Å²	69	45 Å²	45	30%	0.3	23%	0.231	S	C	.	.	H	α-helix	trans	-74.7	-37.9	-176.6	-59	-175.6	-174.1	176	0	112.6	S141 S142 A174 I175 S180 L181	S141-K177 WeakPolarHBondContact O-CB 3.43Å; S141-K177 WeakPolarHBondContact O-CD 3.28Å; S142-K177 PolarHBondContact OG-NZ 2.99Å; A174-K177 PolarHBondContact O-N 2.94Å; I175-K177 VanDerWaalsContact C-N 3.28Å; I175-K177 PolarHBondContact O-N 3.18Å; K177-S180 WeakPolarHBondContact CA-OG 3.46Å; K177-S180 PolarHBondContact O-N 3.04Å; K177-S180 PolarHBondContact O-OG 3.41Å; K177-L181 PolarHBondContact O-N 2.87Å
178	L	90.8	Very high	90	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-47.9	171.6	168.3	53.7	0	0	0	110.1	V149 M152 M153 I156 A174 I175 S180 L181 D182 Q185 L189	V149-L178 HydrophobicContact CB-CD1 4.33Å; V149-L178 HydrophobicContact CG1-CD1 3.72Å; V149-L178 HydrophobicContact CG2-CD1 4.06Å; M152-L178 HydrophobicContact CE-CB 4.07Å; M152-L178 HydrophobicContact CE-CD1 3.9Å; M152-L178 HydrophobicContact CG-CB 4.36Å; M152-L178 HydrophobicContact CG-CD2 4.36Å; M152-L178 HydrophobicContact SD-CB 4.06Å; M153-L178 HydrophobicContact CB-CD2 4.09Å; M153-L178 HydrophobicContact CE-CD2 4.32Å; M153-L178 HydrophobicContact SD-CD2 3.74Å; I156-L178 HydrophobicContact CD1-CB 4.11Å; I156-L178 HydrophobicContact CD1-CD2 3.8Å; A174-L178 PolarHBondContact O-N 2.71Å; I175-L178 PolarHBondContact O-N 3.46Å; L178-S180 VanDerWaalsContact C-N 3.3Å; L178-S180 PolarHBondContact O-N 2.94Å; L178-L181 PolarHBondContact O-N 3.44Å; L178-D182 PolarHBondContact O-N 3.07Å; L178-Q185 HydrophobicContact CD1-CG 4.34Å; L178-L189 HydrophobicContact CD2-CD2 3.62Å; L178-L189 HydrophobicContact CD2-CG 4.41Å; L178-L189 HydrophobicContact CG-CD1 4.32Å; L178-L189 HydrophobicContact CG-CD2 4.17Å
179	Y	90.1	Very high	89.8	Confident	57 Å²	57	47.2 Å²	47.2	22%	0.224	24%	0.242	C	C	.	.	H	α-helix	trans	-60	-36.9	176	-174	-119.3	0	0	0	113.2	I175 Q176 L181 D182 A183 K186 L189 E214 V215	I175-Y179 PolarHBondContact O-N 2.87Å; Q176-Y179 PolarHBondContact O-N 2.93Å; Y179-L181 PolarHBondContact O-N 2.94Å; Y179-D182 CarbonylContact O-C 3.39Å; Y179-A183 HydrophobicContact CE2-CB 4.21Å; Y179-K186 HydrophobicContact CE2-CB 4.28Å; Y179-K186 HydrophobicContact CE2-CD 4.15Å; Y179-K186 HydrophobicContact CE2-CG 4.32Å; Y179-L189 HydrophobicContact CD2-CD1 4.32Å; Y179-E214 HydrophobicContact CD1-CG 4.36Å; Y179-E214 WeakPolarHBondContact CE1-O 3.37Å; Y179-V215 HydrophobicContact CD1-CB 4.42Å; Y179-V215 HydrophobicContact CD1-CG2 3.89Å; Y179-V215 HydrophobicContact CD2-CG1 4.15Å; Y179-V215 HydrophobicContact CD2-CG2 4.42Å; Y179-V215 HydrophobicContact CE2-CG1 4.25Å; Y179-V215 HydrophobicContact CG-CB 4.48Å; Y179-V215 HydrophobicContact CG-CG1 4.37Å; Y179-V215 HydrophobicContact CG-CG2 3.83Å
180	S	89.1	Confident	89.5	Confident	86 Å²	86	47.2 Å²	47.2	60%	0.601	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-7	174.1	75.3	0	0	0	0	115.1	Q176 K177 L178	Q176-S180 PolarHBondContact O-N 3.18Å; K177-S180 WeakPolarHBondContact CA-OG 3.46Å; K177-S180 PolarHBondContact O-N 3.04Å; K177-S180 PolarHBondContact O-OG 3.41Å; L178-S180 VanDerWaalsContact C-N 3.3Å; L178-S180 PolarHBondContact O-N 2.94Å
181	L	87.8	Confident	89.3	Confident	43 Å²	43	51.6 Å²	51.6	23%	0.225	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-37.1	178.5	-177.5	64.6	0	0	0	112.1	R144 P146 V149 M152 K177 L178 Y179	R144-L181 HydrophobicContact CB-CD1 4.06Å; P146-L181 HydrophobicContact CG-CD1 4.21Å; V149-L181 HydrophobicContact CG2-CD2 3.75Å; V149-L181 HydrophobicContact CG2-CG 4.07Å; M152-L181 HydrophobicContact CE-CD2 3.75Å; K177-L181 PolarHBondContact O-N 2.87Å; L178-L181 PolarHBondContact O-N 3.44Å; Y179-L181 PolarHBondContact O-N 2.94Å
182	D	87.8	Confident	89.1	Confident	37 Å²	37	51.9 Å²	51.9	20%	0.198	27%	0.265	C	S	.	.			trans	-145	114.3	174.7	179	10.2	0	0	0	109.6	V149 L178 Y179 D184 Q185	V149-D182 HydrophobicContact CG1-CB 4.04Å; V149-D182 WeakPolarHBondContact CG1-OD2 3.35Å; V149-D182 HydrophobicContact CG2-CB 3.99Å; L178-D182 PolarHBondContact O-N 3.07Å; Y179-D182 CarbonylContact O-C 3.39Å; D182-D184 WeakPolarHBondContact OD1-CB 3.49Å; D182-D184 PolarHBondContact OD1-N 2.96Å; D182-Q185 WeakPolarHBondContact OD2-CG 3.43Å; D182-Q185 PolarHBondContact OD2-NE2 2.97Å
183	A	86.4	Confident	89	Confident	53 Å²	53	52 Å²	52	44%	0.438	27%	0.265	S	S	.	.	S	Bend	trans	-79.7	-19.4	178.5	0	0	0	0	0	112.9	Y179 Q185 K186	Y179-A183 HydrophobicContact CE2-CB 4.21Å; A183-Q185 PolarHBondContact O-N 3.4Å; A183-K186 VanDerWaalsContact O-CB 3.32Å; A183-K186 WeakPolarHBondContact O-CB 3.45Å; A183-K186 PolarHBondContact O-N 3.44Å
184	D	87.1	Confident	88.9	Confident	143 Å²	143	51 Å²	51	77%	0.765	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-21.7	-175.2	-64.4	-12	0	0	0	111.5	D182 K186	D182-D184 WeakPolarHBondContact OD1-CB 3.49Å; D182-D184 PolarHBondContact OD1-N 2.96Å; D184-K186 PolarHBondContact O-N 3.32Å; D184-K186 VanDerWaalsContact O-N 3.16Å
185	Q	83.5	Confident	88.8	Confident	44 Å²	44	56.3 Å²	56.3	21%	0.206	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	5.5	173.9	-54	-46	-47.4	0	0	114.6	V149 M153 L178 D182 A183 E187 H188 L189	V149-Q185 HydrophobicContact CG1-CG 3.9Å; M153-Q185 HydrophobicContact SD-CB 4.42Å; L178-Q185 HydrophobicContact CD1-CG 4.34Å; D182-Q185 WeakPolarHBondContact OD2-CG 3.43Å; D182-Q185 PolarHBondContact OD2-NE2 2.97Å; A183-Q185 PolarHBondContact O-N 3.4Å; Q185-E187 VanDerWaalsContact C-N 3.28Å; Q185-E187 PolarHBondContact O-N 2.84Å; Q185-E187 VanDerWaalsContact O-N 3.16Å; Q185-H188 PolarHBondContact O-N 3.02Å; Q185-H188 VanDerWaalsContact O-N 3.09Å; Q185-H188 PolarHBondContact OE1-ND1 3.29Å; Q185-L189 HydrophobicContact CB-CD1 4.47Å; Q185-L189 HydrophobicContact CB-CG 4.46Å; Q185-L189 WeakPolarHBondContact O-CG 3.44Å; Q185-L189 PolarHBondContact O-N 3.42Å
186	K	85.3	Confident	88.6	Confident	69 Å²	69	56.6 Å²	56.6	30%	0.3	29%	0.285	S	S	.	.	H	α-helix	trans	-47.9	-45.2	-175.4	-177.2	166.9	-177.7	158.3	0	113.5	Y179 A183 D184 L189 I190 V215 C216	Y179-K186 HydrophobicContact CE2-CB 4.28Å; Y179-K186 HydrophobicContact CE2-CD 4.15Å; Y179-K186 HydrophobicContact CE2-CG 4.32Å; A183-K186 VanDerWaalsContact O-CB 3.32Å; A183-K186 WeakPolarHBondContact O-CB 3.45Å; A183-K186 PolarHBondContact O-N 3.44Å; D184-K186 PolarHBondContact O-N 3.32Å; D184-K186 VanDerWaalsContact O-N 3.16Å; K186-L189 WeakPolarHBondContact O-CB 3.39Å; K186-L189 PolarHBondContact O-N 3.41Å; K186-I190 HydrophobicContact CG-CD1 4.24Å; K186-I190 VanDerWaalsContact O-CG1 3.3Å; K186-I190 WeakPolarHBondContact O-CG1 3.26Å; K186-I190 PolarHBondContact O-N 2.94Å; K186-V215 WeakPolarHBondContact CE-O 3.47Å; K186-V215 HydrophobicContact CG-CG1 4.17Å; K186-V215 PolarHBondContact NZ-O 2.98Å; K186-C216 WeakPolarHBondContact CE-SG 3.37Å
187	E	86.9	Confident	88.6	Confident	154 Å²	154	55.4 Å²	55.4	72%	0.72	28%	0.28	S	S	*	.	H	α-helix	trans	-64.9	-47.3	179.9	-59.9	-169.3	158.7	0	0	112.5	Q185 L189 I190 E191	Q185-E187 VanDerWaalsContact C-N 3.28Å; Q185-E187 PolarHBondContact O-N 2.84Å; Q185-E187 VanDerWaalsContact O-N 3.16Å; E187-L189 PolarHBondContact O-N 3.16Å; E187-I190 WeakPolarHBondContact O-CB 3.32Å; E187-I190 PolarHBondContact O-N 2.9Å; E187-I190 VanDerWaalsContact O-N 3.11Å; E187-E191 PolarHBondContact O-N 3.44Å
188	H	86.9	Confident	88.5	Confident	84 Å²	84	57 Å²	57	39%	0.389	29%	0.287	S	S	.	.	H	α-helix	trans	-63.4	-25	175.8	-62.4	134.3	0	0	0	113.5	M153 Q185 V192	M153-H188 HydrophobicContact CG-CB 4.4Å; M153-H188 HydrophobicContact SD-CB 3.69Å; Q185-H188 PolarHBondContact O-N 3.02Å; Q185-H188 VanDerWaalsContact O-N 3.09Å; Q185-H188 PolarHBondContact OE1-ND1 3.29Å; H188-V192 WeakPolarHBondContact O-CG2 3.36Å
189	L	88.8	Confident	88.3	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-77.5	-38.6	173	-68.3	171.9	0	0	0	111.8	M153 I175 L178 Y179 Q185 K186 E187 E191 V192 I193 V215	M153-L189 HydrophobicContact CE-CD2 3.84Å; M153-L189 HydrophobicContact SD-CD2 3.97Å; M153-L189 HydrophobicContact SD-CG 4.35Å; I175-L189 HydrophobicContact CB-CD2 4.16Å; I175-L189 HydrophobicContact CG1-CD2 4Å; I175-L189 HydrophobicContact CG2-CB 4.17Å; I175-L189 HydrophobicContact CG2-CD1 4.3Å; I175-L189 HydrophobicContact CG2-CD2 3.75Å; I175-L189 HydrophobicContact CG2-CG 4.29Å; L178-L189 HydrophobicContact CD2-CD2 3.62Å; L178-L189 HydrophobicContact CD2-CG 4.41Å; L178-L189 HydrophobicContact CG-CD1 4.32Å; L178-L189 HydrophobicContact CG-CD2 4.17Å; Y179-L189 HydrophobicContact CD2-CD1 4.32Å; Q185-L189 HydrophobicContact CB-CD1 4.47Å; Q185-L189 HydrophobicContact CB-CG 4.46Å; Q185-L189 WeakPolarHBondContact O-CG 3.44Å; Q185-L189 PolarHBondContact O-N 3.42Å; K186-L189 WeakPolarHBondContact O-CB 3.39Å; K186-L189 PolarHBondContact O-N 3.41Å; E187-L189 PolarHBondContact O-N 3.16Å; L189-E191 VanDerWaalsContact C-N 3.34Å; L189-E191 PolarHBondContact O-N 2.85Å; L189-V192 PolarHBondContact O-N 3.33Å; L189-V192 VanDerWaalsContact O-N 3.12Å; L189-I193 WeakPolarHBondContact O-CG1 3.43Å; L189-I193 PolarHBondContact O-N 2.88Å; L189-V215 HydrophobicContact CB-CG1 4.41Å
190	I	88.8	Confident	88.1	Confident	30 Å²	30	64 Å²	64	15%	0.154	32%	0.32	C	S	.	.	H	α-helix	trans	-58.2	-44.1	176.3	-69.3	163.3	0	0	0	111.2	K186 E187 V192 I193 E194 C216 L222	K186-I190 HydrophobicContact CG-CD1 4.24Å; K186-I190 VanDerWaalsContact O-CG1 3.3Å; K186-I190 WeakPolarHBondContact O-CG1 3.26Å; K186-I190 PolarHBondContact O-N 2.94Å; E187-I190 WeakPolarHBondContact O-CB 3.32Å; E187-I190 PolarHBondContact O-N 2.9Å; E187-I190 VanDerWaalsContact O-N 3.11Å; I190-V192 PolarHBondContact O-N 2.85Å; I190-I193 PolarHBondContact O-N 2.84Å; I190-I193 VanDerWaalsContact O-N 3.14Å; I190-E194 PolarHBondContact O-N 2.89Å; I190-C216 WeakPolarHBondContact CD1-SG 3.42Å; I190-C216 VanDerWaalsContact CG1-SG 3.52Å; I190-L222 HydrophobicContact CG2-CD1 4Å
191	E	89.1	Confident	88.1	Confident	110 Å²	110	61.1 Å²	61.1	51%	0.514	30%	0.3	S	S	.	.	H	α-helix	trans	-53.3	-42.6	175.2	-63.9	-178.9	145.5	0	0	112.3	K157 E187 L189 K195	K157-E191 IonicContact NZ-OE2 3.73Å; K157-E191 PolarHBondContact NZ-OE2 3.3Å; E187-E191 PolarHBondContact O-N 3.44Å; L189-E191 VanDerWaalsContact C-N 3.34Å; L189-E191 PolarHBondContact O-N 2.85Å; E191-K195 WeakPolarHBondContact O-CB 3.29Å; E191-K195 PolarHBondContact O-N 3.36Å; E191-K195 VanDerWaalsContact O-N 3.11Å
192	V	90.3	Very high	88.1	Confident	6 Å²	6	60.8 Å²	60.8	4%	0.036	30%	0.299	C	S	.	.	H	α-helix	trans	-73	-38.7	-179.3	-176.7	0	0	0	0	110.7	M153 I156 K157 A160 I175 H188 L189 I190 K195 L196	M153-V192 HydrophobicContact CE-CG2 4.02Å; I156-V192 HydrophobicContact CG2-CG1 4.1Å; K157-V192 HydrophobicContact CD-CG2 4.39Å; K157-V192 HydrophobicContact CG-CG2 3.79Å; A160-V192 HydrophobicContact CB-CG1 3.53Å; I175-V192 HydrophobicContact CD1-CB 4.19Å; I175-V192 HydrophobicContact CD1-CG1 3.77Å; H188-V192 WeakPolarHBondContact O-CG2 3.36Å; L189-V192 PolarHBondContact O-N 3.33Å; L189-V192 VanDerWaalsContact O-N 3.12Å; I190-V192 PolarHBondContact O-N 2.85Å; V192-K195 PolarHBondContact O-N 2.86Å; V192-L196 HydrophobicContact CG1-CD1 3.89Å; V192-L196 HydrophobicContact CG1-CG 4.34Å; V192-L196 WeakPolarHBondContact O-CB 3.38Å; V192-L196 VanDerWaalsContact O-CG 3.29Å; V192-L196 WeakPolarHBondContact O-CG 3.42Å; V192-L196 PolarHBondContact O-N 2.89Å
193	I	91.1	Very high	88.1	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-45.5	174.5	-66.3	167.9	0	0	0	110.5	I175 L189 I190 K195 L196 L197 V208 F212 V215	I175-I193 HydrophobicContact CD1-CG1 4.03Å; I175-I193 HydrophobicContact CG2-CD1 4.16Å; I175-I193 HydrophobicContact CG2-CG1 4.39Å; L189-I193 WeakPolarHBondContact O-CG1 3.43Å; L189-I193 PolarHBondContact O-N 2.88Å; I190-I193 PolarHBondContact O-N 2.84Å; I190-I193 VanDerWaalsContact O-N 3.14Å; I193-K195 VanDerWaalsContact C-N 3.34Å; I193-K195 PolarHBondContact O-N 2.68Å; I193-L196 PolarHBondContact O-N 3.29Å; I193-L197 HydrophobicContact CG2-CD1 3.92Å; I193-L197 HydrophobicContact CG2-CG 4.18Å; I193-L197 WeakPolarHBondContact O-CB 3.25Å; I193-L197 WeakPolarHBondContact O-CG 3.41Å; I193-L197 PolarHBondContact O-N 3.36Å; I193-V208 HydrophobicContact CG2-CG1 4.33Å; I193-F212 HydrophobicContact CG2-CB 4.22Å; I193-F212 HydrophobicContact CG2-CD2 4.36Å; I193-V215 HydrophobicContact CD1-CB 4.12Å; I193-V215 HydrophobicContact CD1-CG1 4.37Å; I193-V215 HydrophobicContact CD1-CG2 4.42Å
194	E	90.4	Very high	88.4	Confident	50 Å²	50	60.9 Å²	60.9	23%	0.234	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-42.1	177.1	-164.4	-160.7	167.6	0	0	111.5	I190 L196 K198 L222 R225	I190-E194 PolarHBondContact O-N 2.89Å; E194-L196 VanDerWaalsContact C-N 3.34Å; E194-L196 PolarHBondContact O-N 3.09Å; E194-K198 WeakPolarHBondContact O-CG 3.29Å; E194-K198 PolarHBondContact O-N 3.46Å; E194-K198 WeakPolarHBondContact OE1-CE 3.23Å; E194-K198 IonicContact OE1-NZ 2.75Å; E194-K198 PolarHBondContact OE1-NZ 2.71Å; E194-K198 IonicContact OE2-NZ 2.76Å; E194-L222 HydrophobicContact CB-CD2 4.12Å; E194-L222 HydrophobicContact CG-CD2 3.92Å; E194-R225 IonicContact OE1-CZ 3.37Å; E194-R225 IonicContact OE1-NH1 3.36Å; E194-R225 PolarHBondContact OE1-NH1 3.33Å; E194-R225 IonicContact OE1-NH2 3.35Å
195	K	90.1	Very high	88.5	Confident	112 Å²	112	54.8 Å²	54.8	49%	0.487	26%	0.261	S	S	.	.	H	α-helix	trans	-60.8	-41.7	175.3	-172.8	178.5	-176	176.9	0	112	S161 E191 V192 I193	S161-K195 PolarHBondContact OG-NZ 2.98Å; E191-K195 WeakPolarHBondContact O-CB 3.29Å; E191-K195 PolarHBondContact O-N 3.36Å; E191-K195 VanDerWaalsContact O-N 3.11Å; V192-K195 PolarHBondContact O-N 2.86Å; I193-K195 VanDerWaalsContact C-N 3.34Å; I193-K195 PolarHBondContact O-N 2.68Å
196	L	90.1	Very high	88.8	Confident	5 Å²	5	52.8 Å²	52.8	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-78.3	-31.8	-179	-70.1	173.9	0	0	0	113.3	A160 R168 A172 I175 V192 I193 E194 K198 D199 V204 V208	A160-L196 HydrophobicContact CB-CD1 4.15Å; A160-L196 HydrophobicContact CB-CD2 3.97Å; A160-L196 HydrophobicContact CB-CG 4.09Å; R168-L196 HydrophobicContact CB-CD2 4.07Å; A172-L196 HydrophobicContact CB-CD1 4.32Å; I175-L196 HydrophobicContact CD1-CD1 4.22Å; V192-L196 HydrophobicContact CG1-CD1 3.89Å; V192-L196 HydrophobicContact CG1-CG 4.34Å; V192-L196 WeakPolarHBondContact O-CB 3.38Å; V192-L196 VanDerWaalsContact O-CG 3.29Å; V192-L196 WeakPolarHBondContact O-CG 3.42Å; V192-L196 PolarHBondContact O-N 2.89Å; I193-L196 PolarHBondContact O-N 3.29Å; E194-L196 VanDerWaalsContact C-N 3.34Å; E194-L196 PolarHBondContact O-N 3.09Å; L196-K198 PolarHBondContact O-N 3.3Å; L196-D199 WeakPolarHBondContact O-CB 3.02Å; L196-D199 PolarHBondContact O-N 3.45Å; L196-D199 VanDerWaalsContact O-N 3.08Å; L196-V204 HydrophobicContact CD2-CG1 4.42Å; L196-V208 HydrophobicContact CB-CG1 4.08Å; L196-V208 HydrophobicContact CB-CG2 3.6Å; L196-V208 HydrophobicContact CD1-CG2 4.31Å; L196-V208 HydrophobicContact CG-CG2 4.5Å
197	L	88.9	Confident	89.1	Confident	10 Å²	10	49.6 Å²	49.6	5%	0.052	24%	0.239	C	C	.	.	H	α-helix	trans	-61.1	-30.3	172.1	-78.7	171.7	0	0	0	111.8	I193 D199 V208 V209 L222 I223 N226 K229	I193-L197 HydrophobicContact CG2-CD1 3.92Å; I193-L197 HydrophobicContact CG2-CG 4.18Å; I193-L197 WeakPolarHBondContact O-CB 3.25Å; I193-L197 WeakPolarHBondContact O-CG 3.41Å; I193-L197 PolarHBondContact O-N 3.36Å; L197-D199 VanDerWaalsContact C-N 3.32Å; L197-D199 PolarHBondContact O-N 2.89Å; L197-V208 HydrophobicContact CD2-CG1 3.65Å; L197-V208 HydrophobicContact CG-CG1 3.68Å; L197-V209 HydrophobicContact CD2-CG2 4.41Å; L197-L222 HydrophobicContact CD1-CB 4Å; L197-I223 HydrophobicContact CD1-CD1 4.35Å; L197-I223 HydrophobicContact CD2-CD1 4.49Å; L197-N226 PolarHBondContact O-OD1 3.39Å; L197-K229 PolarHBondContact O-NZ 3.34Å
198	K	88.6	Confident	89.4	Confident	102 Å²	102	42.3 Å²	42.3	44%	0.443	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-16.3	175.7	-69	166.5	-174.6	166.8	0	113.8	E194 L196 K229	E194-K198 WeakPolarHBondContact O-CG 3.29Å; E194-K198 PolarHBondContact O-N 3.46Å; E194-K198 WeakPolarHBondContact OE1-CE 3.23Å; E194-K198 IonicContact OE1-NZ 2.75Å; E194-K198 PolarHBondContact OE1-NZ 2.71Å; E194-K198 IonicContact OE2-NZ 2.76Å; L196-K198 PolarHBondContact O-N 3.3Å; K198-K229 PolarHBondContact O-NZ 3.42Å
199	D	87.6	Confident	89.6	Confident	30 Å²	30	38.3 Å²	38.3	16%	0.16	19%	0.187	C	C	.	.			trans	-56.9	140	179.2	-169.4	-10.7	0	0	0	112.5	R168 L196 L197 S201 V204 K229	R168-D199 IonicContact CZ-OD1 3.6Å; R168-D199 IonicContact CZ-OD2 3.57Å; R168-D199 IonicContact NE-OD2 3.64Å; R168-D199 PolarHBondContact NE-OD2 2.9Å; R168-D199 VanDerWaalsContact NH2-CG 3.31Å; R168-D199 IonicContact NH2-OD1 3.04Å; R168-D199 PolarHBondContact NH2-OD1 3.33Å; R168-D199 IonicContact NH2-OD2 3.29Å; R168-D199 PolarHBondContact NH2-OD2 3.28Å; L196-D199 WeakPolarHBondContact O-CB 3.02Å; L196-D199 PolarHBondContact O-N 3.45Å; L196-D199 VanDerWaalsContact O-N 3.08Å; L197-D199 VanDerWaalsContact C-N 3.32Å; L197-D199 PolarHBondContact O-N 2.89Å; D199-S201 VanDerWaalsContact C-N 3.34Å; D199-S201 PolarHBondContact OD1-N 3.18Å; D199-V204 WeakPolarHBondContact OD2-CG2 3.31Å; D199-K229 VanDerWaalsContact O-CE 3.28Å; D199-K229 WeakPolarHBondContact O-CE 3.17Å; D199-K229 PolarHBondContact O-NZ 3.19Å
200	K	84.6	Confident	89.7	Confident	176 Å²	176	40.5 Å²	40.5	77%	0.765	20%	0.2	S	C	*	.			trans	-81	-11	178.5	-62.2	-177.2	179.6	-178.1	0	112.9
201	S	89.3	Confident	89.8	Confident	25 Å²	25	39.1 Å²	39.1	18%	0.175	19%	0.193	C	C	.	.			trans	-84.4	122.6	-174.3	-166.5	0	0	0	0	114.6	P165 D199 L203 V204 A205	P165-S201 WeakPolarHBondContact CB-OG 3.38Å; D199-S201 VanDerWaalsContact C-N 3.34Å; D199-S201 PolarHBondContact OD1-N 3.18Å; S201-L203 VanDerWaalsContact C-N 3.26Å; S201-L203 PolarHBondContact O-N 3.12Å; S201-V204 PolarHBondContact O-N 2.8Å; S201-V204 VanDerWaalsContact O-N 3.16Å; S201-A205 PolarHBondContact O-N 3.07Å
202	T	88.2	Confident	89.9	Confident	36 Å²	36	34.2 Å²	34.2	22%	0.221	17%	0.17	C	C	.	.	H	α-helix	trans	-60.7	-30.8	175.7	56	0	0	0	0	113.6	V204 L233 D236 V237	T202-V204 PolarHBondContact O-N 3.43Å; T202-L233 HydrophobicContact CG2-CB 4.41Å; T202-L233 HydrophobicContact CG2-CD2 3.98Å; T202-D236 WeakPolarHBondContact CB-O 3.34Å; T202-D236 HydrophobicContact CG2-CB 3.85Å; T202-D236 PolarHBondContact OG1-O 3.1Å; T202-V237 HydrophobicContact CG2-CG2 4.37Å
203	L	89.1	Confident	89.8	Confident	92 Å²	92	36.2 Å²	36.2	48%	0.482	18%	0.179	S	C	.	.	H	α-helix	trans	-62.9	-25.2	177.5	-65.7	176.9	0	0	0	113.5	P165 K169 S201	P165-L203 HydrophobicContact CB-CD1 4.41Å; K169-L203 WeakPolarHBondContact CD-O 3.43Å; K169-L203 WeakPolarHBondContact CG-O 3.3Å; K169-L203 PolarHBondContact NZ-O 2.92Å; S201-L203 VanDerWaalsContact C-N 3.26Å; S201-L203 PolarHBondContact O-N 3.12Å
204	V	90.8	Very high	89.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-95.6	-39	-176.3	179.4	0	0	0	0	110.8	P165 R168 K169 L196 D199 S201 T202 G206 S207 V208	P165-V204 HydrophobicContact CB-CG2 3.94Å; P165-V204 VanDerWaalsContact O-CG2 3.32Å; P165-V204 WeakPolarHBondContact O-CG2 3.32Å; R168-V204 HydrophobicContact CB-CG1 4.39Å; R168-V204 HydrophobicContact CB-CG2 4.07Å; K169-V204 HydrophobicContact CB-CG2 4.29Å; L196-V204 HydrophobicContact CD2-CG1 4.42Å; D199-V204 WeakPolarHBondContact OD2-CG2 3.31Å; S201-V204 PolarHBondContact O-N 2.8Å; S201-V204 VanDerWaalsContact O-N 3.16Å; T202-V204 PolarHBondContact O-N 3.43Å; V204-G206 VanDerWaalsContact C-N 3.35Å; V204-G206 PolarHBondContact O-N 2.61Å; V204-S207 PolarHBondContact O-N 2.73Å; V204-S207 VanDerWaalsContact O-N 3.17Å; V204-V208 HydrophobicContact CG1-CG2 3.58Å; V204-V208 WeakPolarHBondContact O-CG2 3.46Å; V204-V208 PolarHBondContact O-N 2.75Å; V204-V208 VanDerWaalsContact O-N 3.07Å
205	A	89.6	Confident	89.3	Confident	14 Å²	14	39.2 Å²	39.2	12%	0.116	19%	0.193	C	C	.	.	H	α-helix	trans	-49.3	-47.5	-174.7	0	0	0	0	0	114.2	S201 V208 V209 L230 V237	S201-A205 PolarHBondContact O-N 3.07Å; A205-V208 PolarHBondContact O-N 3.49Å; A205-V209 PolarHBondContact O-N 3.39Å; A205-V209 VanDerWaalsContact O-N 3.13Å; A205-L230 HydrophobicContact CB-CD2 4.5Å; A205-V237 HydrophobicContact CB-CG2 4.25Å
206	G	90.6	Very high	88.8	Confident	2 Å²	2	34 Å²	34	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-57	-56.4	177.9	0	0	0	0	0	112.6	V204 V208 V209 V210	V204-G206 VanDerWaalsContact C-N 3.35Å; V204-G206 PolarHBondContact O-N 2.61Å; G206-V208 VanDerWaalsContact C-N 3.27Å; G206-V208 PolarHBondContact O-N 3.49Å; G206-V209 PolarHBondContact O-N 2.88Å; G206-V209 VanDerWaalsContact O-N 3.13Å; G206-V210 WeakPolarHBondContact O-CG2 3.35Å; G206-V210 PolarHBondContact O-N 3.13Å; G206-V210 VanDerWaalsContact O-N 3.16Å
207	S	92.2	Very high	88.2	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.014	18%	0.183	C	C	.	.	H	α-helix	trans	-61	-32.4	-179.4	-59.5	0	0	0	0	113.5	K169 H173 V204 A211	K169-S207 WeakPolarHBondContact CE-OG 3.48Å; K169-S207 WeakPolarHBondContact CG-OG 3.34Å; H173-S207 PolarHBondContact CD2-OG 2.96Å; H173-S207 WeakPolarHBondContact NE2-CB 2.96Å; H173-S207 PolarHBondContact NE2-OG 2.64Å; V204-S207 PolarHBondContact O-N 2.73Å; V204-S207 VanDerWaalsContact O-N 3.17Å; S207-A211 PolarHBondContact O-N 3.28Å; S207-A211 VanDerWaalsContact O-N 3.11Å
208	V	92.9	Very high	87.5	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.012	21%	0.212	C	C	.	.	H	α-helix	trans	-69.6	-38.3	176.2	177.7	0	0	0	0	111.5	A172 I193 L196 L197 V204 A205 G206 A211 F212	A172-V208 HydrophobicContact CB-CG2 3.85Å; I193-V208 HydrophobicContact CG2-CG1 4.33Å; L196-V208 HydrophobicContact CB-CG1 4.08Å; L196-V208 HydrophobicContact CB-CG2 3.6Å; L196-V208 HydrophobicContact CD1-CG2 4.31Å; L196-V208 HydrophobicContact CG-CG2 4.5Å; L197-V208 HydrophobicContact CD2-CG1 3.65Å; L197-V208 HydrophobicContact CG-CG1 3.68Å; V204-V208 HydrophobicContact CG1-CG2 3.58Å; V204-V208 WeakPolarHBondContact O-CG2 3.46Å; V204-V208 PolarHBondContact O-N 2.75Å; V204-V208 VanDerWaalsContact O-N 3.07Å; A205-V208 PolarHBondContact O-N 3.49Å; G206-V208 VanDerWaalsContact C-N 3.27Å; G206-V208 PolarHBondContact O-N 3.49Å; V208-A211 WeakPolarHBondContact O-CB 3.15Å; V208-A211 PolarHBondContact O-N 2.95Å; V208-A211 VanDerWaalsContact O-N 3.13Å; V208-F212 PolarHBondContact O-N 2.86Å
209	V	90.9	Very high	87	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-70	-34.3	176.8	178.1	0	0	0	0	111.6	L197 A205 G206 A211 F212 E213 L230 V244 I245 M248	L197-V209 HydrophobicContact CD2-CG2 4.41Å; A205-V209 PolarHBondContact O-N 3.39Å; A205-V209 VanDerWaalsContact O-N 3.13Å; G206-V209 PolarHBondContact O-N 2.88Å; G206-V209 VanDerWaalsContact O-N 3.13Å; V209-A211 VanDerWaalsContact C-N 3.28Å; V209-A211 PolarHBondContact O-N 3.32Å; V209-F212 PolarHBondContact O-N 2.89Å; V209-E213 WeakPolarHBondContact O-CB 3.46Å; V209-E213 PolarHBondContact O-N 2.89Å; V209-L230 HydrophobicContact CG2-CD1 4.39Å; V209-L230 HydrophobicContact CG2-CD2 4.35Å; V209-V244 HydrophobicContact CG1-CG1 4.17Å; V209-I245 HydrophobicContact CB-CG1 4.08Å; V209-I245 HydrophobicContact CG1-CG1 4.28Å; V209-I245 HydrophobicContact CG2-CG1 4.03Å; V209-M248 HydrophobicContact CG1-CB 3.75Å; V209-M248 HydrophobicContact CG1-CE 3.65Å; V209-M248 HydrophobicContact CG1-CG 3.85Å; V209-M248 HydrophobicContact CG2-CE 4.12Å
210	V	90.8	Very high	86.5	Confident	45 Å²	45	42.5 Å²	42.5	27%	0.273	21%	0.214	S	C	.	.	H	α-helix	trans	-62.4	-36.5	168.9	-162.8	0	0	0	0	111	Q176 G206 E214 V244	Q176-V210 PolarHBondContact NE2-O 3.12Å; G206-V210 WeakPolarHBondContact O-CG2 3.35Å; G206-V210 PolarHBondContact O-N 3.13Å; G206-V210 VanDerWaalsContact O-N 3.16Å; V210-E214 PolarHBondContact O-N 2.81Å; V210-V244 HydrophobicContact CB-CG1 4.43Å; V210-V244 HydrophobicContact CG2-CB 4.25Å; V210-V244 HydrophobicContact CG2-CG1 3.85Å; V210-V244 HydrophobicContact CG2-CG2 4.06Å
211	A	91.3	Very high	86.2	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-72.3	-33.5	177.8	0	0	0	0	0	112.6	A172 I175 Q176 S207 V208 V209 V215	A172-A211 WeakPolarHBondContact O-CB 3.37Å; I175-A211 HydrophobicContact CB-CB 4.41Å; I175-A211 HydrophobicContact CG2-CB 4.33Å; Q176-A211 HydrophobicContact CG-CB 4.3Å; S207-A211 PolarHBondContact O-N 3.28Å; S207-A211 VanDerWaalsContact O-N 3.11Å; V208-A211 WeakPolarHBondContact O-CB 3.15Å; V208-A211 PolarHBondContact O-N 2.95Å; V208-A211 VanDerWaalsContact O-N 3.13Å; V209-A211 VanDerWaalsContact C-N 3.28Å; V209-A211 PolarHBondContact O-N 3.32Å; A211-V215 WeakPolarHBondContact O-CB 3.46Å; A211-V215 VanDerWaalsContact O-CG2 3.3Å; A211-V215 WeakPolarHBondContact O-CG2 3.36Å; A211-V215 PolarHBondContact O-N 2.97Å
212	F	90.9	Very high	85.8	Confident	7 Å²	7	37.2 Å²	37.2	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-65.9	-47.5	172.3	172.2	-93.5	0	0	0	111.9	I193 V208 V209 E214 V215 C216 R219 L222 I223 M248	I193-F212 HydrophobicContact CG2-CB 4.22Å; I193-F212 HydrophobicContact CG2-CD2 4.36Å; V208-F212 PolarHBondContact O-N 2.86Å; V209-F212 PolarHBondContact O-N 2.89Å; F212-E214 VanDerWaalsContact C-N 3.3Å; F212-E214 PolarHBondContact O-N 2.91Å; F212-V215 PolarHBondContact O-N 3.32Å; F212-C216 VanDerWaalsContact CE2-O 3.29Å; F212-C216 WeakPolarHBondContact CE2-O 3.4Å; F212-C216 VanDerWaalsContact CZ-O 3.24Å; F212-C216 WeakPolarHBondContact CZ-O 3.43Å; F212-C216 CarbonylContact O-C 3.55Å; F212-C216 VanDerWaalsContact O-C 3.26Å; F212-C216 PolarHBondContact O-N 3.15Å; F212-R219 WeakPolarHBondContact CE2-O 3.5Å; F212-L222 HydrophobicContact CD2-CD1 4.39Å; F212-L222 HydrophobicContact CE2-CB 4.19Å; F212-L222 HydrophobicContact CE2-CD1 4.17Å; F212-I223 HydrophobicContact CD1-CD1 3.97Å; F212-I223 HydrophobicContact CD1-CG1 4.31Å; F212-I223 HydrophobicContact CD2-CD1 4.19Å; F212-I223 HydrophobicContact CE1-CD1 3.85Å; F212-I223 HydrophobicContact CE1-CG1 3.66Å; F212-I223 HydrophobicContact CE2-CD1 4.07Å; F212-I223 HydrophobicContact CE2-CG1 3.99Å; F212-I223 HydrophobicContact CG-CD1 4.15Å; F212-I223 HydrophobicContact CZ-CD1 3.91Å; F212-I223 HydrophobicContact CZ-CG1 3.48Å; F212-I223 VanDerWaalsContact CZ-CG1 3.48Å; F212-M248 HydrophobicContact CD1-CG 4.28Å; F212-M248 HydrophobicContact CE1-CG 4.26Å
213	E	87.2	Confident	85.7	Confident	48 Å²	48	35.5 Å²	35.5	22%	0.224	18%	0.181	C	C	.	.	H	α-helix	trans	-62.5	-34.8	-178.4	-174.8	164.2	-143.7	0	0	112.8	V209 R251	V209-E213 WeakPolarHBondContact O-CB 3.46Å; V209-E213 PolarHBondContact O-N 2.89Å; E213-R251 IonicContact OE1-CZ 3.22Å; E213-R251 IonicContact OE1-NH1 2.9Å; E213-R251 PolarHBondContact OE1-NH1 2.89Å
214	E	86.1	Confident	85.4	Confident	115 Å²	115	31.6 Å²	31.6	54%	0.537	16%	0.161	S	C	.	.	H	α-helix	trans	-75.2	-43.9	177	-169.7	71.1	-170	0	0	113	Q176 Y179 V210 F212	Q176-E214 HydrophobicContact CG-CB 4.29Å; Q176-E214 HydrophobicContact CG-CG 4.42Å; Y179-E214 HydrophobicContact CD1-CG 4.36Å; Y179-E214 WeakPolarHBondContact CE1-O 3.37Å; V210-E214 PolarHBondContact O-N 2.81Å; F212-E214 VanDerWaalsContact C-N 3.3Å; F212-E214 PolarHBondContact O-N 2.91Å
215	V	85.3	Confident	84.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-90.5	-37.5	-169.8	-179.4	0	0	0	0	112.9	I175 Y179 K186 L189 I193 A211 F212	I175-V215 HydrophobicContact CG2-CG2 3.89Å; Y179-V215 HydrophobicContact CD1-CB 4.42Å; Y179-V215 HydrophobicContact CD1-CG2 3.89Å; Y179-V215 HydrophobicContact CD2-CG1 4.15Å; Y179-V215 HydrophobicContact CD2-CG2 4.42Å; Y179-V215 HydrophobicContact CE2-CG1 4.25Å; Y179-V215 HydrophobicContact CG-CB 4.48Å; Y179-V215 HydrophobicContact CG-CG1 4.37Å; Y179-V215 HydrophobicContact CG-CG2 3.83Å; K186-V215 WeakPolarHBondContact CE-O 3.47Å; K186-V215 HydrophobicContact CG-CG1 4.17Å; K186-V215 PolarHBondContact NZ-O 2.98Å; L189-V215 HydrophobicContact CB-CG1 4.41Å; I193-V215 HydrophobicContact CD1-CB 4.12Å; I193-V215 HydrophobicContact CD1-CG1 4.37Å; I193-V215 HydrophobicContact CD1-CG2 4.42Å; A211-V215 WeakPolarHBondContact O-CB 3.46Å; A211-V215 VanDerWaalsContact O-CG2 3.3Å; A211-V215 WeakPolarHBondContact O-CG2 3.36Å; A211-V215 PolarHBondContact O-N 2.97Å; F212-V215 PolarHBondContact O-N 3.32Å
216	C	80.8	Confident	84.7	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.014	18%	0.181	C	C	.	.			trans	-150.6	62.7	-169.2	-81.7	0	0	0	0	113.2	K186 I190 F212 D218 R219	K186-C216 WeakPolarHBondContact CE-SG 3.37Å; I190-C216 WeakPolarHBondContact CD1-SG 3.42Å; I190-C216 VanDerWaalsContact CG1-SG 3.52Å; F212-C216 VanDerWaalsContact CE2-O 3.29Å; F212-C216 WeakPolarHBondContact CE2-O 3.4Å; F212-C216 VanDerWaalsContact CZ-O 3.24Å; F212-C216 WeakPolarHBondContact CZ-O 3.43Å; F212-C216 CarbonylContact O-C 3.55Å; F212-C216 VanDerWaalsContact O-C 3.26Å; F212-C216 PolarHBondContact O-N 3.15Å; C216-D218 PolarHBondContact O-N 3Å; C216-D218 VanDerWaalsContact O-N 3.15Å; C216-R219 HydrophobicContact CB-CB 4.18Å; C216-R219 HydrophobicContact CB-CG 4.29Å; C216-R219 PolarHBondContact O-N 2.87Å
217	P	76.6	Confident	84.5	Confident	45 Å²	45	37.4 Å²	37.4	29%	0.292	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.6	174.2	25.9	-34.3	0	0	0	112.7
218	D	74.6	Confident	84.3	Confident	125 Å²	125	41.1 Å²	41.1	67%	0.668	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-16	-173.3	-36.3	-72.2	0	0	0	114.3	C216 I220	C216-D218 PolarHBondContact O-N 3Å; C216-D218 VanDerWaalsContact O-N 3.15Å; D218-I220 VanDerWaalsContact C-N 3.27Å; D218-I220 PolarHBondContact O-N 2.78Å
219	R	78.5	Confident	84	Confident	119 Å²	119	43.9 Å²	43.9	45%	0.449	21%	0.205	S	C	.	.			trans	-88.7	63.7	-176.4	-68.7	-58.2	-55.7	-88.9	3.6	112.1	F212 C216 D221 L222	F212-R219 WeakPolarHBondContact CE2-O 3.5Å; C216-R219 HydrophobicContact CB-CB 4.18Å; C216-R219 HydrophobicContact CB-CG 4.29Å; C216-R219 PolarHBondContact O-N 2.87Å; R219-D221 IonicContact CZ-OD2 3.59Å; R219-D221 IonicContact NE-OD2 2.66Å; R219-D221 PolarHBondContact NE-OD2 3.49Å; R219-D221 IonicContact NH2-OD2 2.76Å; R219-D221 PolarHBondContact NH2-OD2 2.98Å; R219-D221 PolarHBondContact O-N 3.45Å; R219-D221 VanDerWaalsContact O-N 3.14Å; R219-L222 HydrophobicContact CB-CD1 4.21Å; R219-L222 PolarHBondContact O-N 3.12Å
220	I	77.3	Confident	83.9	Confident	37 Å²	37	44.2 Å²	44.2	19%	0.19	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-32.9	-175.7	-53.5	-177.7	0	0	0	111.8	D218 L222 I223 H224 Y252 Q256	D218-I220 VanDerWaalsContact C-N 3.27Å; D218-I220 PolarHBondContact O-N 2.78Å; I220-L222 PolarHBondContact O-N 3.47Å; I220-I223 WeakPolarHBondContact O-CA 3.46Å; I220-I223 WeakPolarHBondContact O-CB 3.48Å; I220-I223 PolarHBondContact O-N 2.7Å; I220-H224 PolarHBondContact O-CD2 2.93Å; I220-H224 PolarHBondContact O-N 3.37Å; I220-Y252 HydrophobicContact CG2-CD2 3.53Å; I220-Y252 HydrophobicContact CG2-CE2 3.44Å; I220-Y252 VanDerWaalsContact CG2-CE2 3.44Å; I220-Q256 HydrophobicContact CG2-CG 3.99Å
221	D	78.3	Confident	83.8	Confident	76 Å²	76	42.1 Å²	42.1	41%	0.406	19%	0.194	S	C	.	.	H	α-helix	trans	-44.9	-40.1	178.1	-20	-43	0	0	0	114.1	R219 I223 H224	R219-D221 IonicContact CZ-OD2 3.59Å; R219-D221 IonicContact NE-OD2 2.66Å; R219-D221 PolarHBondContact NE-OD2 3.49Å; R219-D221 IonicContact NH2-OD2 2.76Å; R219-D221 PolarHBondContact NH2-OD2 2.98Å; R219-D221 PolarHBondContact O-N 3.45Å; R219-D221 VanDerWaalsContact O-N 3.14Å; D221-I223 PolarHBondContact O-N 3.39Å; D221-H224 PolarHBondContact O-N 3.45Å
222	L	80.9	Confident	83.7	Confident	13 Å²	13	46.2 Å²	46.2	7%	0.068	22%	0.216	C	C	.	.	H	α-helix	trans	-67.5	-27.7	-179.2	-59.5	174.6	0	0	0	112.1	I190 E194 L197 F212 R219 I220 N226	I190-L222 HydrophobicContact CG2-CD1 4Å; E194-L222 HydrophobicContact CB-CD2 4.12Å; E194-L222 HydrophobicContact CG-CD2 3.92Å; L197-L222 HydrophobicContact CD1-CB 4Å; F212-L222 HydrophobicContact CD2-CD1 4.39Å; F212-L222 HydrophobicContact CE2-CB 4.19Å; F212-L222 HydrophobicContact CE2-CD1 4.17Å; R219-L222 HydrophobicContact CB-CD1 4.21Å; R219-L222 PolarHBondContact O-N 3.12Å; I220-L222 PolarHBondContact O-N 3.47Å; L222-N226 PolarHBondContact O-ND2 3.16Å
223	I	84.8	Confident	83.5	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-84.7	-38.3	178.1	-54.6	-55.7	0	0	0	111.3	L197 F212 I220 D221 R225 N226 Y227 M248 Y252	L197-I223 HydrophobicContact CD1-CD1 4.35Å; L197-I223 HydrophobicContact CD2-CD1 4.49Å; F212-I223 HydrophobicContact CD1-CD1 3.97Å; F212-I223 HydrophobicContact CD1-CG1 4.31Å; F212-I223 HydrophobicContact CD2-CD1 4.19Å; F212-I223 HydrophobicContact CE1-CD1 3.85Å; F212-I223 HydrophobicContact CE1-CG1 3.66Å; F212-I223 HydrophobicContact CE2-CD1 4.07Å; F212-I223 HydrophobicContact CE2-CG1 3.99Å; F212-I223 HydrophobicContact CG-CD1 4.15Å; F212-I223 HydrophobicContact CZ-CD1 3.91Å; F212-I223 HydrophobicContact CZ-CG1 3.48Å; F212-I223 VanDerWaalsContact CZ-CG1 3.48Å; I220-I223 WeakPolarHBondContact O-CA 3.46Å; I220-I223 WeakPolarHBondContact O-CB 3.48Å; I220-I223 PolarHBondContact O-N 2.7Å; D221-I223 PolarHBondContact O-N 3.39Å; I223-R225 VanDerWaalsContact C-N 3.3Å; I223-R225 PolarHBondContact O-N 3.16Å; I223-N226 CarbonylContact O-C 3.56Å; I223-N226 PolarHBondContact O-N 2.93Å; I223-Y227 WeakPolarHBondContact O-CA 3.39Å; I223-Y227 WeakPolarHBondContact O-CB 3.37Å; I223-Y227 PolarHBondContact O-N 2.86Å; I223-M248 HydrophobicContact CD1-CE 3.91Å; I223-M248 HydrophobicContact CD1-SD 4.16Å; I223-M248 HydrophobicContact CG1-CE 4.39Å; I223-M248 HydrophobicContact CG1-SD 4.04Å; I223-M248 HydrophobicContact CG2-CE 4.05Å; I223-M248 HydrophobicContact CG2-SD 3.89Å; I223-Y252 HydrophobicContact CB-CD2 3.94Å; I223-Y252 HydrophobicContact CB-CE2 4.03Å; I223-Y252 HydrophobicContact CG2-CD2 3.54Å; I223-Y252 HydrophobicContact CG2-CE2 3.8Å; I223-Y252 HydrophobicContact CG2-CG 4.28Å
224	H	82.8	Confident	83.6	Confident	10 Å²	10	45.5 Å²	45.5	5%	0.046	21%	0.214	C	C	.	.	H	α-helix	trans	-48.6	-52.4	178.4	-78.7	-104.9	0	0	0	111.9	I220 D221 N226 Y227 Y252 Q256 V662 R663	I220-H224 PolarHBondContact O-CD2 2.93Å; I220-H224 PolarHBondContact O-N 3.37Å; D221-H224 PolarHBondContact O-N 3.45Å; H224-N226 PolarHBondContact O-N 3.4Å; H224-N226 VanDerWaalsContact O-N 3.16Å; H224-Y227 PolarHBondContact O-N 2.66Å; H224-Y252 AromaticContact CD2-CE2 3.88Å; H224-Y252 PolarHBondContact CE1-OH 2.99Å; H224-Y252 VanDerWaalsContact CE1-OH 3.3Å; H224-Y252 VanDerWaalsContact CG-OH 3.28Å; H224-Y252 PolarHBondContact ND1-OH 3.2Å; H224-Q256 PolarHBondContact CE1-OE1 2.93Å; H224-Q256 PolarHBondContact NE2-OE1 2.83Å; H224-V662 HydrophobicContact CB-CG1 3.9Å; H224-V662 WeakPolarHBondContact CB-O 3.31Å; H224-R663 HydrophobicContact CB-CG 4.35Å
225	R	81.1	Confident	83.7	Confident	124 Å²	124	43.3 Å²	43.3	47%	0.468	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-17.4	-178.8	-65.8	166.8	73.2	-155.9	6.5	113.9	E194 I223 V665	E194-R225 IonicContact OE1-CZ 3.37Å; E194-R225 IonicContact OE1-NH1 3.36Å; E194-R225 PolarHBondContact OE1-NH1 3.33Å; E194-R225 IonicContact OE1-NH2 3.35Å; I223-R225 VanDerWaalsContact C-N 3.3Å; I223-R225 PolarHBondContact O-N 3.16Å; R225-V665 HydrophobicContact CB-CG2 3.71Å; R225-V665 HydrophobicContact CG-CG2 3.98Å; R225-V665 WeakPolarHBondContact O-CG2 3.47Å
226	N	85.1	Confident	83.9	Confident	13 Å²	13	48.8 Å²	48.8	7%	0.07	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-1.3	-178.5	-67.4	-76.1	0	0	0	113.3	L197 L222 I223 H224 K229 L230	L197-N226 PolarHBondContact O-OD1 3.39Å; L222-N226 PolarHBondContact O-ND2 3.16Å; I223-N226 CarbonylContact O-C 3.56Å; I223-N226 PolarHBondContact O-N 2.93Å; H224-N226 PolarHBondContact O-N 3.4Å; H224-N226 VanDerWaalsContact O-N 3.16Å; N226-K229 WeakPolarHBondContact O-CB 3.43Å; N226-K229 PolarHBondContact O-N 2.89Å; N226-L230 HydrophobicContact CB-CD1 4.4Å; N226-L230 WeakPolarHBondContact O-CG 3.43Å; N226-L230 PolarHBondContact O-N 3.03Å
227	Y	86.7	Confident	84.4	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-57.7	-58	-168.5	177.2	-91.7	0	0	0	112.4	I223 H224 K229 L230 C231 L249 Y252 F257 D296 L300	I223-Y227 WeakPolarHBondContact O-CA 3.39Å; I223-Y227 WeakPolarHBondContact O-CB 3.37Å; I223-Y227 PolarHBondContact O-N 2.86Å; H224-Y227 PolarHBondContact O-N 2.66Å; Y227-K229 PolarHBondContact O-N 3.44Å; Y227-L230 PolarHBondContact O-N 3.16Å; Y227-L230 VanDerWaalsContact O-N 3.09Å; Y227-C231 PolarHBondContact O-N 3.16Å; Y227-C231 PolarHBondContact O-SG 2.89Å; Y227-C231 VanDerWaalsContact O-SG 3.36Å; Y227-L249 HydrophobicContact CD2-CD2 3.7Å; Y227-L249 HydrophobicContact CE2-CD2 3.72Å; Y227-Y252 AromaticContact CD2-CD1 3.61Å; Y227-Y252 HydrophobicContact CD2-CD1 3.61Å; Y227-Y252 AromaticContact CD2-CE1 3.38Å; Y227-Y252 HydrophobicContact CD2-CE1 3.38Å; Y227-Y252 HydrophobicContact CD2-CG 4.3Å; Y227-Y252 AromaticContact CD2-CZ 3.91Å; Y227-Y252 AromaticContact CE2-CD1 3.42Å; Y227-Y252 HydrophobicContact CE2-CD1 3.42Å; Y227-Y252 VanDerWaalsContact CE2-CD1 3.42Å; Y227-Y252 AromaticContact CE2-CE1 3.45Å; Y227-Y252 HydrophobicContact CE2-CE1 3.45Å; Y227-Y252 VanDerWaalsContact CE2-CE1 3.45Å; Y227-Y252 HydrophobicContact CE2-CG 4.36Å; Y227-Y252 HydrophobicContact CG-CE1 4.2Å; Y227-F257 HydrophobicContact CE1-CZ 4.37Å; Y227-F257 HydrophobicContact CE2-CZ 4.49Å; Y227-F257 AromaticContact CZ-CZ 3.88Å; Y227-F257 WeakPolarHBondContact OH-CE2 3.46Å; Y227-F257 WeakPolarHBondContact OH-CZ 3.45Å; Y227-D296 HydrophobicContact CD1-CB 4.28Å; Y227-D296 HydrophobicContact CE1-CB 3.74Å; Y227-D296 PolarHBondContact OH-O 2.94Å; Y227-D296 VanDerWaalsContact OH-O 3.11Å; Y227-L300 WeakPolarHBondContact OH-CB 3.29Å; Y227-L300 WeakPolarHBondContact OH-CD2 3.42Å
228	R	87.1	Confident	85.1	Confident	80 Å²	80	50.4 Å²	50.4	30%	0.302	24%	0.242	S	C	.	.	H	α-helix	trans	-59.4	-36.5	-179.3	-62.3	179.6	-174.3	140.4	8.6	112.4	N232 D296 L299 R663 N664	R228-N232 WeakPolarHBondContact O-CB 3.38Å; R228-N232 VanDerWaalsContact O-CG 3.27Å; R228-N232 PolarHBondContact O-N 3.33Å; R228-N232 PolarHBondContact O-ND2 3.02Å; R228-D296 WeakPolarHBondContact CD-OD1 3.34Å; R228-D296 VanDerWaalsContact CG-OD1 3.29Å; R228-D296 WeakPolarHBondContact CG-OD1 3.44Å; R228-D296 IonicContact CZ-OD1 2.81Å; R228-D296 IonicContact CZ-OD2 2.68Å; R228-D296 VanDerWaalsContact NE-CG 3.34Å; R228-D296 IonicContact NE-OD1 3.08Å; R228-D296 PolarHBondContact NE-OD1 3.26Å; R228-D296 IonicContact NE-OD2 2.72Å; R228-D296 PolarHBondContact NE-OD2 3.18Å; R228-D296 VanDerWaalsContact NE-OD2 3.13Å; R228-D296 IonicContact NH2-OD1 3.19Å; R228-D296 IonicContact NH2-OD2 3.05Å; R228-D296 PolarHBondContact NH2-OD2 3.11Å; R228-L299 HydrophobicContact CB-CD2 4.2Å; R228-L299 HydrophobicContact CG-CD2 4.09Å; R228-R663 PolarHBondContact NH1-O 3.16Å; R228-N664 PolarHBondContact NH1-OD1 2.89Å; R228-N664 PolarHBondContact NH2-OD1 3.47Å
229	K	87.6	Confident	85.9	Confident	60 Å²	60	48.4 Å²	48.4	26%	0.261	23%	0.228	S	C	.	.	H	α-helix	trans	-65.1	-47.7	175.4	172.2	-171	170	-166.4	0	111.2	L197 K198 D199 N226 Y227 N232 L233	L197-K229 PolarHBondContact O-NZ 3.34Å; K198-K229 PolarHBondContact O-NZ 3.42Å; D199-K229 VanDerWaalsContact O-CE 3.28Å; D199-K229 WeakPolarHBondContact O-CE 3.17Å; D199-K229 PolarHBondContact O-NZ 3.19Å; N226-K229 WeakPolarHBondContact O-CB 3.43Å; N226-K229 PolarHBondContact O-N 2.89Å; Y227-K229 PolarHBondContact O-N 3.44Å; K229-N232 PolarHBondContact O-N 3.1Å; K229-L233 HydrophobicContact CG-CD1 3.82Å; K229-L233 HydrophobicContact CG-CG 4.44Å; K229-L233 WeakPolarHBondContact O-CB 3.17Å; K229-L233 VanDerWaalsContact O-CG 3.3Å; K229-L233 WeakPolarHBondContact O-CG 3.16Å; K229-L233 PolarHBondContact O-N 2.95Å
230	L	88	Confident	86.5	Confident	8 Å²	8	51.6 Å²	51.6	4%	0.042	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-43.5	175.8	-70.1	172.6	0	0	0	111.4	A205 V209 N226 Y227 N232 L233 L234 M248	A205-L230 HydrophobicContact CB-CD2 4.5Å; V209-L230 HydrophobicContact CG2-CD1 4.39Å; V209-L230 HydrophobicContact CG2-CD2 4.35Å; N226-L230 HydrophobicContact CB-CD1 4.4Å; N226-L230 WeakPolarHBondContact O-CG 3.43Å; N226-L230 PolarHBondContact O-N 3.03Å; Y227-L230 PolarHBondContact O-N 3.16Å; Y227-L230 VanDerWaalsContact O-N 3.09Å; L230-N232 VanDerWaalsContact C-N 3.33Å; L230-N232 PolarHBondContact O-N 2.91Å; L230-L233 PolarHBondContact O-N 2.88Å; L230-L234 WeakPolarHBondContact O-CB 3.41Å; L230-L234 PolarHBondContact O-N 2.8Å; L230-L234 VanDerWaalsContact O-N 3.08Å; L230-M248 HydrophobicContact CD1-CE 3.91Å
231	C	88.6	Confident	87.2	Confident	0 Å²	0	50 Å²	50	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-38.1	175.7	-67.4	0	0	0	0	113.1	Y227 L299 N303	Y227-C231 PolarHBondContact O-N 3.16Å; Y227-C231 PolarHBondContact O-SG 2.89Å; Y227-C231 VanDerWaalsContact O-SG 3.36Å; C231-L299 HydrophobicContact CB-CD2 4.28Å; C231-L299 HydrophobicContact CB-CG 4.26Å; C231-N303 VanDerWaalsContact C-ND2 3.34Å; C231-N303 WeakPolarHBondContact O-CB 3.43Å; C231-N303 PolarHBondContact O-ND2 3.07Å
232	N	89	Confident	87.9	Confident	87 Å²	87	47 Å²	47	47%	0.465	22%	0.216	S	C	.	.	H	α-helix	trans	-77.2	-41.9	179.1	-73.3	-20.5	0	0	0	112.5	R228 K229 L230 L234 N303	R228-N232 WeakPolarHBondContact O-CB 3.38Å; R228-N232 VanDerWaalsContact O-CG 3.27Å; R228-N232 PolarHBondContact O-N 3.33Å; R228-N232 PolarHBondContact O-ND2 3.02Å; K229-N232 PolarHBondContact O-N 3.1Å; L230-N232 VanDerWaalsContact C-N 3.33Å; L230-N232 PolarHBondContact O-N 2.91Å; N232-L234 PolarHBondContact O-N 3.49Å; N232-N303 PolarHBondContact OD1-ND2 3.43Å
233	L	88.5	Confident	88.5	Confident	40 Å²	40	47.7 Å²	47.7	21%	0.209	22%	0.221	C	C	.	.	H	α-helix	trans	-71.5	-16.1	178.5	-68.3	176	0	0	0	113.6	T202 K229 L230 V235 D236 V237	T202-L233 HydrophobicContact CG2-CB 4.41Å; T202-L233 HydrophobicContact CG2-CD2 3.98Å; K229-L233 HydrophobicContact CG-CD1 3.82Å; K229-L233 HydrophobicContact CG-CG 4.44Å; K229-L233 WeakPolarHBondContact O-CB 3.17Å; K229-L233 VanDerWaalsContact O-CG 3.3Å; K229-L233 WeakPolarHBondContact O-CG 3.16Å; K229-L233 PolarHBondContact O-N 2.95Å; L230-L233 PolarHBondContact O-N 2.88Å; L233-V235 PolarHBondContact O-N 3.16Å; L233-V235 VanDerWaalsContact O-N 3.09Å; L233-D236 PolarHBondContact O-N 2.93Å; L233-V237 WeakPolarHBondContact O-CG2 3.49Å; L233-V237 PolarHBondContact O-N 3Å
234	L	88.8	Confident	88.8	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-53	-36.1	-170.3	-174.5	62.4	0	0	0	114.2	L230 N232 D236 Q242 I245 I246 T304 L307	L230-L234 WeakPolarHBondContact O-CB 3.41Å; L230-L234 PolarHBondContact O-N 2.8Å; L230-L234 VanDerWaalsContact O-N 3.08Å; N232-L234 PolarHBondContact O-N 3.49Å; L234-D236 VanDerWaalsContact C-N 3.29Å; L234-D236 PolarHBondContact O-N 3.28Å; L234-Q242 HydrophobicContact CD1-CB 4.33Å; L234-Q242 HydrophobicContact CD1-CG 4.29Å; L234-Q242 WeakPolarHBondContact O-CG 3.32Å; L234-Q242 PolarHBondContact O-NE2 2.99Å; L234-I245 HydrophobicContact CD1-CB 3.87Å; L234-I245 HydrophobicContact CD1-CD1 4.37Å; L234-I245 HydrophobicContact CD1-CG2 3.74Å; L234-I246 HydrophobicContact CD1-CG1 4.3Å; L234-I246 HydrophobicContact CD2-CD1 4.38Å; L234-I246 HydrophobicContact CD2-CG1 3.94Å; L234-T304 HydrophobicContact CD2-CG2 3.54Å; L234-L307 HydrophobicContact CD2-CD1 3.83Å; L234-L307 HydrophobicContact CG-CD1 3.91Å
235	V	88.3	Confident	89.2	Confident	70 Å²	70	48.5 Å²	48.5	42%	0.424	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-67.2	-31.5	-179.9	-176.6	0	0	0	0	112	L233 Q242	L233-V235 PolarHBondContact O-N 3.16Å; L233-V235 VanDerWaalsContact O-N 3.09Å; V235-Q242 PolarHBondContact O-NE2 3.11Å
236	D	89.8	Confident	89.7	Confident	115 Å²	115	42.6 Å²	42.6	62%	0.615	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-97.2	-0.2	-175.3	-57.7	-41.6	0	0	0	113.6	T202 L233 L234	T202-D236 WeakPolarHBondContact CB-O 3.34Å; T202-D236 HydrophobicContact CG2-CB 3.85Å; T202-D236 PolarHBondContact OG1-O 3.1Å; L233-D236 PolarHBondContact O-N 2.93Å; L234-D236 VanDerWaalsContact C-N 3.29Å; L234-D236 PolarHBondContact O-N 3.28Å
237	V	91.1	Very high	90	Very high	7 Å²	7	43.9 Å²	43.9	4%	0.042	21%	0.211	C	C	.	.	S	Bend	trans	-83	149.2	173.4	173.8	0	0	0	0	110.4	T202 A205 L233 Q242 I245	T202-V237 HydrophobicContact CG2-CG2 4.37Å; A205-V237 HydrophobicContact CB-CG2 4.25Å; L233-V237 WeakPolarHBondContact O-CG2 3.49Å; L233-V237 PolarHBondContact O-N 3Å; V237-Q242 HydrophobicContact CB-CG 4.39Å; V237-Q242 WeakPolarHBondContact O-CG 3.02Å; V237-Q242 PolarHBondContact O-NE2 3.08Å; V237-I245 HydrophobicContact CB-CD1 4.48Å; V237-I245 HydrophobicContact CG1-CD1 3.96Å; V237-I245 HydrophobicContact CG2-CD1 4.25Å
238	E	91.1	Very high	90.1	Very high	73 Å²	73	44.3 Å²	44.3	34%	0.341	21%	0.213	S	C	.	.			trans	-58.8	148.9	176.2	72.7	-171.2	-173.6	0	0	112.8	K169 W240 G241 Q242	K169-E238 IonicContact NZ-OE1 2.75Å; K169-E238 PolarHBondContact NZ-OE1 3.26Å; K169-E238 IonicContact NZ-OE2 3.26Å; K169-E238 PolarHBondContact NZ-OE2 3.21Å; E238-W240 VanDerWaalsContact C-N 3.26Å; E238-W240 PolarHBondContact O-N 3.34Å; E238-W240 VanDerWaalsContact O-N 3.08Å; E238-G241 CarbonylContact O-C 3.52Å; E238-G241 WeakPolarHBondContact O-CA 3.22Å; E238-G241 PolarHBondContact O-N 3.09Å; E238-Q242 PolarHBondContact O-N 3.35Å
239	E	90.9	Very high	90.2	Very high	84 Å²	84	40.5 Å²	40.5	39%	0.393	20%	0.199	S	C	.	.	H	α-helix	trans	-54.6	-36	-171.5	-54.2	-175.7	144.7	0	0	114.2	Q242 V243 N312 V315	E239-Q242 PolarHBondContact O-N 3.27Å; E239-V243 PolarHBondContact O-N 3.34Å; E239-N312 HydrophobicContact CB-CB 4.36Å; E239-N312 VanDerWaalsContact CD-CB 3.49Å; E239-N312 HydrophobicContact CG-CB 4.35Å; E239-N312 WeakPolarHBondContact OE2-CB 3.46Å; E239-N312 PolarHBondContact OE2-ND2 3.3Å; E239-V315 HydrophobicContact CB-CG2 4.1Å
240	W	91.2	Very high	90.2	Very high	186 Å²	186	37.7 Å²	37.7	71%	0.705	19%	0.187	S	C	*	.	H	α-helix	trans	-67.7	-40.5	175.5	-58.3	108.2	0	0	0	112.4	E238 V244	E238-W240 VanDerWaalsContact C-N 3.26Å; E238-W240 PolarHBondContact O-N 3.34Å; E238-W240 VanDerWaalsContact O-N 3.08Å; W240-V244 PolarHBondContact O-N 3.43Å
241	G	91.9	Very high	90	Very high	2 Å²	2	40 Å²	40	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-67.4	-36.8	174	0	0	0	0	0	112.1	E238 V243 V244 I245	E238-G241 CarbonylContact O-C 3.52Å; E238-G241 WeakPolarHBondContact O-CA 3.22Å; E238-G241 PolarHBondContact O-N 3.09Å; G241-V243 PolarHBondContact O-N 3.37Å; G241-V244 PolarHBondContact O-N 3.05Å; G241-I245 WeakPolarHBondContact O-CB 3.41Å; G241-I245 WeakPolarHBondContact O-CG1 3.39Å; G241-I245 PolarHBondContact O-N 3.45Å
242	Q	93.2	Very high	89.8	Confident	14 Å²	14	40.4 Å²	40.4	7%	0.065	20%	0.197	C	C	.	.	H	α-helix	trans	-57.1	-48.2	175.8	-68.8	-179.3	-6.4	0	0	111.8	L234 V235 V237 E238 E239 V244 I245 I246 V315	L234-Q242 HydrophobicContact CD1-CB 4.33Å; L234-Q242 HydrophobicContact CD1-CG 4.29Å; L234-Q242 WeakPolarHBondContact O-CG 3.32Å; L234-Q242 PolarHBondContact O-NE2 2.99Å; V235-Q242 PolarHBondContact O-NE2 3.11Å; V237-Q242 HydrophobicContact CB-CG 4.39Å; V237-Q242 WeakPolarHBondContact O-CG 3.02Å; V237-Q242 PolarHBondContact O-NE2 3.08Å; E238-Q242 PolarHBondContact O-N 3.35Å; E239-Q242 PolarHBondContact O-N 3.27Å; Q242-V244 PolarHBondContact O-N 3.13Å; Q242-I245 PolarHBondContact O-N 3.37Å; Q242-I246 WeakPolarHBondContact O-CB 3.47Å; Q242-I246 WeakPolarHBondContact O-CD1 3.08Å; Q242-I246 WeakPolarHBondContact O-CG1 3.4Å; Q242-I246 PolarHBondContact O-N 2.9Å; Q242-V315 HydrophobicContact CB-CG1 4.5Å; Q242-V315 HydrophobicContact CB-CG2 4.17Å
243	V	92.5	Very high	89.6	Confident	27 Å²	27	36.3 Å²	36.3	16%	0.164	17%	0.174	C	C	.	.	H	α-helix	trans	-58.7	-47.6	178.9	173.4	0	0	0	0	111.6	E239 G241 I246 N247 A314 V315 A318	E239-V243 PolarHBondContact O-N 3.34Å; G241-V243 PolarHBondContact O-N 3.37Å; V243-I246 PolarHBondContact O-N 3.46Å; V243-N247 VanDerWaalsContact O-CG 3.31Å; V243-N247 PolarHBondContact O-N 2.92Å; V243-A314 HydrophobicContact CG2-CB 3.9Å; V243-V315 HydrophobicContact CG2-CG2 3.94Å; V243-A318 HydrophobicContact CG1-CB 4.25Å; V243-A318 HydrophobicContact CG2-CB 4.44Å
244	V	91.1	Very high	89.2	Confident	28 Å²	28	35.7 Å²	35.7	17%	0.17	17%	0.169	C	C	.	.	H	α-helix	trans	-68.7	-44	-177.6	177.7	0	0	0	0	111.4	V209 V210 W240 G241 Q242 I246 N247 M248	V209-V244 HydrophobicContact CG1-CG1 4.17Å; V210-V244 HydrophobicContact CB-CG1 4.43Å; V210-V244 HydrophobicContact CG2-CB 4.25Å; V210-V244 HydrophobicContact CG2-CG1 3.85Å; V210-V244 HydrophobicContact CG2-CG2 4.06Å; W240-V244 PolarHBondContact O-N 3.43Å; G241-V244 PolarHBondContact O-N 3.05Å; Q242-V244 PolarHBondContact O-N 3.13Å; V244-I246 VanDerWaalsContact C-N 3.31Å; V244-I246 PolarHBondContact O-N 2.98Å; V244-N247 PolarHBondContact O-N 3.17Å; V244-M248 WeakPolarHBondContact O-CB 3.33Å; V244-M248 PolarHBondContact O-N 3.5Å
245	I	91.9	Very high	88.7	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-61.8	-41.2	176.1	-64.5	166.7	0	0	0	110.3	V209 L234 V237 G241 Q242 L249	V209-I245 HydrophobicContact CB-CG1 4.08Å; V209-I245 HydrophobicContact CG1-CG1 4.28Å; V209-I245 HydrophobicContact CG2-CG1 4.03Å; L234-I245 HydrophobicContact CD1-CB 3.87Å; L234-I245 HydrophobicContact CD1-CD1 4.37Å; L234-I245 HydrophobicContact CD1-CG2 3.74Å; V237-I245 HydrophobicContact CB-CD1 4.48Å; V237-I245 HydrophobicContact CG1-CD1 3.96Å; V237-I245 HydrophobicContact CG2-CD1 4.25Å; G241-I245 WeakPolarHBondContact O-CB 3.41Å; G241-I245 WeakPolarHBondContact O-CG1 3.39Å; G241-I245 PolarHBondContact O-N 3.45Å; Q242-I245 PolarHBondContact O-N 3.37Å; I245-L249 HydrophobicContact CG2-CD1 3.56Å; I245-L249 HydrophobicContact CG2-CG 4.05Å; I245-L249 VanDerWaalsContact O-CB 3.24Å; I245-L249 WeakPolarHBondContact O-CB 3.32Å; I245-L249 WeakPolarHBondContact O-CG 3.46Å; I245-L249 PolarHBondContact O-N 2.83Å
246	I	92.1	Very high	88	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-42.3	175.9	-70.4	162.1	0	0	0	111.4	L234 Q242 V243 V244 L249 T250 T304 L307 A318 V319 L322	L234-I246 HydrophobicContact CD1-CG1 4.3Å; L234-I246 HydrophobicContact CD2-CD1 4.38Å; L234-I246 HydrophobicContact CD2-CG1 3.94Å; Q242-I246 WeakPolarHBondContact O-CB 3.47Å; Q242-I246 WeakPolarHBondContact O-CD1 3.08Å; Q242-I246 WeakPolarHBondContact O-CG1 3.4Å; Q242-I246 PolarHBondContact O-N 2.9Å; V243-I246 PolarHBondContact O-N 3.46Å; V244-I246 VanDerWaalsContact C-N 3.31Å; V244-I246 PolarHBondContact O-N 2.98Å; I246-L249 PolarHBondContact O-N 2.86Å; I246-T250 WeakPolarHBondContact O-CB 3.47Å; I246-T250 PolarHBondContact O-N 3.39Å; I246-T250 PolarHBondContact O-OG1 3.01Å; I246-T304 HydrophobicContact CG1-CG2 4.39Å; I246-L307 HydrophobicContact CD1-CD1 4.04Å; I246-A318 HydrophobicContact CB-CB 4.22Å; I246-A318 HydrophobicContact CD1-CB 4.41Å; I246-A318 HydrophobicContact CG2-CB 3.86Å; I246-A318 WeakPolarHBondContact CG2-O 3.41Å; I246-V319 HydrophobicContact CD1-CG2 3.7Å; I246-L322 HydrophobicContact CG2-CB 3.92Å; I246-L322 HydrophobicContact CG2-CD1 4.24Å; I246-L322 HydrophobicContact CG2-CD2 4.38Å; I246-L322 HydrophobicContact CG2-CG 4.42Å
247	N	89.9	Confident	87.5	Confident	39 Å²	39	29.6 Å²	29.6	21%	0.209	14%	0.135	C	C	.	.	H	α-helix	trans	-64.8	-46.5	178.1	-72.6	-13.3	0	0	0	112.1	V243 V244 T250 R251	V243-N247 VanDerWaalsContact O-CG 3.31Å; V243-N247 PolarHBondContact O-N 2.92Å; V244-N247 PolarHBondContact O-N 3.17Å; N247-T250 WeakPolarHBondContact O-CB 3.41Å; N247-T250 PolarHBondContact O-N 3.24Å; N247-R251 PolarHBondContact O-N 2.63Å
248	M	89	Confident	86.7	Confident	10 Å²	10	30.8 Å²	30.8	5%	0.049	14%	0.142	C	C	.	.	H	α-helix	trans	-61.2	-47	175	-178.4	-79.9	-71.7	0	0	111.2	V209 F212 I223 L230 V244 T250 R251 Y252	V209-M248 HydrophobicContact CG1-CB 3.75Å; V209-M248 HydrophobicContact CG1-CE 3.65Å; V209-M248 HydrophobicContact CG1-CG 3.85Å; V209-M248 HydrophobicContact CG2-CE 4.12Å; F212-M248 HydrophobicContact CD1-CG 4.28Å; F212-M248 HydrophobicContact CE1-CG 4.26Å; I223-M248 HydrophobicContact CD1-CE 3.91Å; I223-M248 HydrophobicContact CD1-SD 4.16Å; I223-M248 HydrophobicContact CG1-CE 4.39Å; I223-M248 HydrophobicContact CG1-SD 4.04Å; I223-M248 HydrophobicContact CG2-CE 4.05Å; I223-M248 HydrophobicContact CG2-SD 3.89Å; L230-M248 HydrophobicContact CD1-CE 3.91Å; V244-M248 WeakPolarHBondContact O-CB 3.33Å; V244-M248 PolarHBondContact O-N 3.5Å; M248-T250 PolarHBondContact O-N 3.06Å; M248-R251 PolarHBondContact O-N 3.2Å; M248-R251 VanDerWaalsContact O-N 3.14Å; M248-Y252 PolarHBondContact O-N 3.29Å
249	L	89.3	Confident	85.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.6	-26.2	176.2	-67.9	176.1	0	0	0	112.7	Y227 I245 I246 A253 L300	Y227-L249 HydrophobicContact CD2-CD2 3.7Å; Y227-L249 HydrophobicContact CE2-CD2 3.72Å; I245-L249 HydrophobicContact CG2-CD1 3.56Å; I245-L249 HydrophobicContact CG2-CG 4.05Å; I245-L249 VanDerWaalsContact O-CB 3.24Å; I245-L249 WeakPolarHBondContact O-CB 3.32Å; I245-L249 WeakPolarHBondContact O-CG 3.46Å; I245-L249 PolarHBondContact O-N 2.83Å; I246-L249 PolarHBondContact O-N 2.86Å; L249-A253 WeakPolarHBondContact O-CB 3.17Å; L249-A253 PolarHBondContact O-N 3.29Å; L249-L300 HydrophobicContact CB-CD1 4.22Å; L249-L300 HydrophobicContact CB-CD2 4.21Å; L249-L300 HydrophobicContact CD1-CD1 3.86Å
250	T	87.9	Confident	84.2	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-65.5	-42.2	172.6	-55.4	0	0	0	0	111.2	I246 N247 M248 R254 L322 H325 L326 L650	I246-T250 WeakPolarHBondContact O-CB 3.47Å; I246-T250 PolarHBondContact O-N 3.39Å; I246-T250 PolarHBondContact O-OG1 3.01Å; N247-T250 WeakPolarHBondContact O-CB 3.41Å; N247-T250 PolarHBondContact O-N 3.24Å; M248-T250 PolarHBondContact O-N 3.06Å; T250-R254 PolarHBondContact O-N 3.03Å; T250-L322 VanDerWaalsContact OG1-CD1 3.25Å; T250-L322 WeakPolarHBondContact OG1-CD1 3.46Å; T250-H325 HydrophobicContact CG2-CB 4.46Å; T250-L326 HydrophobicContact CG2-CD1 4.37Å; T250-L650 HydrophobicContact CG2-CD1 4.35Å
251	R	84.8	Confident	82.8	Confident	57 Å²	57	20 Å²	20	22%	0.215	10%	0.1	C	C	.	.	H	α-helix	trans	-71.5	-46.1	178	-67.5	164.9	168.7	-159.7	-19.1	111.3	E213 N247 M248 A253 R254 T255 L650	E213-R251 IonicContact OE1-CZ 3.22Å; E213-R251 IonicContact OE1-NH1 2.9Å; E213-R251 PolarHBondContact OE1-NH1 2.89Å; N247-R251 PolarHBondContact O-N 2.63Å; M248-R251 PolarHBondContact O-N 3.2Å; M248-R251 VanDerWaalsContact O-N 3.14Å; R251-A253 PolarHBondContact O-N 2.95Å; R251-R254 PolarHBondContact O-N 2.72Å; R251-T255 PolarHBondContact O-N 2.92Å; R251-T255 VanDerWaalsContact O-N 3.16Å; R251-T255 PolarHBondContact O-OG1 3.01Å; R251-L650 HydrophobicContact CG-CD1 3.98Å
252	Y	84.8	Confident	81	Confident	9 Å²	9	25.8 Å²	25.8	4%	0.035	12%	0.124	C	C	.	.	H	α-helix	trans	-53.1	-51	171.7	-179.4	-80.5	0	0	0	111.4	I220 I223 H224 Y227 M248 R254 T255 Q256 R663	I220-Y252 HydrophobicContact CG2-CD2 3.53Å; I220-Y252 HydrophobicContact CG2-CE2 3.44Å; I220-Y252 VanDerWaalsContact CG2-CE2 3.44Å; I223-Y252 HydrophobicContact CB-CD2 3.94Å; I223-Y252 HydrophobicContact CB-CE2 4.03Å; I223-Y252 HydrophobicContact CG2-CD2 3.54Å; I223-Y252 HydrophobicContact CG2-CE2 3.8Å; I223-Y252 HydrophobicContact CG2-CG 4.28Å; H224-Y252 AromaticContact CD2-CE2 3.88Å; H224-Y252 PolarHBondContact CE1-OH 2.99Å; H224-Y252 VanDerWaalsContact CE1-OH 3.3Å; H224-Y252 VanDerWaalsContact CG-OH 3.28Å; H224-Y252 PolarHBondContact ND1-OH 3.2Å; Y227-Y252 AromaticContact CD2-CD1 3.61Å; Y227-Y252 HydrophobicContact CD2-CD1 3.61Å; Y227-Y252 AromaticContact CD2-CE1 3.38Å; Y227-Y252 HydrophobicContact CD2-CE1 3.38Å; Y227-Y252 HydrophobicContact CD2-CG 4.3Å; Y227-Y252 AromaticContact CD2-CZ 3.91Å; Y227-Y252 AromaticContact CE2-CD1 3.42Å; Y227-Y252 HydrophobicContact CE2-CD1 3.42Å; Y227-Y252 VanDerWaalsContact CE2-CD1 3.42Å; Y227-Y252 AromaticContact CE2-CE1 3.45Å; Y227-Y252 HydrophobicContact CE2-CE1 3.45Å; Y227-Y252 VanDerWaalsContact CE2-CE1 3.45Å; Y227-Y252 HydrophobicContact CE2-CG 4.36Å; Y227-Y252 HydrophobicContact CG-CE1 4.2Å; M248-Y252 PolarHBondContact O-N 3.29Å; Y252-R254 VanDerWaalsContact C-N 3.25Å; Y252-R254 PolarHBondContact O-N 3.41Å; Y252-T255 PolarHBondContact O-N 2.71Å; Y252-T255 VanDerWaalsContact O-N 3.13Å; Y252-T255 PolarHBondContact O-OG1 3Å; Y252-T255 VanDerWaalsContact O-OG1 3.11Å; Y252-Q256 HydrophobicContact CD1-CB 4.12Å; Y252-Q256 HydrophobicContact CD1-CG 4.18Å; Y252-Q256 HydrophobicContact CD2-CG 4.18Å; Y252-Q256 HydrophobicContact CE1-CB 3.74Å; Y252-Q256 HydrophobicContact CE1-CG 3.91Å; Y252-Q256 HydrophobicContact CE2-CG 3.9Å; Y252-Q256 HydrophobicContact CG-CG 4.28Å; Y252-Q256 VanDerWaalsContact O-CB 3.23Å; Y252-Q256 WeakPolarHBondContact O-CB 3.26Å; Y252-Q256 WeakPolarHBondContact O-CG 3.43Å; Y252-Q256 PolarHBondContact O-N 2.85Å; Y252-R663 PolarHBondContact OH-NE 3.1Å; Y252-R663 VanDerWaalsContact OH-NE 3.14Å
253	A	83.3	Confident	78.7	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.4	-29.8	-177.3	0	0	0	0	0	113.1	L249 R251 F257 L300 L326	L249-A253 WeakPolarHBondContact O-CB 3.17Å; L249-A253 PolarHBondContact O-N 3.29Å; R251-A253 PolarHBondContact O-N 2.95Å; A253-F257 HydrophobicContact CB-CD2 3.69Å; A253-F257 HydrophobicContact CB-CE2 3.76Å; A253-F257 WeakPolarHBondContact O-CD2 3.36Å; A253-F257 PolarHBondContact O-N 3.31Å; A253-L300 HydrophobicContact CB-CD2 4.17Å; A253-L326 HydrophobicContact CB-CD1 3.57Å; A253-L326 HydrophobicContact CB-CD2 3.7Å; A253-L326 HydrophobicContact CB-CG 4.31Å
254	R	79.8	Confident	76	Confident	28 Å²	28	37.9 Å²	37.9	11%	0.106	18%	0.184	C	C	.	.	H	α-helix	trans	-72.5	-33.1	173.4	-82.7	-58.8	-164.9	96.5	-10.5	114	T250 R251 Y252 H325 L326 L650 S651 W653 P654	T250-R254 PolarHBondContact O-N 3.03Å; R251-R254 PolarHBondContact O-N 2.72Å; Y252-R254 VanDerWaalsContact C-N 3.25Å; Y252-R254 PolarHBondContact O-N 3.41Å; R254-H325 PolarHBondContact NE-O 2.89Å; R254-H325 PolarHBondContact NH2-O 2.74Å; R254-L326 HydrophobicContact CG-CD2 3.91Å; R254-L650 HydrophobicContact CB-CD1 4.18Å; R254-L650 HydrophobicContact CB-CG 4.48Å; R254-L650 HydrophobicContact CG-CD1 3.83Å; R254-L650 HydrophobicContact CG-CD2 3.96Å; R254-L650 HydrophobicContact CG-CG 3.86Å; R254-S651 PolarHBondContact NH1-O 2.98Å; R254-W653 VanDerWaalsContact CD-CE2 3.44Å; R254-W653 VanDerWaalsContact NE-CE2 3.33Å; R254-W653 VanDerWaalsContact NE-CZ2 3.32Å; R254-P654 WeakPolarHBondContact O-CD 3.48Å
255	T	78.6	Confident	73.2	Confident	36 Å²	36	38 Å²	38	22%	0.221	19%	0.191	C	C	.	.	H	α-helix	trans	-87.9	-17.7	178.3	53.4	0	0	0	0	113.8	R251 Y252	R251-T255 PolarHBondContact O-N 2.92Å; R251-T255 VanDerWaalsContact O-N 3.16Å; R251-T255 PolarHBondContact O-OG1 3.01Å; Y252-T255 PolarHBondContact O-N 2.71Å; Y252-T255 VanDerWaalsContact O-N 3.13Å; Y252-T255 PolarHBondContact O-OG1 3Å; Y252-T255 VanDerWaalsContact O-OG1 3.11Å
256	Q	75.1	Confident	70.4	Confident	17 Å²	17	46.2 Å²	46.2	8%	0.079	23%	0.233	C	C	.	.	H	α-helix	trans	-118.7	-7.7	-167.8	-62.7	-60	-40.5	0	0	116.2	I220 H224 Y252 R663	I220-Q256 HydrophobicContact CG2-CG 3.99Å; H224-Q256 PolarHBondContact CE1-OE1 2.93Å; H224-Q256 PolarHBondContact NE2-OE1 2.83Å; Y252-Q256 HydrophobicContact CD1-CB 4.12Å; Y252-Q256 HydrophobicContact CD1-CG 4.18Å; Y252-Q256 HydrophobicContact CD2-CG 4.18Å; Y252-Q256 HydrophobicContact CE1-CB 3.74Å; Y252-Q256 HydrophobicContact CE1-CG 3.91Å; Y252-Q256 HydrophobicContact CE2-CG 3.9Å; Y252-Q256 HydrophobicContact CG-CG 4.28Å; Y252-Q256 VanDerWaalsContact O-CB 3.23Å; Y252-Q256 WeakPolarHBondContact O-CB 3.26Å; Y252-Q256 WeakPolarHBondContact O-CG 3.43Å; Y252-Q256 PolarHBondContact O-N 2.85Å; Q256-R663 PolarHBondContact O-NH2 3.13Å
257	F	78.8	Confident	67.8	Low	4 Å²	4	52.7 Å²	52.7	2%	0.018	26%	0.262	C	S	.	.	S	Bend	trans	-122.6	152.6	173.1	-54.8	-66.2	0	0	0	110.7	Y227 A253 D294 D296 H297 W653 P654	Y227-F257 HydrophobicContact CE1-CZ 4.37Å; Y227-F257 HydrophobicContact CE2-CZ 4.49Å; Y227-F257 AromaticContact CZ-CZ 3.88Å; Y227-F257 WeakPolarHBondContact OH-CE2 3.46Å; Y227-F257 WeakPolarHBondContact OH-CZ 3.45Å; A253-F257 HydrophobicContact CB-CD2 3.69Å; A253-F257 HydrophobicContact CB-CE2 3.76Å; A253-F257 WeakPolarHBondContact O-CD2 3.36Å; A253-F257 PolarHBondContact O-N 3.31Å; F257-D294 HydrophobicContact CD1-CB 3.9Å; F257-D294 VanDerWaalsContact CD1-OD2 3.26Å; F257-D294 WeakPolarHBondContact CD1-OD2 3.45Å; F257-D294 HydrophobicContact CE1-CB 4.1Å; F257-D294 WeakPolarHBondContact CE1-OD2 3.33Å; F257-D296 HydrophobicContact CE1-CB 4.07Å; F257-D296 HydrophobicContact CZ-CB 4.09Å; F257-H297 HydrophobicContact CD1-CB 3.95Å; F257-H297 HydrophobicContact CD2-CB 3.88Å; F257-H297 AromaticContact CD2-CG 3.63Å; F257-H297 AromaticContact CD2-ND1 3.59Å; F257-H297 HydrophobicContact CE1-CB 3.87Å; F257-H297 HydrophobicContact CE2-CB 3.84Å; F257-H297 AromaticContact CE2-CG 3.92Å; F257-H297 HydrophobicContact CG-CB 3.96Å; F257-H297 AromaticContact CG-CG 3.93Å; F257-H297 AromaticContact CG-ND1 3.64Å; F257-H297 HydrophobicContact CZ-CB 3.83Å; F257-W653 VanDerWaalsContact O-CE3 3.27Å; F257-P654 WeakPolarHBondContact O-CD 3.5Å; F257-P654 WeakPolarHBondContact O-CG 3.36Å
258	T	72.9	Confident	64.9	Low	32 Å²	32	57.1 Å²	57.1	20%	0.196	29%	0.285	C	S	.	.			trans	-70.5	152.2	168.5	48.6	0	0	0	0	111.5	P260 Y291 A657	T258-P260 WeakPolarHBondContact O-CD 3.4Å; T258-Y291 PolarHBondContact O-OH 3.5Å; T258-A657 HydrophobicContact CG2-CB 4.21Å
259	S	65.3	Low	62.6	Low	22 Å²	22	65.9 Å²	65.9	15%	0.154	33%	0.326	C	S	.	.			trans	-56.3	118.9	178.6	59.7	0	0	0	0	113.5	W261	S259-W261 PolarHBondContact O-N 2.87Å
260	P	65.3	Low	59.8	Low	13 Å²	13	69.8 Å²	69.8	8%	0.084	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	26.3	170	-19.2	34.9	0	0	0	114.6	T258 Y291 M293 P328 W653	T258-P260 WeakPolarHBondContact O-CD 3.4Å; P260-Y291 HydrophobicContact CB-CE1 4.39Å; P260-M293 HydrophobicContact CB-CE 4.01Å; P260-M293 HydrophobicContact CB-SD 3.9Å; P260-M293 HydrophobicContact CG-CE 3.6Å; P260-M293 HydrophobicContact CG-SD 3.62Å; P260-P328 HydrophobicContact CB-CG 4.31Å; P260-W653 HydrophobicContact CG-CH2 4.15Å
261	W	60.9	Low	57.2	Low	80 Å²	80	78.3 Å²	78.3	30%	0.303	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-1.2	-171.4	-54.3	68.8	0	0	0	111.7	S259 R364 W653	S259-W261 PolarHBondContact O-N 2.87Å; W261-R364 VanDerWaalsContact CZ3-NH2 3.25Å; W261-W653 AromaticContact CD1-CZ2 3.89Å; W261-W653 AromaticContact NE1-CZ2 3.61Å
262	K	55.4	Low	54.9	Low	124 Å²	124	85.8 Å²	85.8	54%	0.539	43%	0.427	S	S	.	.			trans	-62.8	137.6	167.1	-69.5	-174.6	179	-179.9	0	108.6
263	E	43.4	Very low	52.5	Low	147 Å²	147	89.9 Å²	89.9	69%	0.687	46%	0.463	S	S	*	.	S	Bend	trans	-96.8	-7.4	-159.5	-146.1	136.3	-124.1	0	0	113.7	G265 K329	E263-G265 PolarHBondContact O-N 2.98Å; E263-K329 IonicContact OE1-NZ 2.76Å; E263-K329 PolarHBondContact OE1-NZ 3.26Å
264	D	35.8	Very low	50.4	Low	149 Å²	149	98.3 Å²	98.3	80%	0.797	50%	0.5	S	S	*	.			trans	-79.8	60.9	178.4	-53.5	-63.3	0	0	0	112.2
265	G	34	Very low	48.4	Very low	31 Å²	31	106.5 Å²	106.5	32%	0.32	53%	0.533	S	S	.	.			trans	-144.5	71.7	-177.1	0	0	0	0	0	111.9	E263 F267	E263-G265 PolarHBondContact O-N 2.98Å; G265-F267 WeakPolarHBondContact O-CD2 3.3Å; G265-F267 PolarHBondContact O-N 2.84Å
266	I	32.8	Very low	46	Very low	172 Å²	172	112.2 Å²	112.2	88%	0.882	56%	0.562	S	S	*	*			trans	-68.4	100	167.4	-59.4	175.4	0	0	0	107.4	D268	I266-D268 PolarHBondContact O-N 2.84Å
267	F	36.3	Very low	43.8	Very low	137 Å²	137	115.7 Å²	115.7	60%	0.601	59%	0.588	S	S	*	*			trans	-83.3	108.6	168.6	-79.7	-88.6	0	0	0	108.4	G265 E269	G265-F267 WeakPolarHBondContact O-CD2 3.3Å; G265-F267 PolarHBondContact O-N 2.84Å; F267-E269 PolarHBondContact O-N 2.94Å
268	D	30.1	Very low	41.6	Very low	132 Å²	132	122.7 Å²	122.7	71%	0.706	63%	0.626	S	S	*	*			trans	-78.2	107.2	176.7	-166.5	13.5	0	0	0	110.2	I266 S270	I266-D268 PolarHBondContact O-N 2.84Å; D268-S270 PolarHBondContact O-N 2.82Å
269	E	41.1	Very low	39.5	Very low	194 Å²	194	127.2 Å²	127.2	91%	0.907	66%	0.658	S	S	*	*			trans	-80.2	56.2	166.5	-75.8	-165	129.2	0	0	110.3	F267 E271	F267-E269 PolarHBondContact O-N 2.94Å; E269-E271 PolarHBondContact O-N 2.73Å
270	S	29.1	Very low	37.8	Very low	82 Å²	82	135.1 Å²	135.1	57%	0.573	69%	0.693	S	S	*	*			trans	-78.7	100.5	173.5	68.5	0	0	0	0	110.4	D268	D268-S270 PolarHBondContact O-N 2.82Å
271	E	34.3	Very low	36.1	Very low	179 Å²	179	142.5 Å²	142.5	84%	0.836	73%	0.726	S	S	*	*			trans	-56.3	150.8	161.6	-64.5	-170.1	128.5	0	0	110	E269 A273	E269-E271 PolarHBondContact O-N 2.73Å; E271-A273 VanDerWaalsContact C-N 3.26Å; E271-A273 PolarHBondContact O-N 3.28Å
272	K	36.7	Very low	34.6	Very low	213 Å²	213	148.1 Å²	148.1	93%	0.926	75%	0.753	S	S	*	*			trans	-70.7	79	179.4	-76.6	-171.4	173.2	-174.7	0	112	F274	K272-F274 PolarHBondContact O-N 3.14Å
273	A	32.9	Very low	33.3	Very low	96 Å²	96	150.9 Å²	150.9	79%	0.793	77%	0.768	S	S	*	*			trans	-70.4	92	168.7	0	0	0	0	0	110.1	E271 Y275	E271-A273 VanDerWaalsContact C-N 3.26Å; E271-A273 PolarHBondContact O-N 3.28Å; A273-Y275 PolarHBondContact O-N 2.91Å
274	F	40.4	Very low	32.9	Very low	176 Å²	176	147.7 Å²	147.7	77%	0.772	77%	0.774	S	S	*	*			trans	-68.4	92.6	173.3	170	-95.5	0	0	0	110.2	K272	K272-F274 PolarHBondContact O-N 3.14Å
275	Y	37.3	Very low	32.6	Very low	201 Å²	201	149.7 Å²	149.7	79%	0.788	78%	0.778	S	S	*	*			trans	-178.7	147.7	142.2	-107.5	-68.8	0	0	0	114.9	A273	A273-Y275 PolarHBondContact O-N 2.91Å
276	D	28	Very low	32.4	Very low	156 Å²	156	160 Å²	160	83%	0.834	81%	0.808	S	S	*	*			trans	87.9	158.3	154	-127.6	-16.8	0	0	0	121.1
277	S	29.3	Very low	32.3	Very low	90 Å²	90	160.8 Å²	160.8	63%	0.629	81%	0.808	S	S	*	*			trans	-117.8	160.5	-149.1	-75.2	0	0	0	0	117.7
278	D	32.5	Very low	32.1	Very low	151 Å²	151	158.5 Å²	158.5	81%	0.807	81%	0.814	S	S	*	*			trans	41.8	104.7	144	-53.9	-32.4	0	0	0	120.1
279	S	28.3	Very low	32.2	Very low	127 Å²	127	161.5 Å²	161.5	89%	0.888	82%	0.821	S	S	*	*			trans	-156.4	135.9	143.8	-57.1	0	0	0	0	110.5
280	E	29.4	Very low	32	Very low	188 Å²	188	156.8 Å²	156.8	88%	0.879	81%	0.807	S	S	*	*			trans	-92.2	158.9	-175.8	-69.8	-173.7	130	0	0	115.1
281	E	30.1	Very low	33.1	Very low	167 Å²	167	156 Å²	156	78%	0.78	79%	0.792	S	S	*	*			trans	54.2	118.4	158.3	-69.1	-165.1	166.7	0	0	121.7
282	K	28.5	Very low	34.1	Very low	198 Å²	198	154.3 Å²	154.3	86%	0.861	79%	0.787	S	S	*	*				-157.9	99.8	117.7	-111	155.6	-168.9	162.4	0	114.9
283	Q	28.1	Very low	35.5	Very low	183 Å²	183	145.4 Å²	145.4	86%	0.855	75%	0.749	S	S	*	*			trans	30.1	118.5	145.5	-63.5	178	-14.1	0	0	120
284	G	35.3	Very low	37.5	Very low	79 Å²	79	142.5 Å²	142.5	81%	0.814	72%	0.72	S	S	*	*				100	52.6	124.3	0	0	0	0	0	119
285	Q	30.6	Very low	39.3	Very low	191 Å²	191	138.9 Å²	138.9	89%	0.893	71%	0.714	S	S	*	*			trans	-124.7	144.9	156.6	-70.9	-169.3	-15.7	0	0	110.9	E287	Q285-E287 PolarHBondContact O-N 3.47Å
286	R	29.8	Very low	41.3	Very low	247 Å²	247	129.7 Å²	129.7	93%	0.932	68%	0.679	S	S	*	*			trans	-65.3	131.4	175.7	-74.7	175.6	168.7	166.2	-6.2	109.3	A288	R286-A288 PolarHBondContact O-N 2.91Å
287	E	30.2	Very low	43.9	Very low	190 Å²	190	122.3 Å²	122.3	89%	0.888	64%	0.639	S	S	*	*			trans	-62.7	103.2	174.2	-64.3	-175.1	156.5	0	0	110.5	Q285 K289	Q285-E287 PolarHBondContact O-N 3.47Å; E287-K289 PolarHBondContact O-N 3.41Å
288	A	31.7	Very low	46.6	Very low	88 Å²	88	124.2 Å²	124.2	73%	0.727	63%	0.633	S	S	*	*			trans	-70.9	98.7	171.1	0	0	0	0	0	108.5	R286 P290	R286-A288 PolarHBondContact O-N 2.91Å; A288-P290 WeakPolarHBondContact O-CD 3.32Å; A288-P290 VanDerWaalsContact O-N 3.09Å
289	K	32.1	Very low	49.2	Very low	195 Å²	195	118.1 Å²	118.1	85%	0.848	60%	0.6	S	S	*	*			trans	-51	117.4	175.5	-68.1	-177.8	179.3	179.2	0	108.8	E287	E287-K289 PolarHBondContact O-N 3.41Å
290	P	37.2	Very low	52.1	Low	95 Å²	95	112.1 Å²	112.1	62%	0.617	56%	0.558	S	S	*	*			trans	-61.2	143.7	-175.5	23.9	-33.6	0	0	0	110.3	A288 I292	A288-P290 WeakPolarHBondContact O-CD 3.32Å; A288-P290 VanDerWaalsContact O-N 3.09Å; P290-I292 VanDerWaalsContact C-N 3.35Å; P290-I292 PolarHBondContact O-N 2.66Å
291	Y	51.3	Low	54.9	Low	66 Å²	66	103.2 Å²	103.2	26%	0.259	52%	0.517	S	S	.	.			trans	-67.6	89.6	-176.3	-178.3	-99	0	0	0	111.7	T258 P260 M293	T258-Y291 PolarHBondContact O-OH 3.5Å; P260-Y291 HydrophobicContact CB-CE1 4.39Å; Y291-M293 HydrophobicContact CE1-CB 4.34Å; Y291-M293 HydrophobicContact CE1-SD 4.1Å; Y291-M293 PolarHBondContact O-N 2.7Å
292	I	55.9	Low	57.7	Low	144 Å²	144	103 Å²	103	74%	0.738	51%	0.508	S	S	*	.			trans	-77.5	103.6	171.3	-63	166.4	0	0	0	107.7	P290 D294	P290-I292 VanDerWaalsContact C-N 3.35Å; P290-I292 PolarHBondContact O-N 2.66Å; I292-D294 PolarHBondContact O-N 2.67Å
293	M	66	Low	60.6	Low	26 Å²	26	94.6 Å²	94.6	13%	0.128	47%	0.473	C	S	.	.			trans	-54.3	131.3	172.2	-177.7	77.7	145.8	0	0	111	P260 Y291 H297 L301 P328	P260-M293 HydrophobicContact CB-CE 4.01Å; P260-M293 HydrophobicContact CB-SD 3.9Å; P260-M293 HydrophobicContact CG-CE 3.6Å; P260-M293 HydrophobicContact CG-SD 3.62Å; Y291-M293 HydrophobicContact CE1-CB 4.34Å; Y291-M293 HydrophobicContact CE1-SD 4.1Å; Y291-M293 PolarHBondContact O-N 2.7Å; M293-H297 HydrophobicContact CE-CB 4.22Å; M293-H297 WeakPolarHBondContact CE-ND1 3.35Å; M293-H297 HydrophobicContact CG-CB 4.47Å; M293-H297 HydrophobicContact SD-CB 4.43Å; M293-L301 HydrophobicContact CE-CD1 3.92Å; M293-P328 HydrophobicContact CE-CG 4.13Å
294	D	74.4	Confident	63.6	Low	34 Å²	34	85.9 Å²	85.9	18%	0.182	43%	0.432	C	S	.	.			trans	-46.9	125.8	178.4	-176	-33.2	0	0	0	111.1	F257 I292 D296 H297 R298 R663	F257-D294 HydrophobicContact CD1-CB 3.9Å; F257-D294 VanDerWaalsContact CD1-OD2 3.26Å; F257-D294 WeakPolarHBondContact CD1-OD2 3.45Å; F257-D294 HydrophobicContact CE1-CB 4.1Å; F257-D294 WeakPolarHBondContact CE1-OD2 3.33Å; I292-D294 PolarHBondContact O-N 2.67Å; D294-D296 PolarHBondContact O-N 3.24Å; D294-D296 WeakPolarHBondContact OD1-CB 3.44Å; D294-D296 PolarHBondContact OD1-N 3.03Å; D294-H297 HydrophobicContact CB-CB 4.09Å; D294-H297 WeakPolarHBondContact O-CB 3.46Å; D294-H297 PolarHBondContact O-N 3.49Å; D294-R298 PolarHBondContact O-N 3.17Å; D294-R663 IonicContact OD1-NH1 2.66Å; D294-R663 IonicContact OD2-CZ 3.67Å; D294-R663 IonicContact OD2-NH1 3.64Å; D294-R663 PolarHBondContact OD2-NH1 3.24Å; D294-R663 IonicContact OD2-NH2 2.66Å
295	P	78.3	Confident	66.2	Low	100 Å²	100	87.4 Å²	87.4	65%	0.649	42%	0.416	S	S	*	.	H	α-helix	trans	-52.2	-34.6	178.1	-28.9	36.1	0	0	0	114.4	R298 L299	P295-R298 PolarHBondContact O-N 3.34Å; P295-L299 WeakPolarHBondContact O-CB 3.01Å; P295-L299 PolarHBondContact O-N 3.05Å
296	D	80.4	Confident	69.1	Low	9 Å²	9	81.6 Å²	81.6	5%	0.048	40%	0.395	C	S	.	.	H	α-helix	trans	-72.5	-34.8	177.6	-81.8	-33.2	0	0	0	112.1	Y227 R228 F257 D294 L299 L300 R663	Y227-D296 HydrophobicContact CD1-CB 4.28Å; Y227-D296 HydrophobicContact CE1-CB 3.74Å; Y227-D296 PolarHBondContact OH-O 2.94Å; Y227-D296 VanDerWaalsContact OH-O 3.11Å; R228-D296 WeakPolarHBondContact CD-OD1 3.34Å; R228-D296 VanDerWaalsContact CG-OD1 3.29Å; R228-D296 WeakPolarHBondContact CG-OD1 3.44Å; R228-D296 IonicContact CZ-OD1 2.81Å; R228-D296 IonicContact CZ-OD2 2.68Å; R228-D296 VanDerWaalsContact NE-CG 3.34Å; R228-D296 IonicContact NE-OD1 3.08Å; R228-D296 PolarHBondContact NE-OD1 3.26Å; R228-D296 IonicContact NE-OD2 2.72Å; R228-D296 PolarHBondContact NE-OD2 3.18Å; R228-D296 VanDerWaalsContact NE-OD2 3.13Å; R228-D296 IonicContact NH2-OD1 3.19Å; R228-D296 IonicContact NH2-OD2 3.05Å; R228-D296 PolarHBondContact NH2-OD2 3.11Å; F257-D296 HydrophobicContact CE1-CB 4.07Å; F257-D296 HydrophobicContact CZ-CB 4.09Å; D294-D296 PolarHBondContact O-N 3.24Å; D294-D296 WeakPolarHBondContact OD1-CB 3.44Å; D294-D296 PolarHBondContact OD1-N 3.03Å; D296-L299 WeakPolarHBondContact O-CB 3.24Å; D296-L299 PolarHBondContact O-N 3.14Å; D296-L300 PolarHBondContact O-N 3.5Å; D296-R663 WeakPolarHBondContact OD2-CD 3.36Å; D296-R663 IonicContact OD2-NH1 2.68Å
297	H	83.1	Confident	72	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-67.6	-41.8	171.7	-162.5	167.2	0	0	0	110.5	F257 M293 D294 L299 L300 L301	F257-H297 HydrophobicContact CD1-CB 3.95Å; F257-H297 HydrophobicContact CD2-CB 3.88Å; F257-H297 AromaticContact CD2-CG 3.63Å; F257-H297 AromaticContact CD2-ND1 3.59Å; F257-H297 HydrophobicContact CE1-CB 3.87Å; F257-H297 HydrophobicContact CE2-CB 3.84Å; F257-H297 AromaticContact CE2-CG 3.92Å; F257-H297 HydrophobicContact CG-CB 3.96Å; F257-H297 AromaticContact CG-CG 3.93Å; F257-H297 AromaticContact CG-ND1 3.64Å; F257-H297 HydrophobicContact CZ-CB 3.83Å; M293-H297 HydrophobicContact CE-CB 4.22Å; M293-H297 WeakPolarHBondContact CE-ND1 3.35Å; M293-H297 HydrophobicContact CG-CB 4.47Å; M293-H297 HydrophobicContact SD-CB 4.43Å; D294-H297 HydrophobicContact CB-CB 4.09Å; D294-H297 WeakPolarHBondContact O-CB 3.46Å; D294-H297 PolarHBondContact O-N 3.49Å; H297-L299 VanDerWaalsContact C-N 3.33Å; H297-L299 PolarHBondContact O-N 2.9Å; H297-L300 PolarHBondContact O-N 2.71Å; H297-L301 PolarHBondContact O-N 3.31Å
298	R	85.9	Confident	74.9	Confident	130 Å²	130	61.6 Å²	61.6	49%	0.491	31%	0.313	S	S	.	.	H	α-helix	trans	-69.2	-29.6	176.9	-164.5	158	-176.7	72.1	-8.3	112.5	D294 P295 R302 E331	D294-R298 PolarHBondContact O-N 3.17Å; P295-R298 PolarHBondContact O-N 3.34Å; R298-R302 VanDerWaalsContact O-CB 3.29Å; R298-R302 WeakPolarHBondContact O-CB 3.4Å; R298-R302 PolarHBondContact O-N 3.04Å; R298-E331 IonicContact CZ-OE1 3.67Å; R298-E331 IonicContact NH1-OE1 3.13Å; R298-E331 PolarHBondContact NH1-OE1 3.35Å; R298-E331 IonicContact NH2-OE1 3.76Å
299	L	86.7	Confident	77.8	Confident	23 Å²	23	65.3 Å²	65.3	12%	0.12	32%	0.315	C	S	.	.	H	α-helix	trans	-61.4	-46.8	171.3	177.9	63.8	0	0	0	111.7	R228 C231 P295 D296 H297 R302 N303	R228-L299 HydrophobicContact CB-CD2 4.2Å; R228-L299 HydrophobicContact CG-CD2 4.09Å; C231-L299 HydrophobicContact CB-CD2 4.28Å; C231-L299 HydrophobicContact CB-CG 4.26Å; P295-L299 WeakPolarHBondContact O-CB 3.01Å; P295-L299 PolarHBondContact O-N 3.05Å; D296-L299 WeakPolarHBondContact O-CB 3.24Å; D296-L299 PolarHBondContact O-N 3.14Å; H297-L299 VanDerWaalsContact C-N 3.33Å; H297-L299 PolarHBondContact O-N 2.9Å; L299-R302 PolarHBondContact O-N 3.3Å; L299-N303 WeakPolarHBondContact O-CB 3.44Å; L299-N303 PolarHBondContact O-N 3.14Å; L299-N303 PolarHBondContact O-OD1 2.88Å
300	L	88.4	Confident	80.5	Confident	1 Å²	1	57 Å²	57	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-60.4	-46.6	177.9	175	57.2	0	0	0	112.2	Y227 L249 A253 D296 H297 T304 L322	Y227-L300 WeakPolarHBondContact OH-CB 3.29Å; Y227-L300 WeakPolarHBondContact OH-CD2 3.42Å; L249-L300 HydrophobicContact CB-CD1 4.22Å; L249-L300 HydrophobicContact CB-CD2 4.21Å; L249-L300 HydrophobicContact CD1-CD1 3.86Å; A253-L300 HydrophobicContact CB-CD2 4.17Å; D296-L300 PolarHBondContact O-N 3.5Å; H297-L300 PolarHBondContact O-N 2.71Å; L300-T304 HydrophobicContact CD1-CG2 3.97Å; L300-T304 WeakPolarHBondContact O-CB 3.14Å; L300-T304 VanDerWaalsContact O-CG2 3.32Å; L300-T304 WeakPolarHBondContact O-CG2 3.21Å; L300-T304 PolarHBondContact O-N 3.22Å; L300-T304 VanDerWaalsContact O-N 3.08Å; L300-T304 PolarHBondContact O-OG1 3.27Å; L300-L322 HydrophobicContact CD2-CD1 4.16Å; L300-L322 HydrophobicContact CG-CD1 4.44Å
301	L	88.6	Confident	83	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-64.4	-43.6	176.1	-65.2	175.4	0	0	0	111.5	M293 H297 N303 T304 K305 Y323 A327	M293-L301 HydrophobicContact CE-CD1 3.92Å; H297-L301 PolarHBondContact O-N 3.31Å; L301-N303 PolarHBondContact O-N 2.95Å; L301-T304 PolarHBondContact O-N 3.07Å; L301-T304 PolarHBondContact O-OG1 3.32Å; L301-K305 PolarHBondContact O-N 3.28Å; L301-Y323 HydrophobicContact CD2-CD2 4.36Å; L301-Y323 HydrophobicContact CD2-CE1 4.38Å; L301-Y323 HydrophobicContact CD2-CE2 4.23Å; L301-Y323 PolarHBondContact O-OH 2.97Å; L301-Y323 VanDerWaalsContact O-OH 3.09Å; L301-A327 HydrophobicContact CD1-CB 4.3Å; L301-A327 HydrophobicContact CD2-CB 4.08Å
302	R	89	Confident	85	Confident	162 Å²	162	62 Å²	62	61%	0.611	29%	0.29	S	S	*	.	H	α-helix	trans	-59	-46.7	177.8	-174.3	-176.3	71.8	-179.1	2.3	112.3	R298 L299	R298-R302 VanDerWaalsContact O-CB 3.29Å; R298-R302 WeakPolarHBondContact O-CB 3.4Å; R298-R302 PolarHBondContact O-N 3.04Å; L299-R302 PolarHBondContact O-N 3.3Å
303	N	89.7	Confident	86.7	Confident	22 Å²	22	56.6 Å²	56.6	12%	0.118	26%	0.264	C	S	.	.	H	α-helix	trans	-79.6	-20.3	-173.9	-66.2	11.4	0	0	0	112.8	C231 N232 L299 L301 P306	C231-N303 VanDerWaalsContact C-ND2 3.34Å; C231-N303 WeakPolarHBondContact O-CB 3.43Å; C231-N303 PolarHBondContact O-ND2 3.07Å; N232-N303 PolarHBondContact OD1-ND2 3.43Å; L299-N303 WeakPolarHBondContact O-CB 3.44Å; L299-N303 PolarHBondContact O-N 3.14Å; L299-N303 PolarHBondContact O-OD1 2.88Å; L301-N303 PolarHBondContact O-N 2.95Å; N303-P306 WeakPolarHBondContact O-CD 3.37Å
304	T	90.4	Very high	87.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-88	-22.9	174.3	52.7	0	0	0	0	113.5	L234 I246 L300 L301 P306 L307 L322	L234-T304 HydrophobicContact CD2-CG2 3.54Å; I246-T304 HydrophobicContact CG1-CG2 4.39Å; L300-T304 HydrophobicContact CD1-CG2 3.97Å; L300-T304 WeakPolarHBondContact O-CB 3.14Å; L300-T304 VanDerWaalsContact O-CG2 3.32Å; L300-T304 WeakPolarHBondContact O-CG2 3.21Å; L300-T304 PolarHBondContact O-N 3.22Å; L300-T304 VanDerWaalsContact O-N 3.08Å; L300-T304 PolarHBondContact O-OG1 3.27Å; L301-T304 PolarHBondContact O-N 3.07Å; L301-T304 PolarHBondContact O-OG1 3.32Å; T304-P306 VanDerWaalsContact C-CD 3.41Å; T304-L307 HydrophobicContact CG2-CD1 4.49Å; T304-L307 WeakPolarHBondContact O-CB 3.5Å; T304-L307 PolarHBondContact O-N 3.29Å; T304-L322 HydrophobicContact CG2-CD2 3.67Å; T304-L322 WeakPolarHBondContact OG1-CD2 3.36Å
305	K	91.1	Very high	88.8	Confident	110 Å²	110	55.7 Å²	55.7	48%	0.478	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-48.9	-41.6	176.5	-168.3	173.1	-179.3	172.9	0	115.2	L301 L307 L308 Y323	L301-K305 PolarHBondContact O-N 3.28Å; K305-L307 VanDerWaalsContact C-N 3.31Å; K305-L307 PolarHBondContact O-N 3.15Å; K305-L308 PolarHBondContact O-N 3.13Å; K305-Y323 WeakPolarHBondContact CB-OH 3.25Å
306	P	91.3	Very high	89.5	Confident	70 Å²	70	50.9 Å²	50.9	46%	0.455	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-65.9	-31.9	177.2	-20.8	34.3	0	0	0	113.2	N303 T304 L308 Q309	N303-P306 WeakPolarHBondContact O-CD 3.37Å; T304-P306 VanDerWaalsContact C-CD 3.41Å; P306-L308 PolarHBondContact O-N 2.85Å; P306-L308 VanDerWaalsContact O-N 3.17Å; P306-Q309 WeakPolarHBondContact O-CB 3.2Å; P306-Q309 PolarHBondContact O-N 3.32Å
307	L	91.1	Very high	90	Very high	11 Å²	11	51.3 Å²	51.3	6%	0.058	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-67.3	-17	-176	-58	176.5	0	0	0	112.7	L234 I246 T304 K305 Q309 S310 V315 V319	L234-L307 HydrophobicContact CD2-CD1 3.83Å; L234-L307 HydrophobicContact CG-CD1 3.91Å; I246-L307 HydrophobicContact CD1-CD1 4.04Å; T304-L307 HydrophobicContact CG2-CD1 4.49Å; T304-L307 WeakPolarHBondContact O-CB 3.5Å; T304-L307 PolarHBondContact O-N 3.29Å; K305-L307 VanDerWaalsContact C-N 3.31Å; K305-L307 PolarHBondContact O-N 3.15Å; L307-Q309 PolarHBondContact O-N 3.41Å; L307-Q309 VanDerWaalsContact O-N 3.17Å; L307-S310 VanDerWaalsContact O-CB 3.23Å; L307-S310 WeakPolarHBondContact O-CB 3.38Å; L307-S310 PolarHBondContact O-N 3.36Å; L307-S310 PolarHBondContact O-OG 3.05Å; L307-V315 HydrophobicContact CB-CG1 3.94Å; L307-V319 HydrophobicContact CB-CG2 3.76Å; L307-V319 HydrophobicContact CD1-CG2 4.45Å
308	L	91.2	Very high	90.4	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.026	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-59.9	-18.4	166.7	-70.8	174.1	0	0	0	113.5	K305 P306 V316 V319 I334 V335 S338 R341	K305-L308 PolarHBondContact O-N 3.13Å; P306-L308 PolarHBondContact O-N 2.85Å; P306-L308 VanDerWaalsContact O-N 3.17Å; L308-V316 HydrophobicContact CD2-CG1 4.44Å; L308-V319 HydrophobicContact CD2-CB 3.96Å; L308-V319 HydrophobicContact CD2-CG1 3.62Å; L308-V319 HydrophobicContact CG-CB 4.44Å; L308-V319 HydrophobicContact CG-CG1 3.73Å; L308-I334 HydrophobicContact CD1-CG2 4.01Å; L308-V335 HydrophobicContact CD1-CG2 4.43Å; L308-V335 HydrophobicContact CD2-CG1 4.47Å; L308-V335 HydrophobicContact CD2-CG2 4.4Å; L308-S338 WeakPolarHBondContact O-CB 3.29Å; L308-S338 PolarHBondContact O-OG 3.43Å; L308-R341 PolarHBondContact O-NH2 3.26Å
309	Q	91.1	Very high	90.7	Very high	166 Å²	166	45.3 Å²	45.3	78%	0.776	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-95	-2.2	175.5	-55	-168.2	18	0	0	113.5	P306 L307	P306-Q309 WeakPolarHBondContact O-CB 3.2Å; P306-Q309 PolarHBondContact O-N 3.32Å; L307-Q309 PolarHBondContact O-N 3.41Å; L307-Q309 VanDerWaalsContact O-N 3.17Å
310	S	90.4	Very high	90.9	Very high	22 Å²	22	44.2 Å²	44.2	15%	0.154	21%	0.209	C	C	.	.			trans	-59.4	155.4	-178.3	62.2	0	0	0	0	113.2	L307 N312 V316 R341	L307-S310 VanDerWaalsContact O-CB 3.23Å; L307-S310 WeakPolarHBondContact O-CB 3.38Å; L307-S310 PolarHBondContact O-N 3.36Å; L307-S310 PolarHBondContact O-OG 3.05Å; S310-N312 PolarHBondContact OG-O 2.91Å; S310-V316 VanDerWaalsContact OG-CG2 3.27Å; S310-V316 WeakPolarHBondContact OG-CG2 3.26Å; S310-R341 PolarHBondContact O-NH1 3.1Å; S310-R341 PolarHBondContact O-NH2 2.67Å
311	R	88.9	Confident	91	Very high	236 Å²	236	44.8 Å²	44.8	89%	0.891	21%	0.211	S	C	*	.	S	Bend	trans	-75.1	-38.5	178	-65.1	-178.5	-179.3	-180	0.8	111.3	T313	R311-T313 PolarHBondContact O-N 3.13Å
312	N	92.1	Very high	91.1	Very high	30 Å²	30	44.7 Å²	44.7	16%	0.16	21%	0.211	C	C	.	.			trans	-71	122.6	178.5	-169.5	-34.1	0	0	0	111.5	E239 S310 A314 V315 V316	E239-N312 HydrophobicContact CB-CB 4.36Å; E239-N312 VanDerWaalsContact CD-CB 3.49Å; E239-N312 HydrophobicContact CG-CB 4.35Å; E239-N312 WeakPolarHBondContact OE2-CB 3.46Å; E239-N312 PolarHBondContact OE2-ND2 3.3Å; S310-N312 PolarHBondContact OG-O 2.91Å; N312-A314 VanDerWaalsContact C-N 3.32Å; N312-A314 PolarHBondContact O-N 3.24Å; N312-A314 WeakPolarHBondContact OD1-CB 3.18Å; N312-A314 PolarHBondContact OD1-N 2.76Å; N312-V315 HydrophobicContact CB-CG2 4.1Å; N312-V315 PolarHBondContact O-N 3.26Å; N312-V316 PolarHBondContact O-N 2.92Å
313	T	92.2	Very high	91.1	Very high	30 Å²	30	37 Å²	37	18%	0.184	18%	0.182	C	C	.	.	H	α-helix	trans	-62.7	-37.5	179.7	-64.9	0	0	0	0	112.1	R311 V315 V316 M317 L342 V349	R311-T313 PolarHBondContact O-N 3.13Å; T313-V315 VanDerWaalsContact C-N 3.33Å; T313-V315 PolarHBondContact O-N 3.28Å; T313-V316 PolarHBondContact O-N 2.93Å; T313-M317 HydrophobicContact CG2-CG 4.29Å; T313-M317 WeakPolarHBondContact O-CG 3.36Å; T313-M317 PolarHBondContact O-N 2.78Å; T313-L342 HydrophobicContact CG2-CD1 4.04Å; T313-L342 HydrophobicContact CG2-CD2 4.12Å; T313-V349 HydrophobicContact CG2-CB 4.29Å; T313-V349 HydrophobicContact CG2-CG1 3.35Å; T313-V349 HydrophobicContact CG2-CG2 3.99Å
314	A	91.6	Very high	90.9	Very high	40 Å²	40	36.7 Å²	36.7	33%	0.331	18%	0.179	S	C	.	.	H	α-helix	trans	-64.6	-38.8	-177	0	0	0	0	0	111.7	V243 N312 M317 A318	V243-A314 HydrophobicContact CG2-CB 3.9Å; N312-A314 VanDerWaalsContact C-N 3.32Å; N312-A314 PolarHBondContact O-N 3.24Å; N312-A314 WeakPolarHBondContact OD1-CB 3.18Å; N312-A314 PolarHBondContact OD1-N 2.76Å; A314-M317 PolarHBondContact O-N 3.27Å; A314-A318 WeakPolarHBondContact O-CB 3.32Å; A314-A318 PolarHBondContact O-N 2.98Å
315	V	93.1	Very high	90.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.8	-49.2	174.1	177.6	0	0	0	0	110.5	E239 Q242 V243 L307 N312 T313 M317 A318 V319	E239-V315 HydrophobicContact CB-CG2 4.1Å; Q242-V315 HydrophobicContact CB-CG1 4.5Å; Q242-V315 HydrophobicContact CB-CG2 4.17Å; V243-V315 HydrophobicContact CG2-CG2 3.94Å; L307-V315 HydrophobicContact CB-CG1 3.94Å; N312-V315 HydrophobicContact CB-CG2 4.1Å; N312-V315 PolarHBondContact O-N 3.26Å; T313-V315 VanDerWaalsContact C-N 3.33Å; T313-V315 PolarHBondContact O-N 3.28Å; V315-M317 VanDerWaalsContact C-N 3.27Å; V315-M317 PolarHBondContact O-N 2.78Å; V315-A318 PolarHBondContact O-N 2.94Å; V315-V319 VanDerWaalsContact O-CG2 3.3Å; V315-V319 WeakPolarHBondContact O-CG2 3.28Å; V315-V319 PolarHBondContact O-N 2.9Å
316	V	93.3	Very high	90.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.4	-38.5	177.4	-176.1	0	0	0	0	111.7	L308 S310 N312 T313 A320 R341 L342	L308-V316 HydrophobicContact CD2-CG1 4.44Å; S310-V316 VanDerWaalsContact OG-CG2 3.27Å; S310-V316 WeakPolarHBondContact OG-CG2 3.26Å; N312-V316 PolarHBondContact O-N 2.92Å; T313-V316 PolarHBondContact O-N 2.93Å; V316-A320 WeakPolarHBondContact O-CB 3.08Å; V316-A320 PolarHBondContact O-N 2.92Å; V316-R341 VanDerWaalsContact CG2-NH2 3.34Å; V316-L342 HydrophobicContact CB-CD1 4.05Å; V316-L342 HydrophobicContact CB-CD2 4.3Å; V316-L342 HydrophobicContact CG1-CD1 3.8Å; V316-L342 HydrophobicContact CG1-CD2 4.36Å; V316-L342 HydrophobicContact CG1-CG 4.23Å; V316-L342 HydrophobicContact CG2-CD2 4.36Å
317	M	91.4	Very high	89.9	Confident	17 Å²	17	29.3 Å²	29.3	8%	0.084	14%	0.14	C	C	.	.	H	α-helix	trans	-69.4	-42.3	177	-74.7	-56.1	-51.4	0	0	112.8	T313 A314 V315 V319 A320 Q321 L339 L342 V353 N356	T313-M317 HydrophobicContact CG2-CG 4.29Å; T313-M317 WeakPolarHBondContact O-CG 3.36Å; T313-M317 PolarHBondContact O-N 2.78Å; A314-M317 PolarHBondContact O-N 3.27Å; V315-M317 VanDerWaalsContact C-N 3.27Å; V315-M317 PolarHBondContact O-N 2.78Å; M317-V319 VanDerWaalsContact C-N 3.32Å; M317-V319 PolarHBondContact O-N 2.81Å; M317-A320 WeakPolarHBondContact O-CB 3.46Å; M317-A320 PolarHBondContact O-N 3.21Å; M317-A320 VanDerWaalsContact O-N 3.16Å; M317-Q321 WeakPolarHBondContact O-CB 3.31Å; M317-Q321 PolarHBondContact O-N 2.75Å; M317-L339 HydrophobicContact CE-CD2 4.33Å; M317-L339 HydrophobicContact SD-CD2 3.58Å; M317-L339 VanDerWaalsContact SD-CD2 3.58Å; M317-L342 HydrophobicContact CG-CD1 4.12Å; M317-L342 HydrophobicContact SD-CD1 3.88Å; M317-V353 HydrophobicContact SD-CG2 3.85Å; M317-N356 HydrophobicContact CE-CB 3.98Å
318	A	91.3	Very high	89.3	Confident	4 Å²	4	29.4 Å²	29.4	3%	0.033	14%	0.141	C	C	.	.	H	α-helix	trans	-62	-40.4	175.1	0	0	0	0	0	111.4	V243 I246 A314 V315 Q321 L322	V243-A318 HydrophobicContact CG1-CB 4.25Å; V243-A318 HydrophobicContact CG2-CB 4.44Å; I246-A318 HydrophobicContact CB-CB 4.22Å; I246-A318 HydrophobicContact CD1-CB 4.41Å; I246-A318 HydrophobicContact CG2-CB 3.86Å; I246-A318 WeakPolarHBondContact CG2-O 3.41Å; A314-A318 WeakPolarHBondContact O-CB 3.32Å; A314-A318 PolarHBondContact O-N 2.98Å; V315-A318 PolarHBondContact O-N 2.94Å; A318-Q321 PolarHBondContact O-N 2.9Å; A318-L322 WeakPolarHBondContact O-CB 3.45Å; A318-L322 PolarHBondContact O-N 2.88Å
319	V	92.5	Very high	88.6	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-67.8	-37.8	173.6	-175.5	0	0	0	0	111.4	I246 L307 L308 V315 M317 Q321 L322 Y323	I246-V319 HydrophobicContact CD1-CG2 3.7Å; L307-V319 HydrophobicContact CB-CG2 3.76Å; L307-V319 HydrophobicContact CD1-CG2 4.45Å; L308-V319 HydrophobicContact CD2-CB 3.96Å; L308-V319 HydrophobicContact CD2-CG1 3.62Å; L308-V319 HydrophobicContact CG-CB 4.44Å; L308-V319 HydrophobicContact CG-CG1 3.73Å; V315-V319 VanDerWaalsContact O-CG2 3.3Å; V315-V319 WeakPolarHBondContact O-CG2 3.28Å; V315-V319 PolarHBondContact O-N 2.9Å; M317-V319 VanDerWaalsContact C-N 3.32Å; M317-V319 PolarHBondContact O-N 2.81Å; V319-Q321 VanDerWaalsContact C-N 3.34Å; V319-Q321 PolarHBondContact O-N 2.91Å; V319-L322 WeakPolarHBondContact O-CB 3.46Å; V319-L322 PolarHBondContact O-N 2.88Å; V319-Y323 HydrophobicContact CG1-CD2 3.63Å; V319-Y323 HydrophobicContact CG1-CE2 3.75Å; V319-Y323 WeakPolarHBondContact O-CB 3.38Å; V319-Y323 WeakPolarHBondContact O-CD2 3.28Å; V319-Y323 PolarHBondContact O-N 2.9Å
320	A	91.2	Very high	88	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-62.7	-40.6	175.1	0	0	0	0	0	112.4	V316 M317 W324 V335 L339	V316-A320 WeakPolarHBondContact O-CB 3.08Å; V316-A320 PolarHBondContact O-N 2.92Å; M317-A320 WeakPolarHBondContact O-CB 3.46Å; M317-A320 PolarHBondContact O-N 3.21Å; M317-A320 VanDerWaalsContact O-N 3.16Å; A320-W324 VanDerWaalsContact O-CB 3.26Å; A320-W324 WeakPolarHBondContact O-CB 3.38Å; A320-W324 PolarHBondContact O-N 2.94Å; A320-V335 HydrophobicContact CB-CG1 3.41Å; A320-V335 VanDerWaalsContact CB-CG1 3.41Å; A320-L339 HydrophobicContact CB-CD2 3.91Å; A320-L339 HydrophobicContact CB-CG 4.42Å
321	Q	89.7	Confident	87.4	Confident	13 Å²	13	32.8 Å²	32.8	6%	0.061	15%	0.153	C	C	.	.	H	α-helix	trans	-64.3	-48.2	173.8	171.1	-175.1	-15	0	0	111.7	M317 A318 V319 W324 H325 Q632 L633	M317-Q321 WeakPolarHBondContact O-CB 3.31Å; M317-Q321 PolarHBondContact O-N 2.75Å; A318-Q321 PolarHBondContact O-N 2.9Å; V319-Q321 VanDerWaalsContact C-N 3.34Å; V319-Q321 PolarHBondContact O-N 2.91Å; Q321-W324 PolarHBondContact O-N 2.89Å; Q321-H325 PolarHBondContact O-CD2 3.06Å; Q321-H325 PolarHBondContact O-N 3.12Å; Q321-H325 VanDerWaalsContact O-N 3.08Å; Q321-Q632 HydrophobicContact CG-CG 4.29Å; Q321-Q632 VanDerWaalsContact NE2-NE2 3.11Å; Q321-L633 VanDerWaalsContact CG-O 3.24Å; Q321-L633 WeakPolarHBondContact CG-O 3.4Å; Q321-L633 PolarHBondContact OE1-O 3.14Å
322	L	89.8	Confident	87.1	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-53.4	-55	173	179	87.6	0	0	0	111.1	I246 T250 L300 T304 A318 V319 W324 H325 L326	I246-L322 HydrophobicContact CG2-CB 3.92Å; I246-L322 HydrophobicContact CG2-CD1 4.24Å; I246-L322 HydrophobicContact CG2-CD2 4.38Å; I246-L322 HydrophobicContact CG2-CG 4.42Å; T250-L322 VanDerWaalsContact OG1-CD1 3.25Å; T250-L322 WeakPolarHBondContact OG1-CD1 3.46Å; L300-L322 HydrophobicContact CD2-CD1 4.16Å; L300-L322 HydrophobicContact CG-CD1 4.44Å; T304-L322 HydrophobicContact CG2-CD2 3.67Å; T304-L322 WeakPolarHBondContact OG1-CD2 3.36Å; A318-L322 WeakPolarHBondContact O-CB 3.45Å; A318-L322 PolarHBondContact O-N 2.88Å; V319-L322 WeakPolarHBondContact O-CB 3.46Å; V319-L322 PolarHBondContact O-N 2.88Å; L322-W324 PolarHBondContact O-N 2.77Å; L322-H325 PolarHBondContact O-N 3.47Å; L322-L326 HydrophobicContact CD1-CD1 3.46Å; L322-L326 VanDerWaalsContact CD1-CD1 3.46Å; L322-L326 HydrophobicContact CG-CD1 4.01Å; L322-L326 VanDerWaalsContact O-CB 3.31Å; L322-L326 WeakPolarHBondContact O-CB 3.39Å; L322-L326 PolarHBondContact O-N 3.19Å
323	Y	88.9	Confident	86.7	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.3	-41.1	179.5	-93.4	-102.6	0	0	0	112.4	L301 K305 V319 H325 A327 E331 V335	L301-Y323 HydrophobicContact CD2-CD2 4.36Å; L301-Y323 HydrophobicContact CD2-CE1 4.38Å; L301-Y323 HydrophobicContact CD2-CE2 4.23Å; L301-Y323 PolarHBondContact O-OH 2.97Å; L301-Y323 VanDerWaalsContact O-OH 3.09Å; K305-Y323 WeakPolarHBondContact CB-OH 3.25Å; V319-Y323 HydrophobicContact CG1-CD2 3.63Å; V319-Y323 HydrophobicContact CG1-CE2 3.75Å; V319-Y323 WeakPolarHBondContact O-CB 3.38Å; V319-Y323 WeakPolarHBondContact O-CD2 3.28Å; V319-Y323 PolarHBondContact O-N 2.9Å; Y323-H325 VanDerWaalsContact C-N 3.34Å; Y323-H325 PolarHBondContact O-N 2.86Å; Y323-A327 HydrophobicContact CD1-CB 3.59Å; Y323-A327 HydrophobicContact CE1-CB 4.24Å; Y323-A327 HydrophobicContact CG-CB 4.15Å; Y323-A327 VanDerWaalsContact O-CB 3.22Å; Y323-A327 WeakPolarHBondContact O-CB 3.49Å; Y323-A327 PolarHBondContact O-N 2.9Å; Y323-E331 HydrophobicContact CE1-CB 4.46Å; Y323-V335 VanDerWaalsContact CB-CG2 3.49Å; Y323-V335 HydrophobicContact CD1-CG2 3.96Å; Y323-V335 HydrophobicContact CD2-CG2 4.43Å; Y323-V335 HydrophobicContact CG-CG2 3.72Å
324	W	86.6	Confident	86.5	Confident	16 Å²	16	25 Å²	25	6%	0.061	13%	0.132	C	C	.	.	H	α-helix	trans	-60.4	-41.3	178	-178.8	-108.4	0	0	0	112.9	A320 Q321 L322 V332 M360 Q363 R364 M367 L633	A320-W324 VanDerWaalsContact O-CB 3.26Å; A320-W324 WeakPolarHBondContact O-CB 3.38Å; A320-W324 PolarHBondContact O-N 2.94Å; Q321-W324 PolarHBondContact O-N 2.89Å; L322-W324 PolarHBondContact O-N 2.77Å; W324-V332 HydrophobicContact CE3-CG1 3.91Å; W324-V332 HydrophobicContact CZ3-CG1 4.37Å; W324-M360 HydrophobicContact CB-CE 4Å; W324-M360 HydrophobicContact CD2-CE 3.88Å; W324-M360 HydrophobicContact CD2-CG 4.08Å; W324-M360 HydrophobicContact CE3-CE 3.57Å; W324-M360 HydrophobicContact CE3-CG 3.9Å; W324-M360 HydrophobicContact CG-CE 4.09Å; W324-M360 HydrophobicContact CH2-CB 3.94Å; W324-M360 HydrophobicContact CH2-CG 4Å; W324-M360 HydrophobicContact CZ2-CB 4.44Å; W324-M360 HydrophobicContact CZ2-CG 4.17Å; W324-M360 HydrophobicContact CZ3-CB 3.98Å; W324-M360 HydrophobicContact CZ3-CE 4.32Å; W324-M360 HydrophobicContact CZ3-CG 3.87Å; W324-Q363 HydrophobicContact CH2-CB 4.07Å; W324-Q363 HydrophobicContact CZ2-CB 4.25Å; W324-Q363 HydrophobicContact CZ2-CG 4.42Å; W324-R364 HydrophobicContact CH2-CB 4.47Å; W324-R364 HydrophobicContact CH2-CG 4.08Å; W324-R364 HydrophobicContact CZ3-CG 4.21Å; W324-M367 HydrophobicContact CE3-CE 4.36Å; W324-M367 HydrophobicContact CZ3-CE 3.67Å; W324-M367 HydrophobicContact CZ3-SD 4.31Å; W324-L633 HydrophobicContact CB-CD2 4.09Å; W324-L633 HydrophobicContact CD2-CD2 4.43Å; W324-L633 HydrophobicContact CG-CD2 3.88Å
325	H	84.8	Confident	86.3	Confident	24 Å²	24	23.3 Å²	23.3	11%	0.111	12%	0.117	C	C	.	.	H	α-helix	trans	-88.2	-18.7	-175.8	-72	-67.7	0	0	0	114.8	T250 R254 Q321 L322 Y323 Q632 L633 L650 W653	T250-H325 HydrophobicContact CG2-CB 4.46Å; R254-H325 PolarHBondContact NE-O 2.89Å; R254-H325 PolarHBondContact NH2-O 2.74Å; Q321-H325 PolarHBondContact O-CD2 3.06Å; Q321-H325 PolarHBondContact O-N 3.12Å; Q321-H325 VanDerWaalsContact O-N 3.08Å; L322-H325 PolarHBondContact O-N 3.47Å; Y323-H325 VanDerWaalsContact C-N 3.34Å; Y323-H325 PolarHBondContact O-N 2.86Å; H325-Q632 WeakPolarHBondContact NE2-CG 3.27Å; H325-L633 PolarHBondContact NE2-N 3.31Å; H325-L650 HydrophobicContact CB-CD2 3.88Å; H325-W653 WeakPolarHBondContact O-CZ2 3.4Å
326	L	82.9	Confident	86.2	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-126.7	-32.5	-170.6	-62	173.2	0	0	0	115.8	T250 A253 R254 L322 W653	T250-L326 HydrophobicContact CG2-CD1 4.37Å; A253-L326 HydrophobicContact CB-CD1 3.57Å; A253-L326 HydrophobicContact CB-CD2 3.7Å; A253-L326 HydrophobicContact CB-CG 4.31Å; R254-L326 HydrophobicContact CG-CD2 3.91Å; L322-L326 HydrophobicContact CD1-CD1 3.46Å; L322-L326 VanDerWaalsContact CD1-CD1 3.46Å; L322-L326 HydrophobicContact CG-CD1 4.01Å; L322-L326 VanDerWaalsContact O-CB 3.31Å; L322-L326 WeakPolarHBondContact O-CB 3.39Å; L322-L326 PolarHBondContact O-N 3.19Å; L326-W653 HydrophobicContact CD2-CH2 3.42Å; L326-W653 VanDerWaalsContact CD2-CH2 3.42Å; L326-W653 HydrophobicContact CD2-CZ2 4.16Å; L326-W653 HydrophobicContact CD2-CZ3 3.96Å
327	A	82.9	Confident	86	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.15	C	C	.	.	S	Bend	trans	-74.4	146.5	-170.1	0	0	0	0	0	112.2	L301 Y323 E331 V332	L301-A327 HydrophobicContact CD1-CB 4.3Å; L301-A327 HydrophobicContact CD2-CB 4.08Å; Y323-A327 HydrophobicContact CD1-CB 3.59Å; Y323-A327 HydrophobicContact CE1-CB 4.24Å; Y323-A327 HydrophobicContact CG-CB 4.15Å; Y323-A327 VanDerWaalsContact O-CB 3.22Å; Y323-A327 WeakPolarHBondContact O-CB 3.49Å; Y323-A327 PolarHBondContact O-N 2.9Å; A327-E331 HydrophobicContact CB-CB 4.26Å; A327-V332 HydrophobicContact CB-CG2 4.14Å
328	P	79.9	Confident	86	Confident	14 Å²	14	30.6 Å²	30.6	9%	0.091	15%	0.151	C	C	.	.			trans	-53.4	152.2	173.4	-26.5	35.2	0	0	0	112.4	P260 M293 H330 E331	P260-P328 HydrophobicContact CB-CG 4.31Å; M293-P328 HydrophobicContact CE-CG 4.13Å; P328-H330 PolarHBondContact O-N 2.89Å; P328-E331 PolarHBondContact O-N 2.82Å
329	K	76.3	Confident	86	Confident	101 Å²	101	30.5 Å²	30.5	44%	0.439	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-37.9	-170.4	-66.7	-175.9	-177.2	-176	0	113.9	E263 R364	E263-K329 IonicContact OE1-NZ 2.76Å; E263-K329 PolarHBondContact OE1-NZ 3.26Å; K329-R364 PolarHBondContact O-NH1 2.86Å
330	H	77.7	Confident	85.9	Confident	136 Å²	136	31.1 Å²	31.1	63%	0.63	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76	-41.2	179.3	58.8	-94.3	0	0	0	114.6	P328 V332 S333	P328-H330 PolarHBondContact O-N 2.89Å; H330-V332 VanDerWaalsContact C-N 3.27Å; H330-V332 PolarHBondContact O-N 3.45Å; H330-S333 PolarHBondContact O-N 2.76Å
331	E	78.6	Confident	85.9	Confident	27 Å²	27	35.1 Å²	35.1	13%	0.126	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-68.8	-22.8	-174.9	-63.8	-160.9	-180	0	0	113.1	R298 Y323 A327 P328 S333 I334	R298-E331 IonicContact CZ-OE1 3.67Å; R298-E331 IonicContact NH1-OE1 3.13Å; R298-E331 PolarHBondContact NH1-OE1 3.35Å; R298-E331 IonicContact NH2-OE1 3.76Å; Y323-E331 HydrophobicContact CE1-CB 4.46Å; A327-E331 HydrophobicContact CB-CB 4.26Å; P328-E331 PolarHBondContact O-N 2.82Å; E331-S333 PolarHBondContact O-N 3.28Å; E331-I334 HydrophobicContact CB-CD1 4.29Å; E331-I334 WeakPolarHBondContact O-CB 3.45Å; E331-I334 WeakPolarHBondContact O-CD1 3.43Å; E331-I334 VanDerWaalsContact O-CG1 3.26Å; E331-I334 WeakPolarHBondContact O-CG1 3.34Å; E331-I334 PolarHBondContact O-N 2.95Å
332	V	81.8	Confident	86	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.006	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-56.2	-33.6	178.3	-176.2	0	0	0	0	112.5	W324 A327 H330 I334 V335 M367	W324-V332 HydrophobicContact CE3-CG1 3.91Å; W324-V332 HydrophobicContact CZ3-CG1 4.37Å; A327-V332 HydrophobicContact CB-CG2 4.14Å; H330-V332 VanDerWaalsContact C-N 3.27Å; H330-V332 PolarHBondContact O-N 3.45Å; V332-I334 PolarHBondContact O-N 2.9Å; V332-I334 VanDerWaalsContact O-N 3.13Å; V332-V335 WeakPolarHBondContact O-CB 3.48Å; V332-V335 WeakPolarHBondContact O-CG2 3.46Å; V332-V335 PolarHBondContact O-N 2.91Å; V332-V335 VanDerWaalsContact O-N 3.11Å; V332-M367 HydrophobicContact CB-SD 4.41Å; V332-M367 HydrophobicContact CG1-CE 4.45Å; V332-M367 HydrophobicContact CG1-SD 3.73Å
333	S	84.5	Confident	86	Confident	64 Å²	64	35.2 Å²	35.2	45%	0.448	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-64.6	-19.2	-177.1	-162	0	0	0	0	113.9	H330 E331 V335 T336	H330-S333 PolarHBondContact O-N 2.76Å; E331-S333 PolarHBondContact O-N 3.28Å; S333-V335 PolarHBondContact O-N 3.46Å; S333-T336 WeakPolarHBondContact O-CB 3.4Å; S333-T336 PolarHBondContact O-N 3.22Å; S333-T336 PolarHBondContact O-OG1 2.82Å
334	I	86.9	Confident	86.1	Confident	68 Å²	68	44.9 Å²	44.9	35%	0.349	21%	0.206	S	C	.	.	H	α-helix	trans	-59.6	-33.6	175	-60	170.5	0	0	0	110.8	L308 E331 V332 T336	L308-I334 HydrophobicContact CD1-CG2 4.01Å; E331-I334 HydrophobicContact CB-CD1 4.29Å; E331-I334 WeakPolarHBondContact O-CB 3.45Å; E331-I334 WeakPolarHBondContact O-CD1 3.43Å; E331-I334 VanDerWaalsContact O-CG1 3.26Å; E331-I334 WeakPolarHBondContact O-CG1 3.34Å; E331-I334 PolarHBondContact O-N 2.95Å; V332-I334 PolarHBondContact O-N 2.9Å; V332-I334 VanDerWaalsContact O-N 3.13Å; I334-T336 PolarHBondContact O-N 3.49Å
335	V	88.9	Confident	86.2	Confident	3 Å²	3	46 Å²	46	2%	0.018	22%	0.216	C	C	.	.	H	α-helix	trans	-67.3	-33.6	-176.9	179.1	0	0	0	0	112.4	L308 A320 Y323 V332 S333 K337 S338 L339	L308-V335 HydrophobicContact CD1-CG2 4.43Å; L308-V335 HydrophobicContact CD2-CG1 4.47Å; L308-V335 HydrophobicContact CD2-CG2 4.4Å; A320-V335 HydrophobicContact CB-CG1 3.41Å; A320-V335 VanDerWaalsContact CB-CG1 3.41Å; Y323-V335 VanDerWaalsContact CB-CG2 3.49Å; Y323-V335 HydrophobicContact CD1-CG2 3.96Å; Y323-V335 HydrophobicContact CD2-CG2 4.43Å; Y323-V335 HydrophobicContact CG-CG2 3.72Å; V332-V335 WeakPolarHBondContact O-CB 3.48Å; V332-V335 WeakPolarHBondContact O-CG2 3.46Å; V332-V335 PolarHBondContact O-N 2.91Å; V332-V335 VanDerWaalsContact O-N 3.11Å; S333-V335 PolarHBondContact O-N 3.46Å; V335-K337 VanDerWaalsContact C-N 3.33Å; V335-K337 PolarHBondContact O-N 2.89Å; V335-S338 PolarHBondContact O-N 2.99Å; V335-L339 HydrophobicContact CG1-CD1 3.77Å; V335-L339 HydrophobicContact CG1-CG 3.85Å; V335-L339 PolarHBondContact O-N 3.44Å
336	T	89.5	Confident	86.5	Confident	3 Å²	3	51.9 Å²	51.9	2%	0.018	24%	0.243	C	C	.	.	H	α-helix	trans	-50.5	-48.8	-174.1	-54.7	0	0	0	0	112.8	S333 I334 S338 L339 V340 M367 F368 Y371	S333-T336 WeakPolarHBondContact O-CB 3.4Å; S333-T336 PolarHBondContact O-N 3.22Å; S333-T336 PolarHBondContact O-OG1 2.82Å; I334-T336 PolarHBondContact O-N 3.49Å; T336-S338 PolarHBondContact O-N 3.39Å; T336-L339 PolarHBondContact O-N 2.89Å; T336-V340 WeakPolarHBondContact O-CG2 3.4Å; T336-V340 PolarHBondContact O-N 3.4Å; T336-M367 WeakPolarHBondContact CG2-O 3.45Å; T336-F368 HydrophobicContact CG2-CD1 3.63Å; T336-F368 HydrophobicContact CG2-CE1 3.86Å; T336-F368 HydrophobicContact CG2-CG 4.36Å; T336-Y371 HydrophobicContact CG2-CD2 3.48Å; T336-Y371 VanDerWaalsContact CG2-CD2 3.48Å; T336-Y371 HydrophobicContact CG2-CE2 3.63Å
337	K	90.4	Very high	86.8	Confident	153 Å²	153	58.2 Å²	58.2	67%	0.665	27%	0.267	S	S	*	.	H	α-helix	trans	-61.4	-33.5	-178.5	-175.4	177.1	177.7	179.9	0	112.2	V335 R341	V335-K337 VanDerWaalsContact C-N 3.33Å; V335-K337 PolarHBondContact O-N 2.89Å; K337-R341 PolarHBondContact O-N 3.44Å; K337-R341 VanDerWaalsContact O-N 3.16Å
338	S	90.6	Very high	87.2	Confident	15 Å²	15	63.1 Å²	63.1	11%	0.105	29%	0.29	C	S	.	.	H	α-helix	trans	-78.7	-37.9	176.2	-77.9	0	0	0	0	112.8	L308 V335 T336 V340 R341 L342	L308-S338 WeakPolarHBondContact O-CB 3.29Å; L308-S338 PolarHBondContact O-OG 3.43Å; V335-S338 PolarHBondContact O-N 2.99Å; T336-S338 PolarHBondContact O-N 3.39Å; S338-V340 PolarHBondContact O-N 3.11Å; S338-R341 VanDerWaalsContact O-CB 3.31Å; S338-R341 WeakPolarHBondContact O-CB 3.06Å; S338-R341 PolarHBondContact O-N 3.05Å; S338-R341 VanDerWaalsContact O-N 3.13Å; S338-L342 WeakPolarHBondContact O-CG 2.87Å; S338-L342 PolarHBondContact O-N 3.2Å; S338-L342 VanDerWaalsContact O-N 3.16Å
339	L	91	Very high	87.8	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-61.3	-44.8	172.3	-68.5	173.9	0	0	0	111.5	M317 A320 V335 T336 R341 L342 L343 V353 I357 M360 F368	M317-L339 HydrophobicContact CE-CD2 4.33Å; M317-L339 HydrophobicContact SD-CD2 3.58Å; M317-L339 VanDerWaalsContact SD-CD2 3.58Å; A320-L339 HydrophobicContact CB-CD2 3.91Å; A320-L339 HydrophobicContact CB-CG 4.42Å; V335-L339 HydrophobicContact CG1-CD1 3.77Å; V335-L339 HydrophobicContact CG1-CG 3.85Å; V335-L339 PolarHBondContact O-N 3.44Å; T336-L339 PolarHBondContact O-N 2.89Å; L339-R341 PolarHBondContact O-N 3.47Å; L339-L342 HydrophobicContact CD2-CD1 4.4Å; L339-L342 WeakPolarHBondContact O-CB 3.47Å; L339-L342 PolarHBondContact O-N 3.3Å; L339-L343 PolarHBondContact O-N 2.83Å; L339-V353 HydrophobicContact CD2-CG1 4.4Å; L339-I357 HydrophobicContact CB-CD1 4.12Å; L339-I357 HydrophobicContact CB-CG1 4.34Å; L339-I357 HydrophobicContact CD1-CG1 4.25Å; L339-M360 HydrophobicContact CD1-CE 4.08Å; L339-M360 HydrophobicContact CD1-SD 3.68Å; L339-F368 HydrophobicContact CD1-CE1 4.32Å; L339-F368 HydrophobicContact CD1-CZ 4.18Å
340	V	91.4	Very high	88.5	Confident	12 Å²	12	60.5 Å²	60.5	7%	0.073	28%	0.28	C	S	.	.	H	α-helix	trans	-64.5	-26.6	175.3	174.9	0	0	0	0	112.2	T336 S338 Y371 F375	T336-V340 WeakPolarHBondContact O-CG2 3.4Å; T336-V340 PolarHBondContact O-N 3.4Å; S338-V340 PolarHBondContact O-N 3.11Å; V340-Y371 HydrophobicContact CG1-CD1 4.2Å; V340-Y371 HydrophobicContact CG1-CG 4.37Å; V340-Y371 HydrophobicContact CG2-CD2 4.24Å; V340-Y371 HydrophobicContact CG2-CG 4Å; V340-F375 HydrophobicContact CG2-CZ 4.22Å
341	R	91.5	Very high	89.2	Confident	85 Å²	85	58.1 Å²	58.1	32%	0.321	27%	0.266	S	S	.	.	H	α-helix	trans	-65.5	-42.3	169.6	174	-180	67.1	99	-13.7	111.8	L308 S310 V316 K337 S338 L339 L343 R344	L308-R341 PolarHBondContact O-NH2 3.26Å; S310-R341 PolarHBondContact O-NH1 3.1Å; S310-R341 PolarHBondContact O-NH2 2.67Å; V316-R341 VanDerWaalsContact CG2-NH2 3.34Å; K337-R341 PolarHBondContact O-N 3.44Å; K337-R341 VanDerWaalsContact O-N 3.16Å; S338-R341 VanDerWaalsContact O-CB 3.31Å; S338-R341 WeakPolarHBondContact O-CB 3.06Å; S338-R341 PolarHBondContact O-N 3.05Å; S338-R341 VanDerWaalsContact O-N 3.13Å; L339-R341 PolarHBondContact O-N 3.47Å; R341-L343 PolarHBondContact O-N 3.25Å; R341-R344 PolarHBondContact O-N 3.2Å
342	L	91.6	Very high	89.8	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.01	28%	0.276	C	S	.	.	H	α-helix	trans	-66.3	-19.3	180	-57.6	176.2	0	0	0	113.2	T313 V316 M317 S338 L339 R344 S345 V349 V353	T313-L342 HydrophobicContact CG2-CD1 4.04Å; T313-L342 HydrophobicContact CG2-CD2 4.12Å; V316-L342 HydrophobicContact CB-CD1 4.05Å; V316-L342 HydrophobicContact CB-CD2 4.3Å; V316-L342 HydrophobicContact CG1-CD1 3.8Å; V316-L342 HydrophobicContact CG1-CD2 4.36Å; V316-L342 HydrophobicContact CG1-CG 4.23Å; V316-L342 HydrophobicContact CG2-CD2 4.36Å; M317-L342 HydrophobicContact CG-CD1 4.12Å; M317-L342 HydrophobicContact SD-CD1 3.88Å; S338-L342 WeakPolarHBondContact O-CG 2.87Å; S338-L342 PolarHBondContact O-N 3.2Å; S338-L342 VanDerWaalsContact O-N 3.16Å; L339-L342 HydrophobicContact CD2-CD1 4.4Å; L339-L342 WeakPolarHBondContact O-CB 3.47Å; L339-L342 PolarHBondContact O-N 3.3Å; L342-R344 PolarHBondContact O-N 3.3Å; L342-S345 VanDerWaalsContact O-CB 3.23Å; L342-S345 WeakPolarHBondContact O-CB 3.26Å; L342-S345 PolarHBondContact O-N 3.3Å; L342-S345 PolarHBondContact O-OG 3.08Å; L342-V349 HydrophobicContact CB-CG1 4.46Å; L342-V353 HydrophobicContact CB-CG1 4.19Å; L342-V353 HydrophobicContact CB-CG2 3.76Å; L342-V353 HydrophobicContact CD1-CG2 3.79Å; L342-V353 HydrophobicContact CG-CG2 4.45Å
343	L	89.8	Confident	90.3	Very high	14 Å²	14	59.4 Å²	59.4	7%	0.073	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-4.1	173.1	-59	-177.7	0	0	0	114.3	L339 R341 V353 L354 I357 F375	L339-L343 PolarHBondContact O-N 2.83Å; R341-L343 PolarHBondContact O-N 3.25Å; L343-V353 HydrophobicContact CD2-CB 4.19Å; L343-V353 HydrophobicContact CD2-CG1 3.65Å; L343-V353 HydrophobicContact CG-CG1 4.37Å; L343-L354 HydrophobicContact CD1-CD2 4.21Å; L343-L354 HydrophobicContact CD2-CD1 4.47Å; L343-L354 HydrophobicContact CD2-CD2 3.6Å; L343-L354 HydrophobicContact CD2-CG 3.62Å; L343-I357 HydrophobicContact CD1-CD1 4.28Å; L343-I357 HydrophobicContact CD2-CD1 4.25Å; L343-I357 HydrophobicContact CG-CD1 4.5Å; L343-F375 HydrophobicContact CD1-CD1 4.12Å; L343-F375 HydrophobicContact CD1-CE1 3.63Å; L343-F375 HydrophobicContact CD1-CZ 4.24Å
344	R	89.8	Confident	90.6	Very high	202 Å²	202	56.3 Å²	56.3	76%	0.762	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-3.8	171	-59.9	-171.6	180	89.4	-5	114	R341 L342	R341-R344 PolarHBondContact O-N 3.2Å; L342-R344 PolarHBondContact O-N 3.3Å
345	S	89.2	Confident	90.8	Very high	39 Å²	39	53.4 Å²	53.4	27%	0.273	24%	0.239	S	C	.	.	S	Bend	trans	-76.8	-174.1	178.6	-59.5	0	0	0	0	112.3	L342 Q350	L342-S345 VanDerWaalsContact O-CB 3.23Å; L342-S345 WeakPolarHBondContact O-CB 3.26Å; L342-S345 PolarHBondContact O-N 3.3Å; L342-S345 PolarHBondContact O-OG 3.08Å; S345-Q350 PolarHBondContact O-NE2 3.47Å
346	H	90.5	Very high	90.8	Very high	149 Å²	149	53.2 Å²	53.2	69%	0.69	24%	0.238	S	C	*	.			trans	-55.2	154.7	173.9	-60.6	-82.7	0	0	0	112.9	E348 V349 Q350	H346-E348 PolarHBondContact O-N 3.26Å; H346-V349 WeakPolarHBondContact O-CB 3.27Å; H346-V349 PolarHBondContact O-N 3.23Å; H346-Q350 PolarHBondContact O-N 3.27Å
347	R	91	Very high	90.9	Very high	133 Å²	133	53.1 Å²	53.1	50%	0.502	24%	0.237	S	C	.	.	H	α-helix	trans	-53.7	-40	-174.9	176.9	-174.1	60.7	178.3	-1.3	112.8	Q350 Y351 I385	R347-Q350 WeakPolarHBondContact O-CB 3.4Å; R347-Q350 PolarHBondContact O-N 2.8Å; R347-Y351 PolarHBondContact O-N 2.9Å; R347-I385 HydrophobicContact CB-CD1 4.44Å; R347-I385 HydrophobicContact CG-CD1 3.67Å
348	E	91.1	Very high	90.7	Very high	103 Å²	103	45.8 Å²	45.8	48%	0.481	21%	0.206	S	C	.	.	H	α-helix	trans	-66.5	-39.5	-178	-62.9	63.1	-139.3	0	0	110.6	H346 V352	H346-E348 PolarHBondContact O-N 3.26Å; E348-V352 PolarHBondContact O-N 3.3Å
349	V	91.5	Very high	90.5	Very high	34 Å²	34	45.3 Å²	45.3	21%	0.206	20%	0.202	C	C	.	.	H	α-helix	trans	-67.7	-45.3	170.7	166.4	0	0	0	0	111	T313 L342 H346 Y351 V352 V353	T313-V349 HydrophobicContact CG2-CB 4.29Å; T313-V349 HydrophobicContact CG2-CG1 3.35Å; T313-V349 HydrophobicContact CG2-CG2 3.99Å; L342-V349 HydrophobicContact CB-CG1 4.46Å; H346-V349 WeakPolarHBondContact O-CB 3.27Å; H346-V349 PolarHBondContact O-N 3.23Å; V349-Y351 VanDerWaalsContact C-N 3.27Å; V349-Y351 PolarHBondContact O-N 3.3Å; V349-V352 PolarHBondContact O-N 3.09Å; V349-V353 HydrophobicContact CG1-CG2 3.94Å; V349-V353 WeakPolarHBondContact O-CB 3.49Å; V349-V353 WeakPolarHBondContact O-CG2 3.41Å; V349-V353 PolarHBondContact O-N 3.44Å
350	Q	91.7	Very high	90.3	Very high	25 Å²	25	45.3 Å²	45.3	12%	0.117	20%	0.202	C	C	.	.	H	α-helix	trans	-56.6	-42.4	178.2	-68.3	-178.6	43.6	0	0	111.3	S345 H346 R347 V353 L354 I385	S345-Q350 PolarHBondContact O-NE2 3.47Å; H346-Q350 PolarHBondContact O-N 3.27Å; R347-Q350 WeakPolarHBondContact O-CB 3.4Å; R347-Q350 PolarHBondContact O-N 2.8Å; Q350-V353 PolarHBondContact O-N 3.43Å; Q350-L354 VanDerWaalsContact O-CB 3.24Å; Q350-L354 WeakPolarHBondContact O-CB 3.43Å; Q350-L354 WeakPolarHBondContact O-CD1 3.48Å; Q350-L354 WeakPolarHBondContact O-CG 3.49Å; Q350-L354 PolarHBondContact O-N 2.76Å; Q350-I385 HydrophobicContact CB-CD1 3.79Å
351	Y	91.6	Very high	90	Very high	86 Å²	86	44.7 Å²	44.7	34%	0.337	20%	0.198	S	C	.	.	H	α-helix	trans	-58.4	-54.6	177.3	176.9	-101.8	0	0	0	112.4	R347 V349 V353 L354 Q355 H384 L388	R347-Y351 PolarHBondContact O-N 2.9Å; V349-Y351 VanDerWaalsContact C-N 3.27Å; V349-Y351 PolarHBondContact O-N 3.3Å; Y351-V353 PolarHBondContact O-N 3.26Å; Y351-L354 PolarHBondContact O-N 3.15Å; Y351-Q355 WeakPolarHBondContact O-CB 3.42Å; Y351-Q355 PolarHBondContact O-N 2.89Å; Y351-H384 HydrophobicContact CD2-CB 4.34Å; Y351-H384 AromaticContact CD2-CD2 3.77Å; Y351-H384 HydrophobicContact CE2-CB 4.19Å; Y351-L388 HydrophobicContact CD2-CD1 3.42Å; Y351-L388 VanDerWaalsContact CD2-CD1 3.42Å; Y351-L388 HydrophobicContact CE2-CD1 3.67Å; Y351-L388 HydrophobicContact CG-CD1 4.27Å
352	V	91.2	Very high	89.7	Confident	54 Å²	54	43 Å²	43	33%	0.327	20%	0.195	S	C	.	.	H	α-helix	trans	-62.1	-42.4	179.7	177.2	0	0	0	0	111.3	E348 V349 Q355 N356	E348-V352 PolarHBondContact O-N 3.3Å; V349-V352 PolarHBondContact O-N 3.09Å; V352-Q355 PolarHBondContact O-N 2.87Å; V352-N356 PolarHBondContact O-N 2.85Å; V352-N356 PolarHBondContact O-ND2 3.24Å
353	V	92.3	Very high	89	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-64.4	-47.5	178.7	173.6	0	0	0	0	111.1	M317 L339 L342 L343 V349 Q350 Y351 Q355 N356 I357	M317-V353 HydrophobicContact SD-CG2 3.85Å; L339-V353 HydrophobicContact CD2-CG1 4.4Å; L342-V353 HydrophobicContact CB-CG1 4.19Å; L342-V353 HydrophobicContact CB-CG2 3.76Å; L342-V353 HydrophobicContact CD1-CG2 3.79Å; L342-V353 HydrophobicContact CG-CG2 4.45Å; L343-V353 HydrophobicContact CD2-CB 4.19Å; L343-V353 HydrophobicContact CD2-CG1 3.65Å; L343-V353 HydrophobicContact CG-CG1 4.37Å; V349-V353 HydrophobicContact CG1-CG2 3.94Å; V349-V353 WeakPolarHBondContact O-CB 3.49Å; V349-V353 WeakPolarHBondContact O-CG2 3.41Å; V349-V353 PolarHBondContact O-N 3.44Å; Q350-V353 PolarHBondContact O-N 3.43Å; Y351-V353 PolarHBondContact O-N 3.26Å; V353-Q355 VanDerWaalsContact C-N 3.32Å; V353-Q355 PolarHBondContact O-N 3.08Å; V353-N356 PolarHBondContact O-N 2.75Å; V353-I357 HydrophobicContact CG1-CD1 3.78Å; V353-I357 HydrophobicContact CG1-CG1 4.4Å; V353-I357 WeakPolarHBondContact O-CG1 3.16Å; V353-I357 PolarHBondContact O-N 2.9Å
354	L	92.1	Very high	88.4	Confident	0 Å²	0	49 Å²	49	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.6	-38.3	178.3	-72.9	166.6	0	0	0	112	L343 Q350 Y351 N356 I357 A358 F375 I385 L388 K389 I392	L343-L354 HydrophobicContact CD1-CD2 4.21Å; L343-L354 HydrophobicContact CD2-CD1 4.47Å; L343-L354 HydrophobicContact CD2-CD2 3.6Å; L343-L354 HydrophobicContact CD2-CG 3.62Å; Q350-L354 VanDerWaalsContact O-CB 3.24Å; Q350-L354 WeakPolarHBondContact O-CB 3.43Å; Q350-L354 WeakPolarHBondContact O-CD1 3.48Å; Q350-L354 WeakPolarHBondContact O-CG 3.49Å; Q350-L354 PolarHBondContact O-N 2.76Å; Y351-L354 PolarHBondContact O-N 3.15Å; L354-N356 VanDerWaalsContact C-N 3.32Å; L354-N356 PolarHBondContact O-N 2.88Å; L354-I357 PolarHBondContact O-N 2.92Å; L354-A358 VanDerWaalsContact O-CB 3.31Å; L354-A358 WeakPolarHBondContact O-CB 3.23Å; L354-A358 PolarHBondContact O-N 3.38Å; L354-F375 HydrophobicContact CD2-CD1 3.92Å; L354-F375 HydrophobicContact CD2-CE1 4.06Å; L354-I385 HydrophobicContact CD1-CB 4.43Å; L354-I385 HydrophobicContact CD1-CG1 4.34Å; L354-I385 HydrophobicContact CD1-CG2 3.78Å; L354-L388 HydrophobicContact CB-CB 4.03Å; L354-L388 HydrophobicContact CB-CD1 3.91Å; L354-L388 HydrophobicContact CD1-CB 4.44Å; L354-K389 HydrophobicContact CD1-CG 4.13Å; L354-K389 HydrophobicContact CD2-CG 4.18Å; L354-I392 HydrophobicContact CB-CD1 4.2Å; L354-I392 HydrophobicContact CD2-CD1 3.56Å; L354-I392 HydrophobicContact CG-CD1 4.5Å
355	Q	89.9	Confident	87.8	Confident	6 Å²	6	43.1 Å²	43.1	3%	0.028	20%	0.201	C	C	.	.	H	α-helix	trans	-62.6	-38.2	176.7	179.3	161.1	34.4	0	0	113	Y351 V352 V353 T359 L388 F611 R628 H638 S639	Y351-Q355 WeakPolarHBondContact O-CB 3.42Å; Y351-Q355 PolarHBondContact O-N 2.89Å; V352-Q355 PolarHBondContact O-N 2.87Å; V353-Q355 VanDerWaalsContact C-N 3.32Å; V353-Q355 PolarHBondContact O-N 3.08Å; Q355-T359 PolarHBondContact O-N 2.86Å; Q355-T359 PolarHBondContact O-OG1 3.24Å; Q355-L388 HydrophobicContact CB-CD1 4.43Å; Q355-L388 HydrophobicContact CB-CD2 4.34Å; Q355-F611 HydrophobicContact CG-CE1 4.43Å; Q355-R628 VanDerWaalsContact NE2-NH2 3.13Å; Q355-H638 PolarHBondContact O-CE1 2.95Å; Q355-S639 PolarHBondContact NE2-O 3.31Å; Q355-S639 PolarHBondContact OE1-OG 3.31Å; Q355-S639 VanDerWaalsContact OE1-OG 3.07Å
356	N	89.4	Confident	87.3	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-70.3	-44.7	174	-72.6	-63.9	0	0	0	111.5	M317 V352 V353 L354 A358 T359 M360 L633 G634 H638	M317-N356 HydrophobicContact CE-CB 3.98Å; V352-N356 PolarHBondContact O-N 2.85Å; V352-N356 PolarHBondContact O-ND2 3.24Å; V353-N356 PolarHBondContact O-N 2.75Å; L354-N356 VanDerWaalsContact C-N 3.32Å; L354-N356 PolarHBondContact O-N 2.88Å; N356-A358 VanDerWaalsContact C-N 3.29Å; N356-A358 PolarHBondContact O-N 2.8Å; N356-T359 PolarHBondContact O-N 3.16Å; N356-T359 VanDerWaalsContact O-N 3.13Å; N356-M360 WeakPolarHBondContact O-CG 3.44Å; N356-M360 PolarHBondContact O-N 2.93Å; N356-L633 HydrophobicContact CB-CD1 3.87Å; N356-L633 HydrophobicContact CB-CD2 4.5Å; N356-L633 HydrophobicContact CB-CG 4.1Å; N356-L633 WeakPolarHBondContact OD1-CD1 3.36Å; N356-L633 VanDerWaalsContact OD1-CG 3.26Å; N356-L633 WeakPolarHBondContact OD1-CG 3.41Å; N356-G634 WeakPolarHBondContact OD1-CA 3.34Å; N356-G634 PolarHBondContact OD1-N 2.6Å; N356-H638 WeakPolarHBondContact CA-CE1 3.4Å; N356-H638 PolarHBondContact N-CE1 2.99Å; N356-H638 PolarHBondContact OD1-CE1 2.94Å; N356-H638 PolarHBondContact OD1-ND1 2.89Å
357	I	90.6	Very high	86.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-58.6	-39.4	173.8	-66.6	170.3	0	0	0	111.8	L339 L343 V353 L354 T359 M360 S361 F368 F375 I392	L339-I357 HydrophobicContact CB-CD1 4.12Å; L339-I357 HydrophobicContact CB-CG1 4.34Å; L339-I357 HydrophobicContact CD1-CG1 4.25Å; L343-I357 HydrophobicContact CD1-CD1 4.28Å; L343-I357 HydrophobicContact CD2-CD1 4.25Å; L343-I357 HydrophobicContact CG-CD1 4.5Å; V353-I357 HydrophobicContact CG1-CD1 3.78Å; V353-I357 HydrophobicContact CG1-CG1 4.4Å; V353-I357 WeakPolarHBondContact O-CG1 3.16Å; V353-I357 PolarHBondContact O-N 2.9Å; L354-I357 PolarHBondContact O-N 2.92Å; I357-T359 PolarHBondContact O-N 2.79Å; I357-M360 PolarHBondContact O-N 2.68Å; I357-S361 WeakPolarHBondContact O-CB 3.12Å; I357-S361 PolarHBondContact O-N 2.76Å; I357-S361 PolarHBondContact O-OG 2.79Å; I357-F368 HydrophobicContact CB-CE1 4.34Å; I357-F368 HydrophobicContact CB-CZ 4.23Å; I357-F368 HydrophobicContact CD1-CE1 4.19Å; I357-F368 HydrophobicContact CG1-CE1 3.82Å; I357-F368 HydrophobicContact CG1-CZ 3.94Å; I357-F368 HydrophobicContact CG2-CD1 3.92Å; I357-F368 HydrophobicContact CG2-CD2 4.2Å; I357-F368 HydrophobicContact CG2-CE1 3.75Å; I357-F368 HydrophobicContact CG2-CE2 4.02Å; I357-F368 HydrophobicContact CG2-CG 4.16Å; I357-F368 HydrophobicContact CG2-CZ 3.8Å; I357-F375 HydrophobicContact CD1-CE1 3.92Å; I357-F375 HydrophobicContact CD1-CZ 4.21Å; I357-F375 HydrophobicContact CG2-CE1 3.82Å; I357-F375 HydrophobicContact CG2-CZ 3.91Å; I357-I392 HydrophobicContact CB-CD1 4.19Å; I357-I392 HydrophobicContact CG2-CD1 3.85Å; I357-I392 HydrophobicContact CG2-CG1 4.17Å; I357-I392 HydrophobicContact CG2-CG2 4.2Å
358	A	88.1	Confident	86.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.5	-29.4	178.7	0	0	0	0	0	112.9	L354 N356 S361 I362 I392 N395 F611	L354-A358 VanDerWaalsContact O-CB 3.31Å; L354-A358 WeakPolarHBondContact O-CB 3.23Å; L354-A358 PolarHBondContact O-N 3.38Å; N356-A358 VanDerWaalsContact C-N 3.29Å; N356-A358 PolarHBondContact O-N 2.8Å; A358-S361 PolarHBondContact O-OG 2.99Å; A358-I362 WeakPolarHBondContact O-CG1 3.45Å; A358-I392 HydrophobicContact CB-CD1 4.35Å; A358-I392 HydrophobicContact CB-CG1 3.82Å; A358-N395 PolarHBondContact O-ND2 3.02Å; A358-F611 HydrophobicContact CB-CD1 3.74Å; A358-F611 HydrophobicContact CB-CE1 3.53Å; A358-F611 HydrophobicContact CB-CZ 4.27Å
359	T	85.3	Confident	86.4	Confident	4 Å²	4	29.7 Å²	29.7	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-79.9	-46.7	173.6	-47.9	0	0	0	0	110.5	Q355 N356 I357 S361 I362 R628 H638	Q355-T359 PolarHBondContact O-N 2.86Å; Q355-T359 PolarHBondContact O-OG1 3.24Å; N356-T359 PolarHBondContact O-N 3.16Å; N356-T359 VanDerWaalsContact O-N 3.13Å; I357-T359 PolarHBondContact O-N 2.79Å; T359-S361 PolarHBondContact O-N 3.07Å; T359-I362 PolarHBondContact O-N 3.5Å; T359-R628 HydrophobicContact CG2-CG 4.08Å; T359-R628 WeakPolarHBondContact OG1-CD 3.46Å; T359-H638 WeakPolarHBondContact CB-NE2 3.22Å; T359-H638 WeakPolarHBondContact CG2-NE2 3.46Å; T359-H638 PolarHBondContact OG1-CE1 2.95Å; T359-H638 PolarHBondContact OG1-NE2 3.12Å
360	M	86	Confident	86.2	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-58.2	-34.7	177	-67	169.9	127.8	0	0	113	W324 L339 N356 I357 R364 M367 F368 L633	W324-M360 HydrophobicContact CB-CE 4Å; W324-M360 HydrophobicContact CD2-CE 3.88Å; W324-M360 HydrophobicContact CD2-CG 4.08Å; W324-M360 HydrophobicContact CE3-CE 3.57Å; W324-M360 HydrophobicContact CE3-CG 3.9Å; W324-M360 HydrophobicContact CG-CE 4.09Å; W324-M360 HydrophobicContact CH2-CB 3.94Å; W324-M360 HydrophobicContact CH2-CG 4Å; W324-M360 HydrophobicContact CZ2-CB 4.44Å; W324-M360 HydrophobicContact CZ2-CG 4.17Å; W324-M360 HydrophobicContact CZ3-CB 3.98Å; W324-M360 HydrophobicContact CZ3-CE 4.32Å; W324-M360 HydrophobicContact CZ3-CG 3.87Å; L339-M360 HydrophobicContact CD1-CE 4.08Å; L339-M360 HydrophobicContact CD1-SD 3.68Å; N356-M360 WeakPolarHBondContact O-CG 3.44Å; N356-M360 PolarHBondContact O-N 2.93Å; I357-M360 PolarHBondContact O-N 2.68Å; M360-R364 PolarHBondContact O-N 2.96Å; M360-M367 HydrophobicContact CB-CE 4.06Å; M360-F368 HydrophobicContact CB-CE2 3.75Å; M360-F368 HydrophobicContact CB-CZ 4.17Å; M360-F368 HydrophobicContact SD-CZ 4.04Å; M360-L633 HydrophobicContact CE-CD2 3.54Å; M360-L633 HydrophobicContact CG-CD1 4.39Å; M360-L633 HydrophobicContact CG-CD2 3.94Å; M360-L633 HydrophobicContact SD-CD2 3.9Å
361	S	86.7	Confident	86.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-73.8	-21.6	-178.3	66.7	0	0	0	0	114.2	I357 A358 T359 K365 N395	I357-S361 WeakPolarHBondContact O-CB 3.12Å; I357-S361 PolarHBondContact O-N 2.76Å; I357-S361 PolarHBondContact O-OG 2.79Å; A358-S361 PolarHBondContact O-OG 2.99Å; T359-S361 PolarHBondContact O-N 3.07Å; S361-K365 WeakPolarHBondContact O-CA 3.47Å; S361-K365 WeakPolarHBondContact O-CG 3.27Å; S361-K365 PolarHBondContact O-N 2.66Å; S361-N395 PolarHBondContact OG-ND2 3.01Å; S361-N395 VanDerWaalsContact OG-ND2 3.1Å
362	I	83.9	Confident	86	Confident	49 Å²	49	32.9 Å²	32.9	25%	0.251	18%	0.176	S	C	.	.	H	α-helix	trans	-70.8	-50.7	173.2	-66	172.7	0	0	0	109.8	A358 T359 N395 F611	A358-I362 WeakPolarHBondContact O-CG1 3.45Å; T359-I362 PolarHBondContact O-N 3.5Å; I362-N395 VanDerWaalsContact CG1-ND2 3.32Å; I362-N395 WeakPolarHBondContact CG1-ND2 3.44Å; I362-F611 HydrophobicContact CD1-CB 3.52Å
363	Q	78.1	Confident	85.9	Confident	96 Å²	96	38.3 Å²	38.3	45%	0.449	20%	0.195	S	C	.	.	H	α-helix	trans	-74.8	-33	-178.4	-60	-172.6	14.5	0	0	113.1	W324 D629	W324-Q363 HydrophobicContact CH2-CB 4.07Å; W324-Q363 HydrophobicContact CZ2-CB 4.25Å; W324-Q363 HydrophobicContact CZ2-CG 4.42Å; Q363-D629 PolarHBondContact NE2-OD1 3.37Å
364	R	76.7	Confident	85.8	Confident	46 Å²	46	40.2 Å²	40.2	17%	0.174	21%	0.209	C	C	.	.			trans	-141.2	68.6	-173.3	-60.7	-166.7	-174	-165.3	7.2	113.3	W261 W324 K329 M360 G366 M367	W261-R364 VanDerWaalsContact CZ3-NH2 3.25Å; W324-R364 HydrophobicContact CH2-CB 4.47Å; W324-R364 HydrophobicContact CH2-CG 4.08Å; W324-R364 HydrophobicContact CZ3-CG 4.21Å; K329-R364 PolarHBondContact O-NH1 2.86Å; M360-R364 PolarHBondContact O-N 2.96Å; R364-G366 PolarHBondContact O-N 3.27Å; R364-M367 HydrophobicContact CB-CE 4.11Å; R364-M367 HydrophobicContact CB-CG 3.94Å; R364-M367 HydrophobicContact CB-SD 3.96Å; R364-M367 PolarHBondContact O-N 2.89Å
365	K	77.9	Confident	85.9	Confident	79 Å²	79	40.2 Å²	40.2	34%	0.343	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-43.6	-53.2	179.8	-65.7	-172.1	173.8	-155.9	0	114.5	S361 M367 F368 N395 L396 A397	S361-K365 WeakPolarHBondContact O-CA 3.47Å; S361-K365 WeakPolarHBondContact O-CG 3.27Å; S361-K365 PolarHBondContact O-N 2.66Å; K365-M367 PolarHBondContact O-N 3.08Å; K365-F368 PolarHBondContact O-N 2.87Å; K365-N395 VanDerWaalsContact CD-O 3.27Å; K365-N395 WeakPolarHBondContact CD-O 3.23Å; K365-N395 WeakPolarHBondContact CE-O 3.5Å; K365-N395 PolarHBondContact NZ-O 2.95Å; K365-L396 HydrophobicContact CB-CD2 4.48Å; K365-L396 WeakPolarHBondContact O-CD2 3.49Å; K365-A397 PolarHBondContact NZ-O 2.97Å
366	G	77.6	Confident	86	Confident	52 Å²	52	43 Å²	43	54%	0.536	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-60.4	-16.5	-170.7	0	0	0	0	0	115.8	R364 F368	R364-G366 PolarHBondContact O-N 3.27Å; G366-F368 VanDerWaalsContact C-N 3.33Å; G366-F368 PolarHBondContact O-N 3.23Å
367	M	82.8	Confident	86.2	Confident	19 Å²	19	43.8 Å²	43.8	9%	0.094	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-64.8	-34.4	179.1	-59.6	-165.7	-42.1	0	0	113.1	W324 V332 T336 M360 R364 K365	W324-M367 HydrophobicContact CE3-CE 4.36Å; W324-M367 HydrophobicContact CZ3-CE 3.67Å; W324-M367 HydrophobicContact CZ3-SD 4.31Å; V332-M367 HydrophobicContact CB-SD 4.41Å; V332-M367 HydrophobicContact CG1-CE 4.45Å; V332-M367 HydrophobicContact CG1-SD 3.73Å; T336-M367 WeakPolarHBondContact CG2-O 3.45Å; M360-M367 HydrophobicContact CB-CE 4.06Å; R364-M367 HydrophobicContact CB-CE 4.11Å; R364-M367 HydrophobicContact CB-CG 3.94Å; R364-M367 HydrophobicContact CB-SD 3.96Å; R364-M367 PolarHBondContact O-N 2.89Å; K365-M367 PolarHBondContact O-N 3.08Å
368	F	87.8	Confident	86.1	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-8.4	-171.8	-63	-80.7	0	0	0	114.4	T336 L339 I357 M360 K365 G366 Y371 M372 F375 L396	T336-F368 HydrophobicContact CG2-CD1 3.63Å; T336-F368 HydrophobicContact CG2-CE1 3.86Å; T336-F368 HydrophobicContact CG2-CG 4.36Å; L339-F368 HydrophobicContact CD1-CE1 4.32Å; L339-F368 HydrophobicContact CD1-CZ 4.18Å; I357-F368 HydrophobicContact CB-CE1 4.34Å; I357-F368 HydrophobicContact CB-CZ 4.23Å; I357-F368 HydrophobicContact CD1-CE1 4.19Å; I357-F368 HydrophobicContact CG1-CE1 3.82Å; I357-F368 HydrophobicContact CG1-CZ 3.94Å; I357-F368 HydrophobicContact CG2-CD1 3.92Å; I357-F368 HydrophobicContact CG2-CD2 4.2Å; I357-F368 HydrophobicContact CG2-CE1 3.75Å; I357-F368 HydrophobicContact CG2-CE2 4.02Å; I357-F368 HydrophobicContact CG2-CG 4.16Å; I357-F368 HydrophobicContact CG2-CZ 3.8Å; M360-F368 HydrophobicContact CB-CE2 3.75Å; M360-F368 HydrophobicContact CB-CZ 4.17Å; M360-F368 HydrophobicContact SD-CZ 4.04Å; K365-F368 PolarHBondContact O-N 2.87Å; G366-F368 VanDerWaalsContact C-N 3.33Å; G366-F368 PolarHBondContact O-N 3.23Å; F368-Y371 CarbonylContact O-C 3.49Å; F368-Y371 WeakPolarHBondContact O-CA 3.13Å; F368-Y371 PolarHBondContact O-N 2.82Å; F368-M372 PolarHBondContact O-N 3.08Å; F368-F375 HydrophobicContact CB-CE2 4.09Å; F368-F375 HydrophobicContact CB-CZ 4.39Å; F368-F375 HydrophobicContact CD1-CE2 4.35Å; F368-F375 AromaticContact CD1-CZ 3.89Å; F368-F375 HydrophobicContact CD1-CZ 3.89Å; F368-F375 HydrophobicContact CG-CZ 4.41Å; F368-L396 HydrophobicContact CB-CD1 3.8Å; F368-L396 HydrophobicContact CB-CD2 3.97Å
369	E	84.3	Confident	86	Confident	71 Å²	71	54.4 Å²	54.4	33%	0.332	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-54.3	-42.9	-178.7	-178.5	160.8	-140.2	0	0	114	Y371 M372 N398 N401	E369-Y371 PolarHBondContact O-N 2.99Å; E369-M372 WeakPolarHBondContact O-CB 3.43Å; E369-M372 PolarHBondContact O-N 3.37Å; E369-M372 VanDerWaalsContact O-N 3.16Å; E369-N398 VanDerWaalsContact CD-ND2 3.31Å; E369-N398 PolarHBondContact OE1-ND2 3.31Å; E369-N398 PolarHBondContact OE2-ND2 3.39Å; E369-N401 PolarHBondContact OE1-ND2 3.15Å
370	P	86.8	Confident	86.1	Confident	105 Å²	105	59.9 Å²	59.9	68%	0.682	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-60.1	-18.9	174.9	-24.5	35.4	0	0	0	114.5
371	Y	88.5	Confident	86.3	Confident	82 Å²	82	60.4 Å²	60.4	32%	0.322	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-109.6	11.8	-176.6	-60.8	-69.5	0	0	0	113.5	T336 V340 F368 E369 K373 S374 F375	T336-Y371 HydrophobicContact CG2-CD2 3.48Å; T336-Y371 VanDerWaalsContact CG2-CD2 3.48Å; T336-Y371 HydrophobicContact CG2-CE2 3.63Å; V340-Y371 HydrophobicContact CG1-CD1 4.2Å; V340-Y371 HydrophobicContact CG1-CG 4.37Å; V340-Y371 HydrophobicContact CG2-CD2 4.24Å; V340-Y371 HydrophobicContact CG2-CG 4Å; F368-Y371 CarbonylContact O-C 3.49Å; F368-Y371 WeakPolarHBondContact O-CA 3.13Å; F368-Y371 PolarHBondContact O-N 2.82Å; E369-Y371 PolarHBondContact O-N 2.99Å; Y371-K373 PolarHBondContact O-N 2.98Å; Y371-S374 WeakPolarHBondContact O-CB 3.36Å; Y371-S374 PolarHBondContact O-N 3.34Å; Y371-S374 PolarHBondContact O-OG 3.47Å; Y371-F375 WeakPolarHBondContact O-CD2 3.37Å
372	M	89.3	Confident	86.5	Confident	25 Å²	25	61.8 Å²	61.8	12%	0.123	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-43.8	-45.7	-177.8	-175.6	175.3	70.7	0	0	113.8	F368 E369 S374 F375 Y376 L393 N401 I405	F368-M372 PolarHBondContact O-N 3.08Å; E369-M372 WeakPolarHBondContact O-CB 3.43Å; E369-M372 PolarHBondContact O-N 3.37Å; E369-M372 VanDerWaalsContact O-N 3.16Å; M372-S374 PolarHBondContact O-N 3.41Å; M372-S374 VanDerWaalsContact O-N 3.1Å; M372-F375 PolarHBondContact O-N 3.38Å; M372-Y376 HydrophobicContact CG-CE1 4.15Å; M372-L393 HydrophobicContact CG-CD2 3.84Å; M372-N401 HydrophobicContact CE-CB 4.35Å; M372-N401 HydrophobicContact SD-CB 4.21Å; M372-I405 HydrophobicContact SD-CD1 3.81Å; M372-I405 HydrophobicContact SD-CG1 3.81Å
373	K	90.6	Very high	86.7	Confident	168 Å²	168	62.3 Å²	62.3	73%	0.73	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-60	-20.8	179.4	-62.6	180	-178.2	176.8	0	114.7	Y371 F375 Y376	Y371-K373 PolarHBondContact O-N 2.98Å; K373-F375 VanDerWaalsContact C-N 3.33Å; K373-Y376 HydrophobicContact CB-CE2 4.38Å; K373-Y376 HydrophobicContact CG-CE2 4.18Å
374	S	90.1	Very high	87.2	Confident	41 Å²	41	61.7 Å²	61.7	29%	0.287	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-77.4	-19.9	176.6	71.4	0	0	0	0	113.3	Y371 M372	Y371-S374 WeakPolarHBondContact O-CB 3.36Å; Y371-S374 PolarHBondContact O-N 3.34Å; Y371-S374 PolarHBondContact O-OG 3.47Å; M372-S374 PolarHBondContact O-N 3.41Å; M372-S374 VanDerWaalsContact O-N 3.1Å
375	F	92.8	Very high	88	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-88.9	-2.2	177.8	-58.9	-74.4	0	0	0	113.2	V340 L343 L354 I357 F368 Y371 M372 K373 K389 I392 L393 L396	V340-F375 HydrophobicContact CG2-CZ 4.22Å; L343-F375 HydrophobicContact CD1-CD1 4.12Å; L343-F375 HydrophobicContact CD1-CE1 3.63Å; L343-F375 HydrophobicContact CD1-CZ 4.24Å; L354-F375 HydrophobicContact CD2-CD1 3.92Å; L354-F375 HydrophobicContact CD2-CE1 4.06Å; I357-F375 HydrophobicContact CD1-CE1 3.92Å; I357-F375 HydrophobicContact CD1-CZ 4.21Å; I357-F375 HydrophobicContact CG2-CE1 3.82Å; I357-F375 HydrophobicContact CG2-CZ 3.91Å; F368-F375 HydrophobicContact CB-CE2 4.09Å; F368-F375 HydrophobicContact CB-CZ 4.39Å; F368-F375 HydrophobicContact CD1-CE2 4.35Å; F368-F375 AromaticContact CD1-CZ 3.89Å; F368-F375 HydrophobicContact CD1-CZ 3.89Å; F368-F375 HydrophobicContact CG-CZ 4.41Å; Y371-F375 WeakPolarHBondContact O-CD2 3.37Å; M372-F375 PolarHBondContact O-N 3.38Å; K373-F375 VanDerWaalsContact C-N 3.33Å; F375-K389 VanDerWaalsContact O-CB 3.3Å; F375-K389 WeakPolarHBondContact O-CB 3.41Å; F375-K389 VanDerWaalsContact O-CD 3.31Å; F375-K389 WeakPolarHBondContact O-CD 3.45Å; F375-K389 WeakPolarHBondContact O-CG 3.5Å; F375-I392 HydrophobicContact CB-CG2 4.47Å; F375-I392 HydrophobicContact CD1-CB 4.42Å; F375-I392 HydrophobicContact CD1-CD1 3.98Å; F375-I392 HydrophobicContact CD1-CG2 3.8Å; F375-I392 HydrophobicContact CD2-CG2 4.19Å; F375-I392 HydrophobicContact CE1-CD1 4.11Å; F375-I392 HydrophobicContact CE1-CG2 4.04Å; F375-I392 HydrophobicContact CE2-CG2 4.41Å; F375-I392 HydrophobicContact CG-CG2 3.88Å; F375-I392 HydrophobicContact CZ-CG2 4.34Å; F375-L393 HydrophobicContact CB-CD2 4Å; F375-L393 HydrophobicContact CB-CG 4.1Å; F375-L396 HydrophobicContact CD2-CD1 4.32Å; F375-L396 HydrophobicContact CE2-CD1 4.4Å
376	Y	93.2	Very high	88.7	Confident	63 Å²	63	57.2 Å²	57.2	25%	0.247	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-61.5	140.1	175.7	-66.1	-0.8	0	0	0	111.1	M372 K373 K389 L393	M372-Y376 HydrophobicContact CG-CE1 4.15Å; K373-Y376 HydrophobicContact CB-CE2 4.38Å; K373-Y376 HydrophobicContact CG-CE2 4.18Å; Y376-K389 PolarHBondContact O-NZ 3.02Å; Y376-L393 HydrophobicContact CD1-CD1 4.28Å; Y376-L393 HydrophobicContact CD1-CD2 4.06Å; Y376-L393 HydrophobicContact CE1-CD2 4.13Å
377	V	92.3	Very high	89.3	Confident	18 Å²	18	57.2 Å²	57.2	11%	0.109	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-83.7	128	-174.1	178.6	0	0	0	0	110.4	K386 K389 Y412 F420	V377-K386 HydrophobicContact CG1-CB 3.85Å; V377-K386 HydrophobicContact CG1-CD 3.65Å; V377-K386 HydrophobicContact CG1-CG 3.52Å; V377-K389 HydrophobicContact CG2-CB 3.68Å; V377-K389 HydrophobicContact CG2-CD 3.95Å; V377-K389 HydrophobicContact CG2-CG 4.5Å; V377-Y412 HydrophobicContact CB-CE1 3.95Å; V377-Y412 HydrophobicContact CB-CE2 3.95Å; V377-Y412 HydrophobicContact CG2-CD2 4.46Å; V377-Y412 HydrophobicContact CG2-CE2 3.74Å; V377-Y412 PolarHBondContact N-OH 3.23Å; V377-F420 HydrophobicContact CB-CZ 4.28Å; V377-F420 HydrophobicContact CG1-CE1 4.21Å; V377-F420 HydrophobicContact CG1-CZ 4Å; V377-F420 HydrophobicContact CG2-CE2 4.46Å; V377-F420 HydrophobicContact CG2-CZ 3.97Å
378	R	89.6	Confident	89.7	Confident	112 Å²	112	56.7 Å²	56.7	42%	0.423	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-93	152.4	172.9	-60.1	167.2	-66.4	-125.3	0.4	109.8	T380 D381 K386	R378-T380 PolarHBondContact O-N 3.26Å; R378-D381 IonicContact CZ-OD1 3.6Å; R378-D381 IonicContact CZ-OD2 2.65Å; R378-D381 PolarHBondContact N-OD2 2.68Å; R378-D381 IonicContact NE-OD1 3.73Å; R378-D381 PolarHBondContact NE-OD1 3.14Å; R378-D381 IonicContact NE-OD2 3.9Å; R378-D381 PolarHBondContact NE-OD2 3.45Å; R378-D381 IonicContact NH2-OD1 2.71Å; R378-D381 PolarHBondContact NH2-OD1 3.23Å; R378-D381 IonicContact NH2-OD2 3.85Å; R378-D381 WeakPolarHBondContact O-CB 3.25Å; R378-D381 PolarHBondContact O-N 3.12Å; R378-D381 VanDerWaalsContact O-N 3.11Å; R378-K386 VanDerWaalsContact O-CE 3.26Å; R378-K386 WeakPolarHBondContact O-CE 3.4Å
379	S	85.5	Confident	90	Very high	110 Å²	110	56.9 Å²	56.9	77%	0.769	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-40.9	172	48.8	0	0	0	0	112.1	D381 K386	S379-D381 VanDerWaalsContact C-N 3.33Å; S379-D381 PolarHBondContact O-N 2.68Å; S379-K386 PolarHBondContact O-NZ 3.15Å
380	T	88.1	Confident	90.4	Very high	120 Å²	120	53.6 Å²	53.6	74%	0.736	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-11.3	179.8	51.8	0	0	0	0	115.8	R378	R378-T380 PolarHBondContact O-N 3.26Å
381	D	89.9	Confident	90.6	Very high	12 Å²	12	49.3 Å²	49.3	6%	0.064	26%	0.257	C	S	.	.	S	Bend	trans	-72.6	138.9	179.3	-66	-25.1	0	0	0	110.7	R378 S379 I385 K386 K389	R378-D381 IonicContact CZ-OD1 3.6Å; R378-D381 IonicContact CZ-OD2 2.65Å; R378-D381 PolarHBondContact N-OD2 2.68Å; R378-D381 IonicContact NE-OD1 3.73Å; R378-D381 PolarHBondContact NE-OD1 3.14Å; R378-D381 IonicContact NE-OD2 3.9Å; R378-D381 PolarHBondContact NE-OD2 3.45Å; R378-D381 IonicContact NH2-OD1 2.71Å; R378-D381 PolarHBondContact NH2-OD1 3.23Å; R378-D381 IonicContact NH2-OD2 3.85Å; R378-D381 WeakPolarHBondContact O-CB 3.25Å; R378-D381 PolarHBondContact O-N 3.12Å; R378-D381 VanDerWaalsContact O-N 3.11Å; S379-D381 VanDerWaalsContact C-N 3.33Å; S379-D381 PolarHBondContact O-N 2.68Å; D381-I385 HydrophobicContact CB-CB 4.45Å; D381-I385 HydrophobicContact CB-CG2 3.94Å; D381-K386 HydrophobicContact CB-CG 4.05Å; D381-K386 VanDerWaalsContact O-CE 3.31Å; D381-K386 WeakPolarHBondContact O-CE 3.44Å; D381-K386 WeakPolarHBondContact O-CG 3.46Å; D381-K386 PolarHBondContact O-NZ 3.38Å; D381-K389 IonicContact OD2-NZ 2.68Å; D381-K389 PolarHBondContact OD2-NZ 3.3Å
382	A	90.1	Very high	90.7	Very high	29 Å²	29	45.4 Å²	45.4	24%	0.24	24%	0.242	C	C	.	.			trans	-69.1	150.3	176.2	0	0	0	0	0	111.8	H384 I385 K386	A382-H384 VanDerWaalsContact C-N 3.28Å; A382-H384 PolarHBondContact O-N 3.45Å; A382-H384 VanDerWaalsContact O-N 3.11Å; A382-I385 WeakPolarHBondContact O-CA 3.47Å; A382-I385 WeakPolarHBondContact O-CB 3.47Å; A382-I385 PolarHBondContact O-N 2.95Å; A382-K386 PolarHBondContact O-N 2.95Å
383	T	89.4	Confident	90.9	Very high	61 Å²	61	44.3 Å²	44.3	37%	0.374	24%	0.236	S	C	.	.	H	α-helix	trans	-49.8	-42.2	-173.1	-53.1	0	0	0	0	114	I385 K386 T387 D417	T383-I385 VanDerWaalsContact C-N 3.3Å; T383-I385 PolarHBondContact O-N 2.93Å; T383-K386 WeakPolarHBondContact O-CB 3.28Å; T383-K386 PolarHBondContact O-N 3.17Å; T383-K386 VanDerWaalsContact O-N 3.11Å; T383-T387 PolarHBondContact O-N 3.36Å; T383-T387 PolarHBondContact O-OG1 2.84Å; T383-D417 WeakPolarHBondContact CB-OD2 3.27Å; T383-D417 WeakPolarHBondContact CG2-OD2 3.46Å; T383-D417 PolarHBondContact OG1-OD2 2.95Å
384	H	88.6	Confident	90.9	Very high	82 Å²	82	36.4 Å²	36.4	38%	0.38	20%	0.203	S	C	.	.	H	α-helix	trans	-67.5	-24.2	177.1	52.5	-102.2	0	0	0	114.2	Y351 A382 T387 L388	Y351-H384 HydrophobicContact CD2-CB 4.34Å; Y351-H384 AromaticContact CD2-CD2 3.77Å; Y351-H384 HydrophobicContact CE2-CB 4.19Å; A382-H384 VanDerWaalsContact C-N 3.28Å; A382-H384 PolarHBondContact O-N 3.45Å; A382-H384 VanDerWaalsContact O-N 3.11Å; H384-T387 PolarHBondContact O-OG1 3.32Å; H384-L388 WeakPolarHBondContact O-CD1 3.44Å; H384-L388 VanDerWaalsContact O-CG 3.28Å; H384-L388 WeakPolarHBondContact O-CG 3.44Å; H384-L388 PolarHBondContact O-N 3.03Å
385	I	92.4	Very high	90.8	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-80.2	-39.6	168	-72.6	-179.7	0	0	0	110.3	R347 Q350 L354 D381 A382 T383 T387 L388 K389	R347-I385 HydrophobicContact CB-CD1 4.44Å; R347-I385 HydrophobicContact CG-CD1 3.67Å; Q350-I385 HydrophobicContact CB-CD1 3.79Å; L354-I385 HydrophobicContact CD1-CB 4.43Å; L354-I385 HydrophobicContact CD1-CG1 4.34Å; L354-I385 HydrophobicContact CD1-CG2 3.78Å; D381-I385 HydrophobicContact CB-CB 4.45Å; D381-I385 HydrophobicContact CB-CG2 3.94Å; A382-I385 WeakPolarHBondContact O-CA 3.47Å; A382-I385 WeakPolarHBondContact O-CB 3.47Å; A382-I385 PolarHBondContact O-N 2.95Å; T383-I385 VanDerWaalsContact C-N 3.3Å; T383-I385 PolarHBondContact O-N 2.93Å; I385-T387 PolarHBondContact O-N 3.07Å; I385-L388 PolarHBondContact O-N 3.41Å; I385-K389 HydrophobicContact CG2-CD 4.03Å; I385-K389 HydrophobicContact CG2-CG 4.36Å; I385-K389 WeakPolarHBondContact O-CB 3.31Å; I385-K389 WeakPolarHBondContact O-CG 3.22Å; I385-K389 PolarHBondContact O-N 3.27Å
386	K	92.3	Very high	90.6	Very high	29 Å²	29	35.4 Å²	35.4	13%	0.126	19%	0.194	C	C	.	.	H	α-helix	trans	-57.4	-47.4	177.2	-59.4	-158	159.8	93.5	0	111.2	V377 R378 S379 D381 A382 T383 L390 F420	V377-K386 HydrophobicContact CG1-CB 3.85Å; V377-K386 HydrophobicContact CG1-CD 3.65Å; V377-K386 HydrophobicContact CG1-CG 3.52Å; R378-K386 VanDerWaalsContact O-CE 3.26Å; R378-K386 WeakPolarHBondContact O-CE 3.4Å; S379-K386 PolarHBondContact O-NZ 3.15Å; D381-K386 HydrophobicContact CB-CG 4.05Å; D381-K386 VanDerWaalsContact O-CE 3.31Å; D381-K386 WeakPolarHBondContact O-CE 3.44Å; D381-K386 WeakPolarHBondContact O-CG 3.46Å; D381-K386 PolarHBondContact O-NZ 3.38Å; A382-K386 PolarHBondContact O-N 2.95Å; T383-K386 WeakPolarHBondContact O-CB 3.28Å; T383-K386 PolarHBondContact O-N 3.17Å; T383-K386 VanDerWaalsContact O-N 3.11Å; K386-L390 WeakPolarHBondContact O-CB 3.48Å; K386-L390 PolarHBondContact O-N 2.78Å; K386-F420 HydrophobicContact CB-CD1 4.35Å; K386-F420 HydrophobicContact CB-CD2 3.54Å; K386-F420 HydrophobicContact CB-CE1 4.39Å; K386-F420 HydrophobicContact CB-CE2 3.6Å; K386-F420 HydrophobicContact CB-CG 3.95Å; K386-F420 HydrophobicContact CB-CZ 4.04Å; K386-F420 HydrophobicContact CD-CD1 3.81Å; K386-F420 HydrophobicContact CD-CD2 4.49Å; K386-F420 HydrophobicContact CD-CE1 4.04Å; K386-F420 HydrophobicContact CD-CG 4.05Å; K386-F420 HydrophobicContact CD-CZ 4.49Å; K386-F420 WeakPolarHBondContact O-CE2 3.47Å
387	T	91.6	Very high	90.4	Very high	52 Å²	52	32.8 Å²	32.8	32%	0.319	19%	0.185	S	C	.	.	H	α-helix	trans	-67.6	-41.1	178.2	53.4	0	0	0	0	113.2	T383 H384 I385 L390 E391 F420 A423	T383-T387 PolarHBondContact O-N 3.36Å; T383-T387 PolarHBondContact O-OG1 2.84Å; H384-T387 PolarHBondContact O-OG1 3.32Å; I385-T387 PolarHBondContact O-N 3.07Å; T387-L390 WeakPolarHBondContact O-CB 3.45Å; T387-L390 PolarHBondContact O-N 2.96Å; T387-E391 PolarHBondContact O-N 3.05Å; T387-F420 HydrophobicContact CG2-CD2 4.3Å; T387-A423 HydrophobicContact CG2-CB 4.26Å
388	L	91.3	Very high	90.2	Very high	9 Å²	9	34 Å²	34	5%	0.047	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-45.6	174.7	-80.4	174.3	0	0	0	112.6	Y351 L354 Q355 H384 I385 L390 E391 I392 F611	Y351-L388 HydrophobicContact CD2-CD1 3.42Å; Y351-L388 VanDerWaalsContact CD2-CD1 3.42Å; Y351-L388 HydrophobicContact CE2-CD1 3.67Å; Y351-L388 HydrophobicContact CG-CD1 4.27Å; L354-L388 HydrophobicContact CB-CB 4.03Å; L354-L388 HydrophobicContact CB-CD1 3.91Å; L354-L388 HydrophobicContact CD1-CB 4.44Å; Q355-L388 HydrophobicContact CB-CD1 4.43Å; Q355-L388 HydrophobicContact CB-CD2 4.34Å; H384-L388 WeakPolarHBondContact O-CD1 3.44Å; H384-L388 VanDerWaalsContact O-CG 3.28Å; H384-L388 WeakPolarHBondContact O-CG 3.44Å; H384-L388 PolarHBondContact O-N 3.03Å; I385-L388 PolarHBondContact O-N 3.41Å; L388-L390 VanDerWaalsContact C-N 3.33Å; L388-L390 PolarHBondContact O-N 2.79Å; L388-E391 PolarHBondContact O-N 3.25Å; L388-I392 WeakPolarHBondContact O-CD1 3.39Å; L388-I392 VanDerWaalsContact O-CG1 3.31Å; L388-I392 WeakPolarHBondContact O-CG1 3.31Å; L388-I392 PolarHBondContact O-N 3.41Å; L388-F611 HydrophobicContact CD2-CE1 4.05Å; L388-F611 HydrophobicContact CD2-CE2 4.37Å; L388-F611 HydrophobicContact CD2-CZ 3.45Å; L388-F611 VanDerWaalsContact CD2-CZ 3.45Å
389	K	93.4	Very high	89.9	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.017	20%	0.202	C	C	.	.	H	α-helix	trans	-59.2	-43.8	175.3	-84.4	-179.4	167.5	-167.5	0	112.2	L354 F375 Y376 V377 D381 I385 I392 L393	L354-K389 HydrophobicContact CD1-CG 4.13Å; L354-K389 HydrophobicContact CD2-CG 4.18Å; F375-K389 VanDerWaalsContact O-CB 3.3Å; F375-K389 WeakPolarHBondContact O-CB 3.41Å; F375-K389 VanDerWaalsContact O-CD 3.31Å; F375-K389 WeakPolarHBondContact O-CD 3.45Å; F375-K389 WeakPolarHBondContact O-CG 3.5Å; Y376-K389 PolarHBondContact O-NZ 3.02Å; V377-K389 HydrophobicContact CG2-CB 3.68Å; V377-K389 HydrophobicContact CG2-CD 3.95Å; V377-K389 HydrophobicContact CG2-CG 4.5Å; D381-K389 IonicContact OD2-NZ 2.68Å; D381-K389 PolarHBondContact OD2-NZ 3.3Å; I385-K389 HydrophobicContact CG2-CD 4.03Å; I385-K389 HydrophobicContact CG2-CG 4.36Å; I385-K389 WeakPolarHBondContact O-CB 3.31Å; I385-K389 WeakPolarHBondContact O-CG 3.22Å; I385-K389 PolarHBondContact O-N 3.27Å; K389-I392 PolarHBondContact O-N 2.98Å; K389-L393 WeakPolarHBondContact O-CG 3.48Å; K389-L393 PolarHBondContact O-N 3.33Å
390	L	93.4	Very high	90	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-44.5	176.3	175.6	73	0	0	0	112.4	K386 T387 L388 I392 L393 T394 F409 Y412 F420 A423 T424 A427	K386-L390 WeakPolarHBondContact O-CB 3.48Å; K386-L390 PolarHBondContact O-N 2.78Å; T387-L390 WeakPolarHBondContact O-CB 3.45Å; T387-L390 PolarHBondContact O-N 2.96Å; L388-L390 VanDerWaalsContact C-N 3.33Å; L388-L390 PolarHBondContact O-N 2.79Å; L390-I392 VanDerWaalsContact C-N 3.33Å; L390-I392 PolarHBondContact O-N 3.1Å; L390-L393 PolarHBondContact O-N 3.08Å; L390-T394 WeakPolarHBondContact O-CB 3.44Å; L390-T394 PolarHBondContact O-N 3.47Å; L390-T394 PolarHBondContact O-OG1 3.21Å; L390-F409 HydrophobicContact CD1-CD1 3.94Å; L390-F409 HydrophobicContact CD1-CE1 3.49Å; L390-F409 VanDerWaalsContact CD1-CE1 3.49Å; L390-F409 HydrophobicContact CD1-CE2 4.21Å; L390-F409 HydrophobicContact CD1-CG 4.48Å; L390-F409 HydrophobicContact CD1-CZ 3.64Å; L390-Y412 HydrophobicContact CD1-CD2 4.38Å; L390-F420 HydrophobicContact CB-CE2 4.02Å; L390-F420 HydrophobicContact CD2-CD2 4.38Å; L390-F420 HydrophobicContact CD2-CE2 3.96Å; L390-F420 HydrophobicContact CG-CE2 4.47Å; L390-A423 VanDerWaalsContact CD2-C 3.47Å; L390-A423 HydrophobicContact CD2-CB 3.82Å; L390-T424 HydrophobicContact CD1-CG2 4.29Å; L390-A427 HydrophobicContact CD1-CB 3.75Å; L390-A427 HydrophobicContact CD2-CB 4.2Å; L390-A427 HydrophobicContact CG-CB 3.92Å
391	E	89.8	Confident	90.1	Very high	15 Å²	15	29.4 Å²	29.4	7%	0.07	17%	0.17	C	C	.	.	H	α-helix	trans	-61.6	-42.6	176.3	-160.3	82.6	160.7	0	0	110.6	T387 L388 T394 N395 R430 S609 A610 F611	T387-E391 PolarHBondContact O-N 3.05Å; L388-E391 PolarHBondContact O-N 3.25Å; E391-T394 WeakPolarHBondContact O-CB 3.39Å; E391-T394 PolarHBondContact O-N 3.43Å; E391-N395 VanDerWaalsContact O-CG 3.23Å; E391-N395 PolarHBondContact O-N 2.92Å; E391-N395 PolarHBondContact O-OD1 3.41Å; E391-R430 IonicContact OE1-CZ 2.71Å; E391-R430 IonicContact OE1-NH1 3.5Å; E391-R430 PolarHBondContact OE1-NH1 3.02Å; E391-R430 IonicContact OE1-NH2 3.69Å; E391-R430 IonicContact OE2-CZ 3.64Å; E391-R430 IonicContact OE2-NH1 3.96Å; E391-R430 PolarHBondContact OE2-NH1 3.19Å; E391-S609 WeakPolarHBondContact OE1-CA 3.44Å; E391-S609 WeakPolarHBondContact OE1-CB 3.46Å; E391-A610 PolarHBondContact OE1-N 3.31Å; E391-F611 HydrophobicContact CG-CD2 3.8Å; E391-F611 HydrophobicContact CG-CE2 4.18Å; E391-F611 HydrophobicContact CG-CG 4.4Å
392	I	91.6	Very high	90.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.6	-48.2	175	-65.4	159.8	0	0	0	111.3	L354 I357 A358 F375 L388 K389 L390 T394 N395 L396	L354-I392 HydrophobicContact CB-CD1 4.2Å; L354-I392 HydrophobicContact CD2-CD1 3.56Å; L354-I392 HydrophobicContact CG-CD1 4.5Å; I357-I392 HydrophobicContact CB-CD1 4.19Å; I357-I392 HydrophobicContact CG2-CD1 3.85Å; I357-I392 HydrophobicContact CG2-CG1 4.17Å; I357-I392 HydrophobicContact CG2-CG2 4.2Å; A358-I392 HydrophobicContact CB-CD1 4.35Å; A358-I392 HydrophobicContact CB-CG1 3.82Å; F375-I392 HydrophobicContact CB-CG2 4.47Å; F375-I392 HydrophobicContact CD1-CB 4.42Å; F375-I392 HydrophobicContact CD1-CD1 3.98Å; F375-I392 HydrophobicContact CD1-CG2 3.8Å; F375-I392 HydrophobicContact CD2-CG2 4.19Å; F375-I392 HydrophobicContact CE1-CD1 4.11Å; F375-I392 HydrophobicContact CE1-CG2 4.04Å; F375-I392 HydrophobicContact CE2-CG2 4.41Å; F375-I392 HydrophobicContact CG-CG2 3.88Å; F375-I392 HydrophobicContact CZ-CG2 4.34Å; L388-I392 WeakPolarHBondContact O-CD1 3.39Å; L388-I392 VanDerWaalsContact O-CG1 3.31Å; L388-I392 WeakPolarHBondContact O-CG1 3.31Å; L388-I392 PolarHBondContact O-N 3.41Å; K389-I392 PolarHBondContact O-N 2.98Å; L390-I392 VanDerWaalsContact C-N 3.33Å; L390-I392 PolarHBondContact O-N 3.1Å; I392-T394 PolarHBondContact O-N 3.09Å; I392-N395 PolarHBondContact O-N 3.25Å; I392-N395 VanDerWaalsContact O-N 3.17Å; I392-L396 HydrophobicContact CG2-CD1 3.75Å; I392-L396 HydrophobicContact CG2-CG 4.27Å; I392-L396 VanDerWaalsContact O-CG 3.28Å; I392-L396 WeakPolarHBondContact O-CG 3.32Å; I392-L396 PolarHBondContact O-N 3.06Å
393	L	92.4	Very high	90.1	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-60.7	-33.4	176.6	-71.9	169.9	0	0	0	112.1	M372 F375 Y376 K389 L390 A397 F409 Y412	M372-L393 HydrophobicContact CG-CD2 3.84Å; F375-L393 HydrophobicContact CB-CD2 4Å; F375-L393 HydrophobicContact CB-CG 4.1Å; Y376-L393 HydrophobicContact CD1-CD1 4.28Å; Y376-L393 HydrophobicContact CD1-CD2 4.06Å; Y376-L393 HydrophobicContact CE1-CD2 4.13Å; K389-L393 WeakPolarHBondContact O-CG 3.48Å; K389-L393 PolarHBondContact O-N 3.33Å; L390-L393 PolarHBondContact O-N 3.08Å; L393-A397 PolarHBondContact O-N 2.9Å; L393-F409 HydrophobicContact CB-CE1 3.97Å; L393-F409 HydrophobicContact CB-CZ 4.06Å; L393-F409 HydrophobicContact CD1-CE1 4.2Å; L393-Y412 HydrophobicContact CD1-CE2 4.33Å
394	T	90.4	Very high	90.2	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-69.7	-40.8	175.2	-51.4	0	0	0	0	111.8	L390 E391 I392 A397 A427 R430	L390-T394 WeakPolarHBondContact O-CB 3.44Å; L390-T394 PolarHBondContact O-N 3.47Å; L390-T394 PolarHBondContact O-OG1 3.21Å; E391-T394 WeakPolarHBondContact O-CB 3.39Å; E391-T394 PolarHBondContact O-N 3.43Å; I392-T394 PolarHBondContact O-N 3.09Å; T394-A397 WeakPolarHBondContact O-CB 3.42Å; T394-A397 PolarHBondContact O-N 3.24Å; T394-A427 HydrophobicContact CG2-CB 4.37Å; T394-A427 VanDerWaalsContact OG1-CB 3.29Å; T394-A427 WeakPolarHBondContact OG1-CB 3.4Å; T394-R430 HydrophobicContact CG2-CB 3.81Å
395	N	88.6	Confident	90.4	Very high	17 Å²	17	27.3 Å²	27.3	9%	0.091	16%	0.164	C	C	.	.	H	α-helix	trans	-67.5	-36.4	177.2	-66.4	-15.1	0	0	0	112.1	A358 S361 I362 K365 E391 I392 A397	A358-N395 PolarHBondContact O-ND2 3.02Å; S361-N395 PolarHBondContact OG-ND2 3.01Å; S361-N395 VanDerWaalsContact OG-ND2 3.1Å; I362-N395 VanDerWaalsContact CG1-ND2 3.32Å; I362-N395 WeakPolarHBondContact CG1-ND2 3.44Å; K365-N395 VanDerWaalsContact CD-O 3.27Å; K365-N395 WeakPolarHBondContact CD-O 3.23Å; K365-N395 WeakPolarHBondContact CE-O 3.5Å; K365-N395 PolarHBondContact NZ-O 2.95Å; E391-N395 VanDerWaalsContact O-CG 3.23Å; E391-N395 PolarHBondContact O-N 2.92Å; E391-N395 PolarHBondContact O-OD1 3.41Å; I392-N395 PolarHBondContact O-N 3.25Å; I392-N395 VanDerWaalsContact O-N 3.17Å; N395-A397 VanDerWaalsContact C-N 3.27Å; N395-A397 PolarHBondContact O-N 2.93Å
396	L	89.3	Confident	90.3	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.01	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	0.4	178.9	-61.4	177.6	0	0	0	114.3	K365 F368 F375 I392 N398 N401	K365-L396 HydrophobicContact CB-CD2 4.48Å; K365-L396 WeakPolarHBondContact O-CD2 3.49Å; F368-L396 HydrophobicContact CB-CD1 3.8Å; F368-L396 HydrophobicContact CB-CD2 3.97Å; F375-L396 HydrophobicContact CD2-CD1 4.32Å; F375-L396 HydrophobicContact CE2-CD1 4.4Å; I392-L396 HydrophobicContact CG2-CD1 3.75Å; I392-L396 HydrophobicContact CG2-CG 4.27Å; I392-L396 VanDerWaalsContact O-CG 3.28Å; I392-L396 WeakPolarHBondContact O-CG 3.32Å; I392-L396 PolarHBondContact O-N 3.06Å; L396-N398 PolarHBondContact O-N 3.31Å; L396-N401 PolarHBondContact O-ND2 3.02Å
397	A	88.9	Confident	90.3	Very high	8 Å²	8	35.8 Å²	35.8	7%	0.066	20%	0.197	C	C	.	.			trans	-66.6	121.9	177.8	0	0	0	0	0	111.7	K365 L393 T394 N395 N401 I402 I405	K365-A397 PolarHBondContact NZ-O 2.97Å; L393-A397 PolarHBondContact O-N 2.9Å; T394-A397 WeakPolarHBondContact O-CB 3.42Å; T394-A397 PolarHBondContact O-N 3.24Å; N395-A397 VanDerWaalsContact C-N 3.27Å; N395-A397 PolarHBondContact O-N 2.93Å; A397-N401 WeakPolarHBondContact CA-OD1 3.47Å; A397-I402 HydrophobicContact CB-CD1 4.21Å; A397-I405 HydrophobicContact CB-CD1 4.15Å
398	N	86.9	Confident	90.3	Very high	45 Å²	45	35.7 Å²	35.7	24%	0.241	19%	0.193	C	C	.	.			trans	-131.7	158.8	176.4	-63.2	-29.2	0	0	0	108.9	E369 L396 A400 N401 I402	E369-N398 VanDerWaalsContact CD-ND2 3.31Å; E369-N398 PolarHBondContact OE1-ND2 3.31Å; E369-N398 PolarHBondContact OE2-ND2 3.39Å; L396-N398 PolarHBondContact O-N 3.31Å; N398-A400 VanDerWaalsContact C-N 3.25Å; N398-A400 PolarHBondContact O-N 3.16Å; N398-A400 VanDerWaalsContact O-N 3.17Å; N398-N401 PolarHBondContact N-OD1 3.12Å; N398-N401 PolarHBondContact O-N 3.44Å; N398-N401 PolarHBondContact O-OD1 3.5Å; N398-N401 VanDerWaalsContact O-OD1 3.09Å; N398-I402 WeakPolarHBondContact O-CB 3.46Å; N398-I402 PolarHBondContact O-N 3.3Å
399	E	84.2	Confident	90.4	Very high	139 Å²	139	35.2 Å²	35.2	65%	0.65	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-39.6	-179.6	-70	161.9	-178	0	0	113.3	N401 I402 I435	E399-N401 VanDerWaalsContact C-N 3.34Å; E399-N401 PolarHBondContact O-N 3.31Å; E399-I402 WeakPolarHBondContact O-CG2 3.39Å; E399-I435 HydrophobicContact CG-CG2 3.89Å
400	A	87.4	Confident	90.3	Very high	94 Å²	94	41 Å²	41	78%	0.777	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-24.2	178.9	0	0	0	0	0	114.5	N398	N398-A400 VanDerWaalsContact C-N 3.25Å; N398-A400 PolarHBondContact O-N 3.16Å; N398-A400 VanDerWaalsContact O-N 3.17Å
401	N	89.5	Confident	90.1	Very high	12 Å²	12	45.2 Å²	45.2	6%	0.064	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-20.4	-170	73.2	32.1	0	0	0	114.2	E369 M372 L396 A397 N398 E399 S403 T404 I405	E369-N401 PolarHBondContact OE1-ND2 3.15Å; M372-N401 HydrophobicContact CE-CB 4.35Å; M372-N401 HydrophobicContact SD-CB 4.21Å; L396-N401 PolarHBondContact O-ND2 3.02Å; A397-N401 WeakPolarHBondContact CA-OD1 3.47Å; N398-N401 PolarHBondContact N-OD1 3.12Å; N398-N401 PolarHBondContact O-N 3.44Å; N398-N401 PolarHBondContact O-OD1 3.5Å; N398-N401 VanDerWaalsContact O-OD1 3.09Å; E399-N401 VanDerWaalsContact C-N 3.34Å; E399-N401 PolarHBondContact O-N 3.31Å; N401-S403 VanDerWaalsContact C-N 3.27Å; N401-S403 PolarHBondContact O-N 3.38Å; N401-S403 VanDerWaalsContact O-N 3.13Å; N401-T404 PolarHBondContact O-N 3.04Å; N401-T404 PolarHBondContact O-OG1 3.03Å; N401-I405 PolarHBondContact O-N 2.79Å; N401-I405 WeakPolarHBondContact OD1-CD1 3.46Å
402	I	91.1	Very high	90.3	Very high	6 Å²	6	45 Å²	45	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-54.7	-35.9	-174	-175.7	60.9	0	0	0	114.1	A397 N398 E399 T404 I405 L406 C431 I435 V438	A397-I402 HydrophobicContact CB-CD1 4.21Å; N398-I402 WeakPolarHBondContact O-CB 3.46Å; N398-I402 PolarHBondContact O-N 3.3Å; E399-I402 WeakPolarHBondContact O-CG2 3.39Å; I402-T404 PolarHBondContact O-N 2.89Å; I402-I405 PolarHBondContact O-N 3.48Å; I402-L406 HydrophobicContact CD1-CD1 4.02Å; I402-L406 HydrophobicContact CD1-CD2 4.23Å; I402-L406 HydrophobicContact CD1-CG 3.75Å; I402-L406 HydrophobicContact CG1-CD1 3.85Å; I402-L406 HydrophobicContact CG1-CG 4.05Å; I402-L406 WeakPolarHBondContact O-CG 3.44Å; I402-L406 PolarHBondContact O-N 3.45Å; I402-C431 HydrophobicContact CD1-CB 3.73Å; I402-I435 HydrophobicContact CB-CD1 3.93Å; I402-I435 HydrophobicContact CD1-CD1 4.38Å; I402-I435 HydrophobicContact CG1-CD1 4.05Å; I402-I435 HydrophobicContact CG2-CD1 4.23Å; I402-V438 HydrophobicContact CG1-CG1 4.47Å; I402-V438 HydrophobicContact CG1-CG2 4.25Å; I402-V438 HydrophobicContact CG2-CG2 3.96Å
403	S	90.3	Very high	90.2	Very high	75 Å²	75	45.8 Å²	45.8	52%	0.524	25%	0.246	S	C	.	.	H	α-helix	trans	-63.1	-26.3	178.3	64.7	0	0	0	0	113.6	N401	N401-S403 VanDerWaalsContact C-N 3.27Å; N401-S403 PolarHBondContact O-N 3.38Å; N401-S403 VanDerWaalsContact O-N 3.13Å
404	T	91.1	Very high	90	Very high	57 Å²	57	53.9 Å²	53.9	35%	0.35	28%	0.281	S	S	.	.	H	α-helix	trans	-84.3	-40.6	174.4	68.5	0	0	0	0	111.3	N401 I402 R407 E408	N401-T404 PolarHBondContact O-N 3.04Å; N401-T404 PolarHBondContact O-OG1 3.03Å; I402-T404 PolarHBondContact O-N 2.89Å; T404-R407 PolarHBondContact O-N 2.81Å; T404-E408 PolarHBondContact O-N 3.2Å
405	I	92.5	Very high	89.8	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-43.1	178.7	-60.8	176.7	0	0	0	111	M372 A397 N401 I402 R407 E408 F409	M372-I405 HydrophobicContact SD-CD1 3.81Å; M372-I405 HydrophobicContact SD-CG1 3.81Å; A397-I405 HydrophobicContact CB-CD1 4.15Å; N401-I405 PolarHBondContact O-N 2.79Å; N401-I405 WeakPolarHBondContact OD1-CD1 3.46Å; I402-I405 PolarHBondContact O-N 3.48Å; I405-R407 PolarHBondContact O-N 2.65Å; I405-E408 WeakPolarHBondContact O-CB 3.2Å; I405-E408 PolarHBondContact O-N 3.07Å; I405-F409 HydrophobicContact CG2-CD1 3.97Å; I405-F409 HydrophobicContact CG2-CD2 4.12Å; I405-F409 HydrophobicContact CG2-CE1 3.48Å; I405-F409 VanDerWaalsContact CG2-CE1 3.48Å; I405-F409 HydrophobicContact CG2-CE2 3.67Å; I405-F409 HydrophobicContact CG2-CG 4.27Å; I405-F409 HydrophobicContact CG2-CZ 3.33Å; I405-F409 WeakPolarHBondContact O-CD1 3.47Å; I405-F409 WeakPolarHBondContact O-CG 3.36Å; I405-F409 PolarHBondContact O-N 3.05Å
406	L	91.2	Very high	89.7	Confident	30 Å²	30	63.4 Å²	63.4	16%	0.157	33%	0.329	C	S	.	.	H	α-helix	trans	-68.8	-32.2	179.6	-71.5	177.2	0	0	0	113.6	I402 E408 F409 Q410 I428 V438	I402-L406 HydrophobicContact CD1-CD1 4.02Å; I402-L406 HydrophobicContact CD1-CD2 4.23Å; I402-L406 HydrophobicContact CD1-CG 3.75Å; I402-L406 HydrophobicContact CG1-CD1 3.85Å; I402-L406 HydrophobicContact CG1-CG 4.05Å; I402-L406 WeakPolarHBondContact O-CG 3.44Å; I402-L406 PolarHBondContact O-N 3.45Å; L406-E408 VanDerWaalsContact C-N 3.3Å; L406-F409 HydrophobicContact CD2-CD2 4.16Å; L406-F409 PolarHBondContact O-N 2.68Å; L406-Q410 WeakPolarHBondContact O-CB 3.47Å; L406-Q410 PolarHBondContact O-N 2.66Å; L406-I428 HydrophobicContact CD2-CG1 4.11Å; L406-I428 HydrophobicContact CD2-CG2 4.41Å; L406-V438 HydrophobicContact CD1-CG1 3.36Å
407	R	90.8	Very high	89.7	Confident	178 Å²	178	65.1 Å²	65.1	67%	0.672	34%	0.338	S	S	*	.	H	α-helix	trans	-64.2	-38.9	173.2	-170.7	-176.3	-57.3	178.3	3.1	111.4	T404 I405 T411	T404-R407 PolarHBondContact O-N 2.81Å; I405-R407 PolarHBondContact O-N 2.65Å; R407-T411 PolarHBondContact O-OG1 3.43Å
408	E	92.4	Very high	89.7	Confident	50 Å²	50	68.5 Å²	68.5	23%	0.234	35%	0.351	C	S	.	.	H	α-helix	trans	-69.3	-46.8	175	-173.1	70.9	-178.6	0	0	110.8	T404 I405 L406 Q410 T411 Y412	T404-E408 PolarHBondContact O-N 3.2Å; I405-E408 WeakPolarHBondContact O-CB 3.2Å; I405-E408 PolarHBondContact O-N 3.07Å; L406-E408 VanDerWaalsContact C-N 3.3Å; E408-Q410 VanDerWaalsContact C-N 3.31Å; E408-Q410 PolarHBondContact O-N 3.41Å; E408-T411 WeakPolarHBondContact O-CA 3.39Å; E408-T411 VanDerWaalsContact O-CB 3.28Å; E408-T411 WeakPolarHBondContact O-CB 3.49Å; E408-T411 PolarHBondContact O-N 3.08Å; E408-Y412 VanDerWaalsContact CD-OH 3.29Å; E408-Y412 HydrophobicContact CG-CE1 3.72Å; E408-Y412 HydrophobicContact CG-CE2 3.97Å; E408-Y412 WeakPolarHBondContact CG-OH 3.34Å; E408-Y412 WeakPolarHBondContact O-CD1 3.21Å; E408-Y412 PolarHBondContact O-N 2.92Å; E408-Y412 VanDerWaalsContact O-N 3.11Å; E408-Y412 WeakPolarHBondContact OE1-CE1 3.4Å; E408-Y412 VanDerWaalsContact OE1-CZ 3.25Å; E408-Y412 PolarHBondContact OE1-OH 2.83Å
409	F	93.6	Very high	89.7	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-60	-36.5	175.4	-70.7	3	0	0	0	112.6	L390 L393 I405 L406 T411 Y412 V413 T424 A427 I428	L390-F409 HydrophobicContact CD1-CD1 3.94Å; L390-F409 HydrophobicContact CD1-CE1 3.49Å; L390-F409 VanDerWaalsContact CD1-CE1 3.49Å; L390-F409 HydrophobicContact CD1-CE2 4.21Å; L390-F409 HydrophobicContact CD1-CG 4.48Å; L390-F409 HydrophobicContact CD1-CZ 3.64Å; L393-F409 HydrophobicContact CB-CE1 3.97Å; L393-F409 HydrophobicContact CB-CZ 4.06Å; L393-F409 HydrophobicContact CD1-CE1 4.2Å; I405-F409 HydrophobicContact CG2-CD1 3.97Å; I405-F409 HydrophobicContact CG2-CD2 4.12Å; I405-F409 HydrophobicContact CG2-CE1 3.48Å; I405-F409 VanDerWaalsContact CG2-CE1 3.48Å; I405-F409 HydrophobicContact CG2-CE2 3.67Å; I405-F409 HydrophobicContact CG2-CG 4.27Å; I405-F409 HydrophobicContact CG2-CZ 3.33Å; I405-F409 WeakPolarHBondContact O-CD1 3.47Å; I405-F409 WeakPolarHBondContact O-CG 3.36Å; I405-F409 PolarHBondContact O-N 3.05Å; L406-F409 HydrophobicContact CD2-CD2 4.16Å; L406-F409 PolarHBondContact O-N 2.68Å; F409-T411 PolarHBondContact O-N 3.31Å; F409-Y412 AromaticContact CD1-CD2 3.96Å; F409-Y412 HydrophobicContact CD1-CD2 3.96Å; F409-Y412 HydrophobicContact CD1-CE2 4.13Å; F409-Y412 HydrophobicContact CE1-CE2 4.45Å; F409-Y412 PolarHBondContact O-N 3.18Å; F409-V413 WeakPolarHBondContact O-CG2 3.24Å; F409-V413 PolarHBondContact O-N 3.37Å; F409-T424 HydrophobicContact CB-CG2 3.83Å; F409-T424 HydrophobicContact CG-CG2 4.16Å; F409-A427 HydrophobicContact CD2-CB 4.46Å; F409-A427 HydrophobicContact CE2-CB 3.86Å; F409-A427 HydrophobicContact CZ-CB 4.32Å; F409-I428 HydrophobicContact CB-CD1 4.24Å; F409-I428 HydrophobicContact CB-CG1 4.12Å; F409-I428 HydrophobicContact CD2-CG1 3.81Å; F409-I428 HydrophobicContact CG-CG1 4.46Å
410	Q	90.4	Very high	90.1	Very high	126 Å²	126	63.1 Å²	63.1	59%	0.589	34%	0.336	S	S	*	.	H	α-helix	trans	-60.6	-25.4	174	-166.8	-176.3	26.8	0	0	112.6	L406 E408	L406-Q410 WeakPolarHBondContact O-CB 3.47Å; L406-Q410 PolarHBondContact O-N 2.66Å; E408-Q410 VanDerWaalsContact C-N 3.31Å; E408-Q410 PolarHBondContact O-N 3.41Å
411	T	90.2	Very high	90.3	Very high	89 Å²	89	58.7 Å²	58.7	55%	0.546	30%	0.299	S	S	.	.	H	α-helix	trans	-80.7	-39.7	172	-53.9	0	0	0	0	110.9	R407 E408 F409 V413 K414	R407-T411 PolarHBondContact O-OG1 3.43Å; E408-T411 WeakPolarHBondContact O-CA 3.39Å; E408-T411 VanDerWaalsContact O-CB 3.28Å; E408-T411 WeakPolarHBondContact O-CB 3.49Å; E408-T411 PolarHBondContact O-N 3.08Å; F409-T411 PolarHBondContact O-N 3.31Å; T411-V413 PolarHBondContact O-N 3.48Å; T411-K414 PolarHBondContact O-N 2.87Å; T411-K414 VanDerWaalsContact O-N 3.13Å
412	Y	92.6	Very high	90.3	Very high	12 Å²	12	59 Å²	59	5%	0.047	30%	0.303	C	S	.	.	H	α-helix	trans	-65.4	-35	179.2	-63.4	-4.9	0	0	0	113.4	V377 L390 L393 E408 F409 K414 S415 F420	V377-Y412 HydrophobicContact CB-CE1 3.95Å; V377-Y412 HydrophobicContact CB-CE2 3.95Å; V377-Y412 HydrophobicContact CG2-CD2 4.46Å; V377-Y412 HydrophobicContact CG2-CE2 3.74Å; V377-Y412 PolarHBondContact N-OH 3.23Å; L390-Y412 HydrophobicContact CD1-CD2 4.38Å; L393-Y412 HydrophobicContact CD1-CE2 4.33Å; E408-Y412 VanDerWaalsContact CD-OH 3.29Å; E408-Y412 HydrophobicContact CG-CE1 3.72Å; E408-Y412 HydrophobicContact CG-CE2 3.97Å; E408-Y412 WeakPolarHBondContact CG-OH 3.34Å; E408-Y412 WeakPolarHBondContact O-CD1 3.21Å; E408-Y412 PolarHBondContact O-N 2.92Å; E408-Y412 VanDerWaalsContact O-N 3.11Å; E408-Y412 WeakPolarHBondContact OE1-CE1 3.4Å; E408-Y412 VanDerWaalsContact OE1-CZ 3.25Å; E408-Y412 PolarHBondContact OE1-OH 2.83Å; F409-Y412 AromaticContact CD1-CD2 3.96Å; F409-Y412 HydrophobicContact CD1-CD2 3.96Å; F409-Y412 HydrophobicContact CD1-CE2 4.13Å; F409-Y412 HydrophobicContact CE1-CE2 4.45Å; F409-Y412 PolarHBondContact O-N 3.18Å; Y412-K414 PolarHBondContact O-N 3.41Å; Y412-S415 VanDerWaalsContact O-CB 3.23Å; Y412-S415 WeakPolarHBondContact O-CB 3.29Å; Y412-S415 PolarHBondContact O-N 3.11Å; Y412-S415 VanDerWaalsContact O-N 3.08Å; Y412-S415 PolarHBondContact O-OG 3.41Å; Y412-F420 HydrophobicContact CD1-CE1 4.43Å; Y412-F420 HydrophobicContact CD2-CE1 4.21Å; Y412-F420 AromaticContact CD2-CZ 3.62Å; Y412-F420 HydrophobicContact CD2-CZ 3.62Å; Y412-F420 HydrophobicContact CE2-CZ 4.29Å; Y412-F420 AromaticContact CG-CE1 3.86Å; Y412-F420 HydrophobicContact CG-CE1 3.86Å; Y412-F420 AromaticContact CG-CZ 3.78Å; Y412-F420 HydrophobicContact CG-CZ 3.78Å
413	V	90.2	Very high	90.2	Very high	15 Å²	15	59.7 Å²	59.7	9%	0.091	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-27.3	173.2	174.3	0	0	0	0	112.4	F409 T411 S415 T424 I425 I428 L449	F409-V413 WeakPolarHBondContact O-CG2 3.24Å; F409-V413 PolarHBondContact O-N 3.37Å; T411-V413 PolarHBondContact O-N 3.48Å; V413-S415 VanDerWaalsContact C-N 3.28Å; V413-S415 PolarHBondContact O-N 3.46Å; V413-T424 HydrophobicContact CG2-CG2 3.64Å; V413-I425 HydrophobicContact CG1-CD1 4.36Å; V413-I425 HydrophobicContact CG1-CG1 4.46Å; V413-I425 HydrophobicContact CG2-CG1 4.06Å; V413-I428 HydrophobicContact CG2-CD1 3.95Å; V413-L449 HydrophobicContact CG1-CD1 3.8Å; V413-L449 HydrophobicContact CG1-CD2 3.71Å; V413-L449 HydrophobicContact CG1-CG 4.44Å
414	K	88.1	Confident	90.3	Very high	171 Å²	171	56.1 Å²	56.1	74%	0.743	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	7.9	178.1	-61.1	179.8	-178.8	179.5	0	113.8	T411 Y412	T411-K414 PolarHBondContact O-N 2.87Å; T411-K414 VanDerWaalsContact O-N 3.13Å; Y412-K414 PolarHBondContact O-N 3.41Å
415	S	87	Confident	90.4	Very high	32 Å²	32	53.4 Å²	53.4	22%	0.224	27%	0.269	C	S	.	.	S	Bend	trans	-72	157.6	-179.1	64.5	0	0	0	0	112.9	Y412 V413 D417	Y412-S415 VanDerWaalsContact O-CB 3.23Å; Y412-S415 WeakPolarHBondContact O-CB 3.29Å; Y412-S415 PolarHBondContact O-N 3.11Å; Y412-S415 VanDerWaalsContact O-N 3.08Å; Y412-S415 PolarHBondContact O-OG 3.41Å; V413-S415 VanDerWaalsContact C-N 3.28Å; V413-S415 PolarHBondContact O-N 3.46Å; S415-D417 VanDerWaalsContact C-N 3.28Å; S415-D417 PolarHBondContact O-N 2.9Å
416	Q	86.8	Confident	90.3	Very high	189 Å²	189	56.6 Å²	56.6	88%	0.883	28%	0.284	S	S	*	.	S	Bend	trans	-67.8	-29.4	176.8	-67.6	172.8	-18.8	0	0	112.3	K418	Q416-K418 PolarHBondContact O-N 3.31Å; Q416-K418 VanDerWaalsContact O-N 3.16Å
417	D	88.9	Confident	90.2	Very high	38 Å²	38	55.1 Å²	55.1	20%	0.203	28%	0.276	C	S	.	.			trans	-76.6	97.9	179.2	-177.8	-20.5	0	0	0	110.2	T383 S415 A419 F420 A421	T383-D417 WeakPolarHBondContact CB-OD2 3.27Å; T383-D417 WeakPolarHBondContact CG2-OD2 3.46Å; T383-D417 PolarHBondContact OG1-OD2 2.95Å; S415-D417 VanDerWaalsContact C-N 3.28Å; S415-D417 PolarHBondContact O-N 2.9Å; D417-A419 VanDerWaalsContact C-N 3.25Å; D417-A419 PolarHBondContact O-N 3.26Å; D417-A419 PolarHBondContact OD1-N 3.4Å; D417-A419 VanDerWaalsContact OD1-N 3.12Å; D417-F420 HydrophobicContact CB-CB 3.92Å; D417-F420 VanDerWaalsContact CG-CB 3.47Å; D417-F420 PolarHBondContact O-N 2.96Å; D417-F420 PolarHBondContact OD1-N 3.4Å; D417-A421 PolarHBondContact O-N 2.73Å
418	K	88.4	Confident	90.3	Very high	79 Å²	79	47.5 Å²	47.5	34%	0.343	25%	0.249	S	C	.	.	H	α-helix	trans	-65.5	-25.9	-176.4	-53.2	-58.2	177.2	177.8	0	113.3	Q416 A422 D454	Q416-K418 PolarHBondContact O-N 3.31Å; Q416-K418 VanDerWaalsContact O-N 3.16Å; K418-A422 WeakPolarHBondContact O-CB 3.2Å; K418-A422 PolarHBondContact O-N 3.42Å; K418-D454 WeakPolarHBondContact CE-OD1 3.02Å; K418-D454 IonicContact NZ-OD1 3.55Å; K418-D454 PolarHBondContact NZ-OD1 3.1Å; K418-D454 IonicContact NZ-OD2 3.23Å; K418-D454 PolarHBondContact NZ-OD2 3.2Å
419	A	87.9	Confident	90.1	Very high	67 Å²	67	45.1 Å²	45.1	55%	0.554	24%	0.237	S	C	*	.	H	α-helix	trans	-74.7	-41.5	175.7	0	0	0	0	0	110.9	D417 A422 A423	D417-A419 VanDerWaalsContact C-N 3.25Å; D417-A419 PolarHBondContact O-N 3.26Å; D417-A419 PolarHBondContact OD1-N 3.4Å; D417-A419 VanDerWaalsContact OD1-N 3.12Å; A419-A422 PolarHBondContact O-N 2.71Å; A419-A423 PolarHBondContact O-N 3.44Å
420	F	92	Very high	89.8	Confident	3 Å²	3	46.2 Å²	46.2	1%	0.013	24%	0.242	C	C	.	.	H	α-helix	trans	-66.6	-37.1	172.4	178	-119.1	0	0	0	112.7	V377 K386 T387 L390 Y412 D417 A423 T424	V377-F420 HydrophobicContact CB-CZ 4.28Å; V377-F420 HydrophobicContact CG1-CE1 4.21Å; V377-F420 HydrophobicContact CG1-CZ 4Å; V377-F420 HydrophobicContact CG2-CE2 4.46Å; V377-F420 HydrophobicContact CG2-CZ 3.97Å; K386-F420 HydrophobicContact CB-CD1 4.35Å; K386-F420 HydrophobicContact CB-CD2 3.54Å; K386-F420 HydrophobicContact CB-CE1 4.39Å; K386-F420 HydrophobicContact CB-CE2 3.6Å; K386-F420 HydrophobicContact CB-CG 3.95Å; K386-F420 HydrophobicContact CB-CZ 4.04Å; K386-F420 HydrophobicContact CD-CD1 3.81Å; K386-F420 HydrophobicContact CD-CD2 4.49Å; K386-F420 HydrophobicContact CD-CE1 4.04Å; K386-F420 HydrophobicContact CD-CG 4.05Å; K386-F420 HydrophobicContact CD-CZ 4.49Å; K386-F420 WeakPolarHBondContact O-CE2 3.47Å; T387-F420 HydrophobicContact CG2-CD2 4.3Å; L390-F420 HydrophobicContact CB-CE2 4.02Å; L390-F420 HydrophobicContact CD2-CD2 4.38Å; L390-F420 HydrophobicContact CD2-CE2 3.96Å; L390-F420 HydrophobicContact CG-CE2 4.47Å; Y412-F420 HydrophobicContact CD1-CE1 4.43Å; Y412-F420 HydrophobicContact CD2-CE1 4.21Å; Y412-F420 AromaticContact CD2-CZ 3.62Å; Y412-F420 HydrophobicContact CD2-CZ 3.62Å; Y412-F420 HydrophobicContact CE2-CZ 4.29Å; Y412-F420 AromaticContact CG-CE1 3.86Å; Y412-F420 HydrophobicContact CG-CE1 3.86Å; Y412-F420 AromaticContact CG-CZ 3.78Å; Y412-F420 HydrophobicContact CG-CZ 3.78Å; D417-F420 HydrophobicContact CB-CB 3.92Å; D417-F420 VanDerWaalsContact CG-CB 3.47Å; D417-F420 PolarHBondContact O-N 2.96Å; D417-F420 PolarHBondContact OD1-N 3.4Å; F420-A423 PolarHBondContact O-N 3.31Å; F420-T424 WeakPolarHBondContact O-CB 3.18Å; F420-T424 PolarHBondContact O-N 2.87Å; F420-T424 PolarHBondContact O-OG1 3.36Å
421	A	91.1	Very high	89.7	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-61.9	-44.9	172.8	0	0	0	0	0	112	D417 T424 I425 V457	D417-A421 PolarHBondContact O-N 2.73Å; A421-T424 WeakPolarHBondContact O-CB 3.29Å; A421-T424 PolarHBondContact O-N 3.19Å; A421-I425 WeakPolarHBondContact O-CD1 3.45Å; A421-I425 WeakPolarHBondContact O-CG1 3.42Å; A421-I425 PolarHBondContact O-N 3.08Å; A421-I425 VanDerWaalsContact O-N 3.08Å; A421-V457 HydrophobicContact CB-CG2 4.16Å
422	A	89.1	Confident	89.6	Confident	18 Å²	18	36.1 Å²	36.1	15%	0.149	19%	0.188	C	C	.	.	H	α-helix	trans	-61.8	-45	174.4	0	0	0	0	0	112.4	K418 A419 T424 I425 Q426 E460	K418-A422 WeakPolarHBondContact O-CB 3.2Å; K418-A422 PolarHBondContact O-N 3.42Å; A419-A422 PolarHBondContact O-N 2.71Å; A422-T424 VanDerWaalsContact C-N 3.27Å; A422-T424 PolarHBondContact O-N 3.28Å; A422-I425 WeakPolarHBondContact O-CB 3.27Å; A422-I425 PolarHBondContact O-N 3.27Å; A422-I425 VanDerWaalsContact O-N 3.09Å; A422-Q426 PolarHBondContact O-N 3.42Å; A422-Q426 VanDerWaalsContact O-N 3.1Å; A422-E460 HydrophobicContact CB-CB 4.22Å; A422-E460 HydrophobicContact CB-CG 4.24Å
423	A	89.8	Confident	89.2	Confident	22 Å²	22	37.6 Å²	37.6	18%	0.182	20%	0.199	C	C	.	.	H	α-helix	trans	-59	-38.6	173.7	0	0	0	0	0	112.1	T387 L390 A419 F420 I425 Q426 A427	T387-A423 HydrophobicContact CG2-CB 4.26Å; L390-A423 VanDerWaalsContact CD2-C 3.47Å; L390-A423 HydrophobicContact CD2-CB 3.82Å; A419-A423 PolarHBondContact O-N 3.44Å; F420-A423 PolarHBondContact O-N 3.31Å; A423-I425 VanDerWaalsContact C-N 3.3Å; A423-I425 PolarHBondContact O-N 3.21Å; A423-Q426 WeakPolarHBondContact O-CB 3.21Å; A423-Q426 PolarHBondContact O-N 3.42Å; A423-A427 PolarHBondContact O-N 3.04Å
424	T	93.3	Very high	88.9	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-37.3	176.1	-55.7	0	0	0	0	111.6	L390 F409 V413 F420 A421 A422 A427 I428	L390-T424 HydrophobicContact CD1-CG2 4.29Å; F409-T424 HydrophobicContact CB-CG2 3.83Å; F409-T424 HydrophobicContact CG-CG2 4.16Å; V413-T424 HydrophobicContact CG2-CG2 3.64Å; F420-T424 WeakPolarHBondContact O-CB 3.18Å; F420-T424 PolarHBondContact O-N 2.87Å; F420-T424 PolarHBondContact O-OG1 3.36Å; A421-T424 WeakPolarHBondContact O-CB 3.29Å; A421-T424 PolarHBondContact O-N 3.19Å; A422-T424 VanDerWaalsContact C-N 3.27Å; A422-T424 PolarHBondContact O-N 3.28Å; T424-A427 WeakPolarHBondContact O-CB 3.37Å; T424-A427 PolarHBondContact O-N 3.11Å; T424-I428 HydrophobicContact CG2-CD1 4.31Å; T424-I428 VanDerWaalsContact O-CG1 3.32Å; T424-I428 WeakPolarHBondContact O-CG1 3.43Å; T424-I428 PolarHBondContact O-N 2.79Å
425	I	91.9	Very high	88.9	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.5	-39.8	176.6	-70.2	159.1	0	0	0	111	V413 A421 A422 A423 I428 G429 L446 L449 V457 E460 V464	V413-I425 HydrophobicContact CG1-CD1 4.36Å; V413-I425 HydrophobicContact CG1-CG1 4.46Å; V413-I425 HydrophobicContact CG2-CG1 4.06Å; A421-I425 WeakPolarHBondContact O-CD1 3.45Å; A421-I425 WeakPolarHBondContact O-CG1 3.42Å; A421-I425 PolarHBondContact O-N 3.08Å; A421-I425 VanDerWaalsContact O-N 3.08Å; A422-I425 WeakPolarHBondContact O-CB 3.27Å; A422-I425 PolarHBondContact O-N 3.27Å; A422-I425 VanDerWaalsContact O-N 3.09Å; A423-I425 VanDerWaalsContact C-N 3.3Å; A423-I425 PolarHBondContact O-N 3.21Å; I425-I428 PolarHBondContact O-N 3.46Å; I425-G429 PolarHBondContact O-N 2.97Å; I425-G429 VanDerWaalsContact O-N 3.07Å; I425-L446 HydrophobicContact CG2-CD2 3.73Å; I425-L449 HydrophobicContact CD1-CD1 4.22Å; I425-L449 HydrophobicContact CG1-CD1 4.1Å; I425-V457 HydrophobicContact CD1-CB 4.26Å; I425-V457 HydrophobicContact CD1-CG1 3.81Å; I425-V457 HydrophobicContact CD1-CG2 4.34Å; I425-E460 HydrophobicContact CB-CG 4.31Å; I425-E460 HydrophobicContact CG2-CB 4.28Å; I425-E460 HydrophobicContact CG2-CG 4.01Å; I425-V464 HydrophobicContact CG2-CB 4.4Å; I425-V464 HydrophobicContact CG2-CG2 4.04Å
426	Q	89.8	Confident	88.7	Confident	68 Å²	68	37 Å²	37	32%	0.318	21%	0.207	S	C	.	.	H	α-helix	trans	-62.9	-42	171.1	-67.8	-178.5	-9.1	0	0	112.4	A422 A423 G429 R430 E460 V464	A422-Q426 PolarHBondContact O-N 3.42Å; A422-Q426 VanDerWaalsContact O-N 3.1Å; A423-Q426 WeakPolarHBondContact O-CB 3.21Å; A423-Q426 PolarHBondContact O-N 3.42Å; Q426-G429 WeakPolarHBondContact O-CA 3.49Å; Q426-G429 PolarHBondContact O-N 3.1Å; Q426-G429 VanDerWaalsContact O-N 3.15Å; Q426-R430 WeakPolarHBondContact O-CG 3.39Å; Q426-R430 PolarHBondContact O-N 3.08Å; Q426-E460 HydrophobicContact CG-CG 3.87Å; Q426-E460 WeakPolarHBondContact CG-OE1 3.45Å; Q426-E460 PolarHBondContact NE2-OE1 3.17Å; Q426-E460 PolarHBondContact NE2-OE2 2.94Å; Q426-V464 HydrophobicContact CG-CG2 4.34Å
427	A	90.7	Very high	88.6	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.7	-45.3	175.7	0	0	0	0	0	112.7	L390 T394 F409 A423 T424 G429 R430 C431	L390-A427 HydrophobicContact CD1-CB 3.75Å; L390-A427 HydrophobicContact CD2-CB 4.2Å; L390-A427 HydrophobicContact CG-CB 3.92Å; T394-A427 HydrophobicContact CG2-CB 4.37Å; T394-A427 VanDerWaalsContact OG1-CB 3.29Å; T394-A427 WeakPolarHBondContact OG1-CB 3.4Å; F409-A427 HydrophobicContact CD2-CB 4.46Å; F409-A427 HydrophobicContact CE2-CB 3.86Å; F409-A427 HydrophobicContact CZ-CB 4.32Å; A423-A427 PolarHBondContact O-N 3.04Å; T424-A427 WeakPolarHBondContact O-CB 3.37Å; T424-A427 PolarHBondContact O-N 3.11Å; A427-G429 VanDerWaalsContact C-N 3.26Å; A427-G429 PolarHBondContact O-N 2.74Å; A427-R430 PolarHBondContact O-N 3.23Å; A427-C431 PolarHBondContact O-N 2.94Å; A427-C431 PolarHBondContact O-SG 3.37Å; A427-C431 VanDerWaalsContact O-SG 3.42Å
428	I	91.8	Very high	88.4	Confident	18 Å²	18	34.4 Å²	34.4	9%	0.092	20%	0.195	C	C	.	.	H	α-helix	trans	-56.5	-42.6	172.3	-67.7	165.3	0	0	0	110.6	L406 F409 V413 T424 I425 C431 A432 C442 L446	L406-I428 HydrophobicContact CD2-CG1 4.11Å; L406-I428 HydrophobicContact CD2-CG2 4.41Å; F409-I428 HydrophobicContact CB-CD1 4.24Å; F409-I428 HydrophobicContact CB-CG1 4.12Å; F409-I428 HydrophobicContact CD2-CG1 3.81Å; F409-I428 HydrophobicContact CG-CG1 4.46Å; V413-I428 HydrophobicContact CG2-CD1 3.95Å; T424-I428 HydrophobicContact CG2-CD1 4.31Å; T424-I428 VanDerWaalsContact O-CG1 3.32Å; T424-I428 WeakPolarHBondContact O-CG1 3.43Å; T424-I428 PolarHBondContact O-N 2.79Å; I425-I428 PolarHBondContact O-N 3.46Å; I428-C431 PolarHBondContact O-N 3.32Å; I428-A432 WeakPolarHBondContact O-CB 3.49Å; I428-A432 PolarHBondContact O-N 3.42Å; I428-C442 HydrophobicContact CG2-CB 3.96Å; I428-L446 HydrophobicContact CG2-CD1 4.49Å; I428-L446 HydrophobicContact CG2-CD2 4.43Å; I428-L446 HydrophobicContact CG2-CG 4.42Å
429	G	88.8	Confident	88.2	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.1	-44.9	174.5	0	0	0	0	0	114.1	I425 Q426 A427 A432 T433 V464	I425-G429 PolarHBondContact O-N 2.97Å; I425-G429 VanDerWaalsContact O-N 3.07Å; Q426-G429 WeakPolarHBondContact O-CA 3.49Å; Q426-G429 PolarHBondContact O-N 3.1Å; Q426-G429 VanDerWaalsContact O-N 3.15Å; A427-G429 VanDerWaalsContact C-N 3.26Å; A427-G429 PolarHBondContact O-N 2.74Å; G429-A432 PolarHBondContact O-N 3.05Å; G429-T433 PolarHBondContact O-N 3.13Å; G429-T433 PolarHBondContact O-OG1 3.49Å; G429-V464 VanDerWaalsContact CA-CG1 3.42Å
430	R	87.1	Confident	88.1	Confident	23 Å²	23	31.1 Å²	31.1	9%	0.087	17%	0.172	C	C	.	.	H	α-helix	trans	-62.7	-45.7	175.8	-68.6	177.3	-177	142.3	-7.1	111.3	E391 T394 Q426 A427 A432 T433 N434 L607 E608	E391-R430 IonicContact OE1-CZ 2.71Å; E391-R430 IonicContact OE1-NH1 3.5Å; E391-R430 PolarHBondContact OE1-NH1 3.02Å; E391-R430 IonicContact OE1-NH2 3.69Å; E391-R430 IonicContact OE2-CZ 3.64Å; E391-R430 IonicContact OE2-NH1 3.96Å; E391-R430 PolarHBondContact OE2-NH1 3.19Å; T394-R430 HydrophobicContact CG2-CB 3.81Å; Q426-R430 WeakPolarHBondContact O-CG 3.39Å; Q426-R430 PolarHBondContact O-N 3.08Å; A427-R430 PolarHBondContact O-N 3.23Å; R430-A432 VanDerWaalsContact C-N 3.34Å; R430-A432 PolarHBondContact O-N 2.62Å; R430-T433 WeakPolarHBondContact O-CB 3.36Å; R430-T433 PolarHBondContact O-N 2.99Å; R430-T433 VanDerWaalsContact O-N 3.08Å; R430-N434 VanDerWaalsContact O-CG 3.27Å; R430-N434 PolarHBondContact O-N 3.26Å; R430-N434 PolarHBondContact O-ND2 3.11Å; R430-L607 HydrophobicContact CG-CB 4.23Å; R430-L607 HydrophobicContact CG-CD2 4.25Å; R430-E608 VanDerWaalsContact CZ-O 3.31Å; R430-E608 PolarHBondContact NE-O 3.18Å; R430-E608 PolarHBondContact NH2-O 3.43Å
431	C	88.5	Confident	87.8	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.02	20%	0.198	C	C	.	.	H	α-helix	trans	-57.3	-45.7	175	-69	0	0	0	0	112.2	I402 A427 I428 T433 N434 I435	I402-C431 HydrophobicContact CD1-CB 3.73Å; A427-C431 PolarHBondContact O-N 2.94Å; A427-C431 PolarHBondContact O-SG 3.37Å; A427-C431 VanDerWaalsContact O-SG 3.42Å; I428-C431 PolarHBondContact O-N 3.32Å; C431-T433 VanDerWaalsContact C-N 3.26Å; C431-T433 PolarHBondContact O-N 3.44Å; C431-N434 PolarHBondContact O-N 3.05Å; C431-I435 PolarHBondContact O-N 2.91Å
432	A	88	Confident	87.7	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-68.2	-20.5	176.5	0	0	0	0	0	114.2	I428 G429 R430 T439 C442 L468	I428-A432 WeakPolarHBondContact O-CB 3.49Å; I428-A432 PolarHBondContact O-N 3.42Å; G429-A432 PolarHBondContact O-N 3.05Å; R430-A432 VanDerWaalsContact C-N 3.34Å; R430-A432 PolarHBondContact O-N 2.62Å; A432-T439 HydrophobicContact CB-CG2 4.5Å; A432-T439 PolarHBondContact O-OG1 3.48Å; A432-C442 HydrophobicContact CB-CB 3.74Å; A432-L468 HydrophobicContact CB-CD1 4Å; A432-L468 HydrophobicContact CB-CD2 3.84Å
433	T	85.3	Confident	87.5	Confident	43 Å²	43	34.7 Å²	34.7	26%	0.264	19%	0.192	S	C	.	.	H	α-helix	trans	-81.6	-34.1	172.5	-52.7	0	0	0	0	111.4	G429 R430 C431 L468 L607	G429-T433 PolarHBondContact O-N 3.13Å; G429-T433 PolarHBondContact O-OG1 3.49Å; R430-T433 WeakPolarHBondContact O-CB 3.36Å; R430-T433 PolarHBondContact O-N 2.99Å; R430-T433 VanDerWaalsContact O-N 3.08Å; C431-T433 VanDerWaalsContact C-N 3.26Å; C431-T433 PolarHBondContact O-N 3.44Å; T433-L468 WeakPolarHBondContact OG1-CD2 3.45Å; T433-L607 HydrophobicContact CG2-CB 4.5Å; T433-L607 VanDerWaalsContact OG1-CD1 3.26Å; T433-L607 WeakPolarHBondContact OG1-CD1 3.12Å
434	N	83.9	Confident	87.3	Confident	107 Å²	107	38.1 Å²	38.1	57%	0.572	21%	0.208	S	C	*	.	H	α-helix	trans	-85.3	-29.4	-176.5	-67.1	-15.2	0	0	0	113.8	R430 C431	R430-N434 VanDerWaalsContact O-CG 3.27Å; R430-N434 PolarHBondContact O-N 3.26Å; R430-N434 PolarHBondContact O-ND2 3.11Å; C431-N434 PolarHBondContact O-N 3.05Å
435	I	86.3	Confident	87	Confident	10 Å²	10	39.8 Å²	39.8	5%	0.051	23%	0.225	C	C	.	.			trans	-126.5	102.4	-175.3	-52.8	175.4	0	0	0	109.2	E399 I402 C431 E437 V438	E399-I435 HydrophobicContact CG-CG2 3.89Å; I402-I435 HydrophobicContact CB-CD1 3.93Å; I402-I435 HydrophobicContact CD1-CD1 4.38Å; I402-I435 HydrophobicContact CG1-CD1 4.05Å; I402-I435 HydrophobicContact CG2-CD1 4.23Å; C431-I435 PolarHBondContact O-N 2.91Å; I435-E437 PolarHBondContact O-N 3.38Å; I435-V438 HydrophobicContact CB-CG2 4.49Å; I435-V438 HydrophobicContact CG2-CG2 3.86Å; I435-V438 PolarHBondContact O-N 3.35Å
436	S	83.1	Confident	86.8	Confident	87 Å²	87	39.8 Å²	39.8	61%	0.608	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-64.5	-34.7	-170.9	49	0	0	0	0	114.2	V438 T439	S436-V438 PolarHBondContact O-N 2.73Å; S436-V438 VanDerWaalsContact O-N 3.12Å; S436-T439 WeakPolarHBondContact CA-OG1 3.39Å; S436-T439 WeakPolarHBondContact O-CB 3.41Å; S436-T439 PolarHBondContact O-N 2.7Å; S436-T439 PolarHBondContact O-OG1 3.29Å
437	E	85.1	Confident	86.5	Confident	154 Å²	154	36.8 Å²	36.8	72%	0.72	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-58	-29.2	-177.6	-57.5	-166	138.2	0	0	113.5	I435	I435-E437 PolarHBondContact O-N 3.38Å
438	V	84.6	Confident	86.2	Confident	19 Å²	19	43.1 Å²	43.1	12%	0.115	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-97.3	-9.7	-169.6	-160.7	0	0	0	0	111.7	I402 L406 I435 S436 D440 T441 C442	I402-V438 HydrophobicContact CG1-CG1 4.47Å; I402-V438 HydrophobicContact CG1-CG2 4.25Å; I402-V438 HydrophobicContact CG2-CG2 3.96Å; L406-V438 HydrophobicContact CD1-CG1 3.36Å; I435-V438 HydrophobicContact CB-CG2 4.49Å; I435-V438 HydrophobicContact CG2-CG2 3.86Å; I435-V438 PolarHBondContact O-N 3.35Å; S436-V438 PolarHBondContact O-N 2.73Å; S436-V438 VanDerWaalsContact O-N 3.12Å; V438-D440 PolarHBondContact O-N 3.4Å; V438-T441 WeakPolarHBondContact CG1-OG1 3.1Å; V438-T441 PolarHBondContact O-N 2.81Å; V438-T441 PolarHBondContact O-OG1 3.07Å; V438-C442 PolarHBondContact O-N 3.21Å
439	T	85.3	Confident	85.8	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	25%	0.25	C	S	.	.	H	α-helix	trans	-50.5	-52.1	-172.6	-43.3	0	0	0	0	113.1	A432 S436 T441 C442 L443	A432-T439 HydrophobicContact CB-CG2 4.5Å; A432-T439 PolarHBondContact O-OG1 3.48Å; S436-T439 WeakPolarHBondContact CA-OG1 3.39Å; S436-T439 WeakPolarHBondContact O-CB 3.41Å; S436-T439 PolarHBondContact O-N 2.7Å; S436-T439 PolarHBondContact O-OG1 3.29Å; T439-T441 VanDerWaalsContact C-N 3.33Å; T439-T441 PolarHBondContact O-N 3.32Å; T439-C442 PolarHBondContact O-N 3.38Å; T439-L443 HydrophobicContact CG2-CD1 3.97Å; T439-L443 HydrophobicContact CG2-CG 4.46Å; T439-L443 WeakPolarHBondContact O-CB 3.23Å; T439-L443 WeakPolarHBondContact O-CG 3.49Å; T439-L443 PolarHBondContact O-N 3.21Å
440	D	84.7	Confident	85.4	Confident	75 Å²	75	44.6 Å²	44.6	40%	0.401	25%	0.252	S	S	.	.	H	α-helix	trans	-66.6	-32.8	-179	-79	-52.3	0	0	0	112.7	V438 N444 H476	V438-D440 PolarHBondContact O-N 3.4Å; D440-N444 WeakPolarHBondContact O-CB 3.34Å; D440-N444 PolarHBondContact O-N 3.04Å; D440-N444 PolarHBondContact O-ND2 3.24Å; D440-H476 IonicContact OD1-CE1 2.73Å; D440-H476 PolarHBondContact OD1-CE1 3.24Å; D440-H476 IonicContact OD1-ND1 2.61Å; D440-H476 PolarHBondContact OD1-ND1 2.84Å
441	T	86.4	Confident	85.2	Confident	90 Å²	90	47.1 Å²	47.1	55%	0.552	27%	0.274	S	S	*	.	H	α-helix	trans	-69.6	-41.3	176.9	74.6	0	0	0	0	111	V438 T439 G445	V438-T441 WeakPolarHBondContact CG1-OG1 3.1Å; V438-T441 PolarHBondContact O-N 2.81Å; V438-T441 PolarHBondContact O-OG1 3.07Å; T439-T441 VanDerWaalsContact C-N 3.33Å; T439-T441 PolarHBondContact O-N 3.32Å; T441-G445 PolarHBondContact O-N 3.24Å
442	C	87.6	Confident	84.9	Confident	7 Å²	7	50.1 Å²	50.1	5%	0.047	29%	0.29	C	S	.	.	H	α-helix	trans	-64.2	-46	173.4	-70.5	0	0	0	0	111.4	I428 A432 V438 T439 G445 L446	I428-C442 HydrophobicContact CG2-CB 3.96Å; A432-C442 HydrophobicContact CB-CB 3.74Å; V438-C442 PolarHBondContact O-N 3.21Å; T439-C442 PolarHBondContact O-N 3.38Å; C442-G445 PolarHBondContact O-N 3Å; C442-L446 WeakPolarHBondContact O-CB 3.1Å; C442-L446 WeakPolarHBondContact O-CG 3.41Å; C442-L446 PolarHBondContact O-N 3.33Å
443	L	86.1	Confident	84.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.6	-46.3	178.6	-79.1	170.4	0	0	0	112.1	T439 G445 L446 V447 I465 L468 H476 I479	T439-L443 HydrophobicContact CG2-CD1 3.97Å; T439-L443 HydrophobicContact CG2-CG 4.46Å; T439-L443 WeakPolarHBondContact O-CB 3.23Å; T439-L443 WeakPolarHBondContact O-CG 3.49Å; T439-L443 PolarHBondContact O-N 3.21Å; L443-G445 VanDerWaalsContact C-N 3.31Å; L443-G445 PolarHBondContact O-N 3.4Å; L443-L446 PolarHBondContact O-N 3.23Å; L443-V447 WeakPolarHBondContact O-CB 3.3Å; L443-V447 WeakPolarHBondContact O-CG2 3.24Å; L443-V447 PolarHBondContact O-N 2.76Å; L443-I465 HydrophobicContact CD2-CG1 4.39Å; L443-I465 HydrophobicContact CD2-CG2 4.25Å; L443-L468 HydrophobicContact CD2-CB 3.89Å; L443-L468 HydrophobicContact CD2-CD1 3.71Å; L443-L468 HydrophobicContact CD2-CG 4.47Å; L443-L468 HydrophobicContact CG-CD1 4.13Å; L443-H476 VanDerWaalsContact CD1-CE1 3.49Å; L443-H476 WeakPolarHBondContact CD1-CE1 3.39Å; L443-I479 HydrophobicContact CB-CD1 3.8Å; L443-I479 HydrophobicContact CD1-CD1 4.01Å; L443-I479 HydrophobicContact CG-CD1 4.47Å
444	N	85.5	Confident	84.3	Confident	94 Å²	94	61.9 Å²	61.9	50%	0.503	33%	0.333	S	S	.	.	H	α-helix	trans	-63.4	-38	176	-75.8	-62.2	0	0	0	111.9	D440 V447 L448	D440-N444 WeakPolarHBondContact O-CB 3.34Å; D440-N444 PolarHBondContact O-N 3.04Å; D440-N444 PolarHBondContact O-ND2 3.24Å; N444-V447 PolarHBondContact O-N 3.18Å; N444-L448 PolarHBondContact O-N 3.36Å; N444-L448 VanDerWaalsContact O-N 3.11Å
445	G	86	Confident	84.2	Confident	35 Å²	35	62.2 Å²	62.2	36%	0.361	33%	0.331	S	S	.	.	H	α-helix	trans	-61.9	-46.9	172.3	0	0	0	0	0	113.1	T441 C442 L443 V447 L448 L449	T441-G445 PolarHBondContact O-N 3.24Å; C442-G445 PolarHBondContact O-N 3Å; L443-G445 VanDerWaalsContact C-N 3.31Å; L443-G445 PolarHBondContact O-N 3.4Å; G445-V447 VanDerWaalsContact C-N 3.34Å; G445-V447 PolarHBondContact O-N 3.4Å; G445-L448 WeakPolarHBondContact O-CB 2.6Å; G445-L448 PolarHBondContact O-N 3.2Å; G445-L449 PolarHBondContact O-N 3.33Å
446	L	87.6	Confident	84.1	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.005	35%	0.35	C	S	.	.	H	α-helix	trans	-63.7	-37.7	176.8	-68.9	165.8	0	0	0	112	I425 I428 C442 L443 L448 L449 V464 I465 L468	I425-L446 HydrophobicContact CG2-CD2 3.73Å; I428-L446 HydrophobicContact CG2-CD1 4.49Å; I428-L446 HydrophobicContact CG2-CD2 4.43Å; I428-L446 HydrophobicContact CG2-CG 4.42Å; C442-L446 WeakPolarHBondContact O-CB 3.1Å; C442-L446 WeakPolarHBondContact O-CG 3.41Å; C442-L446 PolarHBondContact O-N 3.33Å; L443-L446 PolarHBondContact O-N 3.23Å; L446-L448 VanDerWaalsContact C-N 3.31Å; L446-L448 PolarHBondContact O-N 2.13Å; L446-L449 HydrophobicContact CD2-CD1 4.39Å; L446-L449 WeakPolarHBondContact O-CB 2.62Å; L446-L449 PolarHBondContact O-N 2.9Å; L446-V464 HydrophobicContact CD1-CG1 3.73Å; L446-I465 HydrophobicContact CB-CD1 3.81Å; L446-I465 HydrophobicContact CB-CG1 3.62Å; L446-I465 HydrophobicContact CD1-CG1 4.15Å; L446-I465 HydrophobicContact CG-CG1 4.49Å; L446-L468 HydrophobicContact CD1-CD1 3.94Å
447	V	84.6	Confident	84.3	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.03	32%	0.321	C	S	.	.	H	α-helix	trans	-65.4	-34.4	176.1	169.7	0	0	0	0	111.5	L443 N444 G445 L449 L450 I465 I479 H482 L486	L443-V447 WeakPolarHBondContact O-CB 3.3Å; L443-V447 WeakPolarHBondContact O-CG2 3.24Å; L443-V447 PolarHBondContact O-N 2.76Å; N444-V447 PolarHBondContact O-N 3.18Å; G445-V447 VanDerWaalsContact C-N 3.34Å; G445-V447 PolarHBondContact O-N 3.4Å; V447-L449 VanDerWaalsContact C-N 3.33Å; V447-L450 WeakPolarHBondContact O-CB 3.49Å; V447-L450 WeakPolarHBondContact O-CG 3.49Å; V447-L450 PolarHBondContact O-N 3.19Å; V447-I465 HydrophobicContact CG2-CD1 3.96Å; V447-I479 HydrophobicContact CG2-CG2 3.78Å; V447-H482 VanDerWaalsContact CG1-ND1 3.26Å; V447-H482 WeakPolarHBondContact CG1-ND1 3.21Å; V447-L486 HydrophobicContact CG1-CD1 4.34Å
448	L	83.6	Confident	84.4	Confident	133 Å²	133	54 Å²	54	70%	0.696	29%	0.288	S	S	*	.	H	α-helix	trans	-67	-33.3	173.6	-175.4	63.5	0	0	0	112.3	N444 G445 L446 L450 S451	N444-L448 PolarHBondContact O-N 3.36Å; N444-L448 VanDerWaalsContact O-N 3.11Å; G445-L448 WeakPolarHBondContact O-CB 2.6Å; G445-L448 PolarHBondContact O-N 3.2Å; L446-L448 VanDerWaalsContact C-N 3.31Å; L446-L448 PolarHBondContact O-N 2.13Å; L448-L450 PolarHBondContact O-N 3.44Å; L448-S451 PolarHBondContact O-N 3.42Å
449	L	84.5	Confident	84.3	Confident	41 Å²	41	53.8 Å²	53.8	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-67.4	-17.8	175.9	-62.6	175.9	0	0	0	113.4	V413 I425 G445 L446 V447 S451 N452 V457	V413-L449 HydrophobicContact CG1-CD1 3.8Å; V413-L449 HydrophobicContact CG1-CD2 3.71Å; V413-L449 HydrophobicContact CG1-CG 4.44Å; I425-L449 HydrophobicContact CD1-CD1 4.22Å; I425-L449 HydrophobicContact CG1-CD1 4.1Å; G445-L449 PolarHBondContact O-N 3.33Å; L446-L449 HydrophobicContact CD2-CD1 4.39Å; L446-L449 WeakPolarHBondContact O-CB 2.62Å; L446-L449 PolarHBondContact O-N 2.9Å; V447-L449 VanDerWaalsContact C-N 3.33Å; L449-S451 PolarHBondContact O-N 3.13Å; L449-N452 VanDerWaalsContact O-CB 3.27Å; L449-N452 WeakPolarHBondContact O-CB 3.32Å; L449-N452 PolarHBondContact O-N 3.36Å; L449-N452 VanDerWaalsContact O-N 3.08Å; L449-V457 HydrophobicContact CB-CG1 4.41Å
450	L	80.8	Confident	84.4	Confident	7 Å²	7	55.3 Å²	55.3	4%	0.037	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.5	175.8	-54.6	-174	0	0	0	113.5	V447 L448 N452 V458 V462 I465 M483 I490	V447-L450 WeakPolarHBondContact O-CB 3.49Å; V447-L450 WeakPolarHBondContact O-CG 3.49Å; V447-L450 PolarHBondContact O-N 3.19Å; L448-L450 PolarHBondContact O-N 3.44Å; L450-N452 VanDerWaalsContact C-N 3.34Å; L450-V458 HydrophobicContact CD2-CG1 4.37Å; L450-V462 HydrophobicContact CD1-CG2 4.24Å; L450-V462 HydrophobicContact CD2-CG2 3.36Å; L450-V462 HydrophobicContact CG-CG2 4.43Å; L450-I465 HydrophobicContact CD1-CD1 3.93Å; L450-I465 HydrophobicContact CD2-CD1 4.06Å; L450-I465 HydrophobicContact CG-CD1 4.16Å; L450-M483 HydrophobicContact CD1-CE 3.98Å; L450-M483 HydrophobicContact CD1-CG 4.26Å; L450-I490 HydrophobicContact CB-CD1 4.32Å
451	S	82.6	Confident	84.6	Confident	77 Å²	77	51.7 Å²	51.7	54%	0.538	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	3	174.3	-58.6	0	0	0	0	113.3	L448 L449	L448-S451 PolarHBondContact O-N 3.42Å; L449-S451 PolarHBondContact O-N 3.13Å
452	N	81.6	Confident	84.5	Confident	66 Å²	66	47.4 Å²	47.4	35%	0.353	25%	0.25	S	C	.	.	S	Bend	trans	-76.1	155.2	174.5	-168.4	17.1	0	0	0	111.2	L449 L450 D454 V458	L449-N452 VanDerWaalsContact O-CB 3.27Å; L449-N452 WeakPolarHBondContact O-CB 3.32Å; L449-N452 PolarHBondContact O-N 3.36Å; L449-N452 VanDerWaalsContact O-N 3.08Å; L450-N452 VanDerWaalsContact C-N 3.34Å; N452-D454 WeakPolarHBondContact ND2-CB 3.39Å; N452-D454 PolarHBondContact ND2-OD2 3.44Å; N452-V458 HydrophobicContact CB-CG2 4.46Å; N452-V458 VanDerWaalsContact O-CG2 3.32Å; N452-V458 WeakPolarHBondContact O-CG2 3.27Å
453	R	77.3	Confident	84.3	Confident	242 Å²	242	49.3 Å²	49.3	91%	0.913	26%	0.261	S	S	*	.	S	Bend	trans	-83.5	-15.4	177.4	-62.8	-175.2	179.7	-172	-0.4	113.8	E455	R453-E455 PolarHBondContact O-N 3.39Å
454	D	83	Confident	84.3	Confident	48 Å²	48	49.3 Å²	49.3	26%	0.257	26%	0.261	S	S	.	.			trans	-74.7	110.3	-180	-68.5	-55.8	0	0	0	111.8	K418 N452 T456 V457 V458	K418-D454 WeakPolarHBondContact CE-OD1 3.02Å; K418-D454 IonicContact NZ-OD1 3.55Å; K418-D454 PolarHBondContact NZ-OD1 3.1Å; K418-D454 IonicContact NZ-OD2 3.23Å; K418-D454 PolarHBondContact NZ-OD2 3.2Å; N452-D454 WeakPolarHBondContact ND2-CB 3.39Å; N452-D454 PolarHBondContact ND2-OD2 3.44Å; D454-T456 VanDerWaalsContact C-N 3.32Å; D454-T456 PolarHBondContact O-N 2.97Å; D454-V457 HydrophobicContact CB-CB 3.88Å; D454-V457 HydrophobicContact CB-CG2 3.94Å; D454-V457 PolarHBondContact O-N 3.17Å; D454-V458 PolarHBondContact O-N 2.9Å; D454-V458 VanDerWaalsContact O-N 3.1Å
455	E	82.9	Confident	84.3	Confident	113 Å²	113	44.9 Å²	44.9	53%	0.528	24%	0.237	S	C	.	.	H	α-helix	trans	-60	-39.2	-174.1	-57.4	-158	141.4	0	0	113.8	R453 V458 A459 V492	R453-E455 PolarHBondContact O-N 3.39Å; E455-V458 PolarHBondContact O-N 3.33Å; E455-A459 WeakPolarHBondContact O-CB 3.48Å; E455-A459 PolarHBondContact O-N 3.31Å; E455-V492 HydrophobicContact CB-CG2 3.76Å; E455-V492 HydrophobicContact CG-CG2 3.89Å
456	T	84.3	Confident	84.2	Confident	74 Å²	74	46 Å²	46	45%	0.454	23%	0.232	S	C	.	.	H	α-helix	trans	-66.4	-38.4	179.6	54.1	0	0	0	0	112.6	D454 E460	D454-T456 VanDerWaalsContact C-N 3.32Å; D454-T456 PolarHBondContact O-N 2.97Å; T456-E460 PolarHBondContact O-N 2.97Å
457	V	86.6	Confident	83.8	Confident	1 Å²	1	48 Å²	48	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-67.5	-43.9	177	163.9	0	0	0	0	110.5	A421 I425 L449 D454 S461	A421-V457 HydrophobicContact CB-CG2 4.16Å; I425-V457 HydrophobicContact CD1-CB 4.26Å; I425-V457 HydrophobicContact CD1-CG1 3.81Å; I425-V457 HydrophobicContact CD1-CG2 4.34Å; L449-V457 HydrophobicContact CB-CG1 4.41Å; D454-V457 HydrophobicContact CB-CB 3.88Å; D454-V457 HydrophobicContact CB-CG2 3.94Å; D454-V457 PolarHBondContact O-N 3.17Å; V457-S461 VanDerWaalsContact O-CB 3.23Å; V457-S461 WeakPolarHBondContact O-CB 3.41Å; V457-S461 PolarHBondContact O-N 3.09Å; V457-S461 PolarHBondContact O-OG 2.92Å
458	V	86.4	Confident	83.7	Confident	4 Å²	4	48 Å²	48	2%	0.024	24%	0.24	C	C	.	.	H	α-helix	trans	-67	-43.5	176.9	175.3	0	0	0	0	110.8	L450 N452 D454 E455 S461 V462 I490 V492 A495	L450-V458 HydrophobicContact CD2-CG1 4.37Å; N452-V458 HydrophobicContact CB-CG2 4.46Å; N452-V458 VanDerWaalsContact O-CG2 3.32Å; N452-V458 WeakPolarHBondContact O-CG2 3.27Å; D454-V458 PolarHBondContact O-N 2.9Å; D454-V458 VanDerWaalsContact O-N 3.1Å; E455-V458 PolarHBondContact O-N 3.33Å; V458-S461 PolarHBondContact O-N 3.18Å; V458-V462 WeakPolarHBondContact O-CG2 3.24Å; V458-V462 PolarHBondContact O-N 3.07Å; V458-I490 HydrophobicContact CG1-CG2 4.2Å; V458-V492 HydrophobicContact CB-CG2 4.15Å; V458-V492 HydrophobicContact CG1-CB 4.36Å; V458-V492 HydrophobicContact CG1-CG2 4.1Å; V458-A495 HydrophobicContact CG1-CB 3.97Å
459	A	83.6	Confident	83.5	Confident	14 Å²	14	41.9 Å²	41.9	12%	0.116	21%	0.208	C	C	.	.	H	α-helix	trans	-57.2	-52.5	177.8	0	0	0	0	0	112.1	E455 V462 V463 V492 M494	E455-A459 WeakPolarHBondContact O-CB 3.48Å; E455-A459 PolarHBondContact O-N 3.31Å; A459-V462 PolarHBondContact O-N 3.4Å; A459-V463 WeakPolarHBondContact O-CG2 3.45Å; A459-V463 PolarHBondContact O-N 2.92Å; A459-V463 VanDerWaalsContact O-N 3.15Å; A459-V492 HydrophobicContact CB-CG1 4.06Å; A459-M494 HydrophobicContact CB-CE 3.86Å
460	E	86.4	Confident	83.2	Confident	34 Å²	34	41.3 Å²	41.3	16%	0.159	21%	0.205	C	C	.	.	H	α-helix	trans	-68.4	-38.1	-179.8	-165.2	57.9	-136.2	0	0	111.8	A422 I425 Q426 T456 V462 V463 V464	A422-E460 HydrophobicContact CB-CB 4.22Å; A422-E460 HydrophobicContact CB-CG 4.24Å; I425-E460 HydrophobicContact CB-CG 4.31Å; I425-E460 HydrophobicContact CG2-CB 4.28Å; I425-E460 HydrophobicContact CG2-CG 4.01Å; Q426-E460 HydrophobicContact CG-CG 3.87Å; Q426-E460 WeakPolarHBondContact CG-OE1 3.45Å; Q426-E460 PolarHBondContact NE2-OE1 3.17Å; Q426-E460 PolarHBondContact NE2-OE2 2.94Å; T456-E460 PolarHBondContact O-N 2.97Å; E460-V462 VanDerWaalsContact C-N 3.32Å; E460-V462 PolarHBondContact O-N 3.32Å; E460-V463 PolarHBondContact O-N 3.31Å; E460-V463 VanDerWaalsContact O-N 3.13Å; E460-V464 WeakPolarHBondContact O-CG2 3.31Å; E460-V464 PolarHBondContact O-N 3.36Å
461	S	88.8	Confident	82.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.5	-42.9	176.2	-62.8	0	0	0	0	111.7	V457 V458 V464 I465	V457-S461 VanDerWaalsContact O-CB 3.23Å; V457-S461 WeakPolarHBondContact O-CB 3.41Å; V457-S461 PolarHBondContact O-N 3.09Å; V457-S461 PolarHBondContact O-OG 2.92Å; V458-S461 PolarHBondContact O-N 3.18Å; S461-V464 PolarHBondContact O-N 3.05Å; S461-I465 WeakPolarHBondContact O-CB 3.36Å; S461-I465 WeakPolarHBondContact O-CD1 3.48Å; S461-I465 WeakPolarHBondContact O-CG1 3.46Å; S461-I465 PolarHBondContact O-N 3.22Å
462	V	84.5	Confident	82.3	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-70.5	-34.7	176.1	-177.1	0	0	0	0	112.3	L450 V458 A459 E460 K466 M483 A495 S498 I499	L450-V462 HydrophobicContact CD1-CG2 4.24Å; L450-V462 HydrophobicContact CD2-CG2 3.36Å; L450-V462 HydrophobicContact CG-CG2 4.43Å; V458-V462 WeakPolarHBondContact O-CG2 3.24Å; V458-V462 PolarHBondContact O-N 3.07Å; A459-V462 PolarHBondContact O-N 3.4Å; E460-V462 VanDerWaalsContact C-N 3.32Å; E460-V462 PolarHBondContact O-N 3.32Å; V462-K466 WeakPolarHBondContact O-CB 3.38Å; V462-K466 PolarHBondContact O-N 3.35Å; V462-M483 HydrophobicContact CG1-CE 4.3Å; V462-A495 HydrophobicContact CB-CB 4.16Å; V462-A495 HydrophobicContact CG2-CB 3.67Å; V462-S498 VanDerWaalsContact CG1-CB 3.43Å; V462-I499 HydrophobicContact CG1-CG1 4.29Å
463	V	83.6	Confident	81.4	Confident	46 Å²	46	42 Å²	42	28%	0.279	21%	0.206	S	C	.	.	H	α-helix	trans	-60.7	-46.5	173.7	170.4	0	0	0	0	110.6	A459 E460 K467 M494	A459-V463 WeakPolarHBondContact O-CG2 3.45Å; A459-V463 PolarHBondContact O-N 2.92Å; A459-V463 VanDerWaalsContact O-N 3.15Å; E460-V463 PolarHBondContact O-N 3.31Å; E460-V463 VanDerWaalsContact O-N 3.13Å; V463-K467 WeakPolarHBondContact O-CB 3.39Å; V463-K467 PolarHBondContact O-N 3.47Å; V463-M494 HydrophobicContact CG2-CE 3.86Å
464	V	86	Confident	80.8	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-67.4	-46.4	178.1	174.8	0	0	0	0	112.1	I425 Q426 G429 L446 E460 S461 K466 K467 L468	I425-V464 HydrophobicContact CG2-CB 4.4Å; I425-V464 HydrophobicContact CG2-CG2 4.04Å; Q426-V464 HydrophobicContact CG-CG2 4.34Å; G429-V464 VanDerWaalsContact CA-CG1 3.42Å; L446-V464 HydrophobicContact CD1-CG1 3.73Å; E460-V464 WeakPolarHBondContact O-CG2 3.31Å; E460-V464 PolarHBondContact O-N 3.36Å; S461-V464 PolarHBondContact O-N 3.05Å; V464-K466 VanDerWaalsContact C-N 3.35Å; V464-K466 PolarHBondContact O-N 2.94Å; V464-K467 WeakPolarHBondContact O-CB 3.36Å; V464-K467 PolarHBondContact O-N 2.9Å; V464-K467 VanDerWaalsContact O-N 3.14Å; V464-L468 HydrophobicContact CG1-CD1 4.03Å; V464-L468 HydrophobicContact CG1-CG 4.43Å; V464-L468 WeakPolarHBondContact O-CG 3.31Å; V464-L468 PolarHBondContact O-N 3.32Å
465	I	86.6	Confident	80	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-57.7	-48.6	175.9	-68.7	161.4	0	0	0	110.3	L443 L446 V447 L450 S461 K467 L468 L469 M483	L443-I465 HydrophobicContact CD2-CG1 4.39Å; L443-I465 HydrophobicContact CD2-CG2 4.25Å; L446-I465 HydrophobicContact CB-CD1 3.81Å; L446-I465 HydrophobicContact CB-CG1 3.62Å; L446-I465 HydrophobicContact CD1-CG1 4.15Å; L446-I465 HydrophobicContact CG-CG1 4.49Å; V447-I465 HydrophobicContact CG2-CD1 3.96Å; L450-I465 HydrophobicContact CD1-CD1 3.93Å; L450-I465 HydrophobicContact CD2-CD1 4.06Å; L450-I465 HydrophobicContact CG-CD1 4.16Å; S461-I465 WeakPolarHBondContact O-CB 3.36Å; S461-I465 WeakPolarHBondContact O-CD1 3.48Å; S461-I465 WeakPolarHBondContact O-CG1 3.46Å; S461-I465 PolarHBondContact O-N 3.22Å; I465-K467 PolarHBondContact O-N 3.48Å; I465-L468 PolarHBondContact O-N 3.2Å; I465-L469 HydrophobicContact CG2-CD1 3.59Å; I465-L469 HydrophobicContact CG2-CG 4.04Å; I465-L469 WeakPolarHBondContact O-CB 3.45Å; I465-L469 WeakPolarHBondContact O-CG 3.47Å; I465-L469 PolarHBondContact O-N 3.25Å; I465-M483 HydrophobicContact CB-CE 4.27Å; I465-M483 HydrophobicContact CD1-CE 4.17Å; I465-M483 HydrophobicContact CG2-CE 3.62Å; I465-M483 HydrophobicContact CG2-SD 3.72Å
466	K	82.4	Confident	79.3	Confident	58 Å²	58	34.2 Å²	34.2	25%	0.252	19%	0.186	S	C	.	.	H	α-helix	trans	-55	-42.7	177.2	172.8	-176.4	166.7	-172.6	0	111.5	V462 V464 Q470 W501 L502	V462-K466 WeakPolarHBondContact O-CB 3.38Å; V462-K466 PolarHBondContact O-N 3.35Å; V464-K466 VanDerWaalsContact C-N 3.35Å; V464-K466 PolarHBondContact O-N 2.94Å; K466-Q470 WeakPolarHBondContact O-CG 3.28Å; K466-Q470 PolarHBondContact O-N 3.13Å; K466-Q470 VanDerWaalsContact O-N 3.11Å; K466-W501 HydrophobicContact CD-CE3 3.92Å; K466-W501 HydrophobicContact CD-CZ3 4.27Å; K466-W501 VanDerWaalsContact CE-CE3 3.46Å; K466-W501 HydrophobicContact CG-CE3 3.94Å; K466-W501 HydrophobicContact CG-CZ3 3.87Å; K466-L502 HydrophobicContact CB-CD1 4.11Å; K466-L502 HydrophobicContact CB-CD2 4.45Å; K466-L502 HydrophobicContact CB-CG 4.37Å; K466-L502 HydrophobicContact CG-CD2 4.25Å; K466-L502 HydrophobicContact CG-CG 4.28Å
467	K	80.6	Confident	78.8	Confident	45 Å²	45	32.1 Å²	32.1	20%	0.196	17%	0.174	C	C	.	.	H	α-helix	trans	-67.3	-47.8	-178.2	-159.5	152.9	-179.8	-164.8	0	111.9	V463 V464 I465 L469 Q470 T471 P605 V606 L607	V463-K467 WeakPolarHBondContact O-CB 3.39Å; V463-K467 PolarHBondContact O-N 3.47Å; V464-K467 WeakPolarHBondContact O-CB 3.36Å; V464-K467 PolarHBondContact O-N 2.9Å; V464-K467 VanDerWaalsContact O-N 3.14Å; I465-K467 PolarHBondContact O-N 3.48Å; K467-L469 PolarHBondContact O-N 2.95Å; K467-Q470 PolarHBondContact O-N 2.88Å; K467-T471 PolarHBondContact O-N 3.17Å; K467-T471 PolarHBondContact O-OG1 3.46Å; K467-P605 HydrophobicContact CD-CG 4.21Å; K467-P605 VanDerWaalsContact CE-C 3.42Å; K467-P605 WeakPolarHBondContact CE-O 3.46Å; K467-P605 HydrophobicContact CG-CG 4.08Å; K467-P605 VanDerWaalsContact CG-O 3.27Å; K467-P605 WeakPolarHBondContact CG-O 3.46Å; K467-V606 WeakPolarHBondContact CE-O 3.38Å; K467-V606 PolarHBondContact NZ-O 2.98Å; K467-L607 HydrophobicContact CB-CD1 4.24Å; K467-L607 HydrophobicContact CD-CD1 4.16Å; K467-L607 HydrophobicContact CD-CD2 3.95Å; K467-L607 HydrophobicContact CD-CG 3.63Å; K467-L607 HydrophobicContact CG-CD1 3.93Å; K467-L607 HydrophobicContact CG-CG 3.86Å
468	L	82.1	Confident	78.3	Confident	4 Å²	4	37 Å²	37	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-44.8	173.7	-70.3	171.5	0	0	0	112.3	A432 T433 L443 L446 V464 I465 Q470 T471 Q472 L607	A432-L468 HydrophobicContact CB-CD1 4Å; A432-L468 HydrophobicContact CB-CD2 3.84Å; T433-L468 WeakPolarHBondContact OG1-CD2 3.45Å; L443-L468 HydrophobicContact CD2-CB 3.89Å; L443-L468 HydrophobicContact CD2-CD1 3.71Å; L443-L468 HydrophobicContact CD2-CG 4.47Å; L443-L468 HydrophobicContact CG-CD1 4.13Å; L446-L468 HydrophobicContact CD1-CD1 3.94Å; V464-L468 HydrophobicContact CG1-CD1 4.03Å; V464-L468 HydrophobicContact CG1-CG 4.43Å; V464-L468 WeakPolarHBondContact O-CG 3.31Å; V464-L468 PolarHBondContact O-N 3.32Å; I465-L468 PolarHBondContact O-N 3.2Å; L468-Q470 PolarHBondContact O-N 3.15Å; L468-T471 PolarHBondContact O-N 3.38Å; L468-Q472 PolarHBondContact O-N 3.46Å; L468-L607 HydrophobicContact CD2-CD1 4.33Å
469	L	79.9	Confident	78	Confident	4 Å²	4	37.4 Å²	37.4	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-24.8	177.1	-70.3	177.8	0	0	0	113.3	I465 K467 P473 H476 I480 M483 L502 Y506	I465-L469 HydrophobicContact CG2-CD1 3.59Å; I465-L469 HydrophobicContact CG2-CG 4.04Å; I465-L469 WeakPolarHBondContact O-CB 3.45Å; I465-L469 WeakPolarHBondContact O-CG 3.47Å; I465-L469 PolarHBondContact O-N 3.25Å; K467-L469 PolarHBondContact O-N 2.95Å; L469-P473 WeakPolarHBondContact O-CA 3.37Å; L469-H476 HydrophobicContact CD2-CB 3.4Å; L469-H476 VanDerWaalsContact CD2-CB 3.4Å; L469-I480 HydrophobicContact CD1-CG1 4.41Å; L469-M483 HydrophobicContact CD1-SD 4.28Å; L469-L502 HydrophobicContact CB-CD2 4.04Å; L469-L502 HydrophobicContact CD1-CD1 3.86Å; L469-L502 HydrophobicContact CD1-CD2 3.86Å; L469-L502 HydrophobicContact CD1-CG 4.49Å; L469-Y506 PolarHBondContact O-OH 2.91Å
470	Q	77.6	Confident	77.9	Confident	29 Å²	29	37.1 Å²	37.1	14%	0.136	20%	0.198	C	C	.	.	H	α-helix	trans	-77.7	-32.5	172	-73.3	-178	-102.4	0	0	112.6	K466 K467 L468 W501 A604	K466-Q470 WeakPolarHBondContact O-CG 3.28Å; K466-Q470 PolarHBondContact O-N 3.13Å; K466-Q470 VanDerWaalsContact O-N 3.11Å; K467-Q470 PolarHBondContact O-N 2.88Å; L468-Q470 PolarHBondContact O-N 3.15Å; Q470-W501 HydrophobicContact CG-CH2 3.84Å; Q470-W501 HydrophobicContact CG-CZ3 4Å; Q470-A604 HydrophobicContact CB-CB 3.8Å
471	T	73.3	Confident	77.7	Confident	66 Å²	66	39 Å²	39	41%	0.405	21%	0.206	S	C	.	.	H	α-helix	trans	-72.8	-40.9	177	-50.7	0	0	0	0	112.3	K467 L468 P473	K467-T471 PolarHBondContact O-N 3.17Å; K467-T471 PolarHBondContact O-OG1 3.46Å; L468-T471 PolarHBondContact O-N 3.38Å; T471-P473 VanDerWaalsContact C-CD 3.43Å; T471-P473 VanDerWaalsContact O-CD 3.24Å; T471-P473 WeakPolarHBondContact O-CD 3.45Å
472	Q	70.1	Confident	77.3	Confident	46 Å²	46	43.3 Å²	43.3	22%	0.215	23%	0.226	C	C	.	.	S	Bend	trans	-118.2	70.9	-179.9	-66.2	-178	16.8	0	0	111.1	L468 T474 H476	L468-Q472 PolarHBondContact O-N 3.46Å; Q472-T474 PolarHBondContact O-N 3.32Å; Q472-T474 VanDerWaalsContact O-N 3.14Å; Q472-H476 PolarHBondContact O-CD2 3.04Å; Q472-H476 VanDerWaalsContact O-CD2 3.31Å; Q472-H476 PolarHBondContact OE1-NE2 3.25Å
473	P	64.1	Low	77.1	Confident	52 Å²	52	43.5 Å²	43.5	34%	0.338	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-6.1	-168.3	30.9	-38.2	0	0	0	114.5	L469 T471 Y506 R509	L469-P473 WeakPolarHBondContact O-CA 3.37Å; T471-P473 VanDerWaalsContact C-CD 3.43Å; T471-P473 VanDerWaalsContact O-CD 3.24Å; T471-P473 WeakPolarHBondContact O-CD 3.45Å; P473-Y506 HydrophobicContact CB-CE1 4.3Å; P473-R509 PolarHBondContact O-NH1 2.92Å; P473-R509 PolarHBondContact O-NH2 2.96Å
474	T	63.8	Low	76.9	Confident	106 Å²	106	41.4 Å²	41.4	65%	0.65	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-32.3	-171.1	48.7	0	0	0	0	115.1	Q472	Q472-T474 PolarHBondContact O-N 3.32Å; Q472-T474 VanDerWaalsContact O-N 3.14Å
475	Q	66	Low	76.8	Confident	127 Å²	127	48.8 Å²	48.8	59%	0.593	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-39	-164.4	-68.2	173.7	-11.2	0	0	113.7	C477	Q475-C477 VanDerWaalsContact C-N 3.33Å; Q475-C477 PolarHBondContact O-N 3.46Å
476	H	68	Low	76.5	Confident	7 Å²	7	50 Å²	50	3%	0.032	25%	0.253	C	S	.	.			trans	-89	39.1	-163.5	-46.5	-61.6	0	0	0	115.5	D440 L443 L469 Q472 D478 I479	D440-H476 IonicContact OD1-CE1 2.73Å; D440-H476 PolarHBondContact OD1-CE1 3.24Å; D440-H476 IonicContact OD1-ND1 2.61Å; D440-H476 PolarHBondContact OD1-ND1 2.84Å; L443-H476 VanDerWaalsContact CD1-CE1 3.49Å; L443-H476 WeakPolarHBondContact CD1-CE1 3.39Å; L469-H476 HydrophobicContact CD2-CB 3.4Å; L469-H476 VanDerWaalsContact CD2-CB 3.4Å; Q472-H476 PolarHBondContact O-CD2 3.04Å; Q472-H476 VanDerWaalsContact O-CD2 3.31Å; Q472-H476 PolarHBondContact OE1-NE2 3.25Å; H476-D478 VanDerWaalsContact C-N 3.26Å; H476-D478 PolarHBondContact O-N 2.94Å; H476-I479 HydrophobicContact CB-CB 4.26Å; H476-I479 HydrophobicContact CB-CD1 3.87Å; H476-I479 HydrophobicContact CB-CG1 4.47Å; H476-I479 PolarHBondContact O-N 2.81Å
477	C	73.7	Confident	76.5	Confident	30 Å²	30	47.4 Å²	47.4	20%	0.203	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-32.6	-177.7	-75	0	0	0	0	113.6	Q475 K481	Q475-C477 VanDerWaalsContact C-N 3.33Å; Q475-C477 PolarHBondContact O-N 3.46Å; C477-K481 WeakPolarHBondContact O-CG 3.48Å; C477-K481 PolarHBondContact O-N 3.41Å
478	D	77.4	Confident	76.5	Confident	104 Å²	104	49.6 Å²	49.6	56%	0.556	26%	0.256	S	S	*	.	H	α-helix	trans	-77.5	-28.1	-179	-73	-81.2	0	0	0	113.4	H476 I480 K481 H482	H476-D478 VanDerWaalsContact C-N 3.26Å; H476-D478 PolarHBondContact O-N 2.94Å; D478-I480 VanDerWaalsContact C-N 3.32Å; D478-I480 PolarHBondContact O-N 3.11Å; D478-K481 WeakPolarHBondContact O-CB 3.35Å; D478-K481 PolarHBondContact O-N 2.62Å; D478-K481 WeakPolarHBondContact OD1-CD 3.3Å; D478-K481 WeakPolarHBondContact OD1-CE 3.38Å; D478-K481 IonicContact OD1-NZ 3.67Å; D478-K481 PolarHBondContact OD1-NZ 2.96Å; D478-K481 IonicContact OD2-NZ 2.64Å; D478-K481 PolarHBondContact OD2-NZ 2.68Å; D478-K481 VanDerWaalsContact OD2-NZ 3.16Å; D478-H482 PolarHBondContact O-N 2.88Å
479	I	80.3	Confident	76.5	Confident	13 Å²	13	55.5 Å²	55.5	7%	0.067	29%	0.287	C	S	.	.	H	α-helix	trans	-62.9	-41.1	171.8	-70.9	165.6	0	0	0	110.3	L443 V447 H476 K481 H482 M483	L443-I479 HydrophobicContact CB-CD1 3.8Å; L443-I479 HydrophobicContact CD1-CD1 4.01Å; L443-I479 HydrophobicContact CG-CD1 4.47Å; V447-I479 HydrophobicContact CG2-CG2 3.78Å; H476-I479 HydrophobicContact CB-CB 4.26Å; H476-I479 HydrophobicContact CB-CD1 3.87Å; H476-I479 HydrophobicContact CB-CG1 4.47Å; H476-I479 PolarHBondContact O-N 2.81Å; I479-K481 VanDerWaalsContact C-N 3.33Å; I479-K481 PolarHBondContact O-N 2.87Å; I479-H482 WeakPolarHBondContact O-CB 3.38Å; I479-H482 PolarHBondContact O-N 3.4Å; I479-H482 VanDerWaalsContact O-N 3.1Å; I479-M483 HydrophobicContact CG2-CG 4.39Å; I479-M483 HydrophobicContact CG2-SD 4.17Å; I479-M483 WeakPolarHBondContact O-CG 3.09Å; I479-M483 PolarHBondContact O-N 3.39Å
480	I	80.4	Confident	76.6	Confident	7 Å²	7	55.6 Å²	55.6	4%	0.036	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-40.4	175.5	-56.5	164.1	0	0	0	110.7	L469 D478 H482 A484 Y506 V510	L469-I480 HydrophobicContact CD1-CG1 4.41Å; D478-I480 VanDerWaalsContact C-N 3.32Å; D478-I480 PolarHBondContact O-N 3.11Å; I480-H482 VanDerWaalsContact C-N 3.3Å; I480-H482 PolarHBondContact O-N 2.99Å; I480-A484 WeakPolarHBondContact O-CB 3.42Å; I480-A484 PolarHBondContact O-N 3.04Å; I480-Y506 HydrophobicContact CD1-CD2 3.48Å; I480-Y506 VanDerWaalsContact CD1-CD2 3.48Å; I480-Y506 HydrophobicContact CD1-CE2 4.23Å; I480-Y506 HydrophobicContact CD1-CG 4.05Å; I480-V510 HydrophobicContact CG2-CG2 3.94Å
481	K	81.6	Confident	76.7	Confident	74 Å²	74	59.1 Å²	59.1	32%	0.322	31%	0.311	S	S	.	.	H	α-helix	trans	-63.1	-36	174.3	-59.1	168.7	-154.2	163.1	0	111.6	C477 D478 I479 K485 I513	C477-K481 WeakPolarHBondContact O-CG 3.48Å; C477-K481 PolarHBondContact O-N 3.41Å; D478-K481 WeakPolarHBondContact O-CB 3.35Å; D478-K481 PolarHBondContact O-N 2.62Å; D478-K481 WeakPolarHBondContact OD1-CD 3.3Å; D478-K481 WeakPolarHBondContact OD1-CE 3.38Å; D478-K481 IonicContact OD1-NZ 3.67Å; D478-K481 PolarHBondContact OD1-NZ 2.96Å; D478-K481 IonicContact OD2-NZ 2.64Å; D478-K481 PolarHBondContact OD2-NZ 2.68Å; D478-K481 VanDerWaalsContact OD2-NZ 3.16Å; I479-K481 VanDerWaalsContact C-N 3.33Å; I479-K481 PolarHBondContact O-N 2.87Å; K481-K485 PolarHBondContact O-N 3.41Å; K481-I513 HydrophobicContact CB-CD1 4.26Å; K481-I513 HydrophobicContact CG-CD1 4.25Å
482	H	80.4	Confident	77.3	Confident	90 Å²	90	56.5 Å²	56.5	42%	0.417	30%	0.295	S	S	.	.	H	α-helix	trans	-71	-47.6	177.7	-162.2	-95.8	0	0	0	112.1	V447 D478 I479 I480 A484 K485 L486	V447-H482 VanDerWaalsContact CG1-ND1 3.26Å; V447-H482 WeakPolarHBondContact CG1-ND1 3.21Å; D478-H482 PolarHBondContact O-N 2.88Å; I479-H482 WeakPolarHBondContact O-CB 3.38Å; I479-H482 PolarHBondContact O-N 3.4Å; I479-H482 VanDerWaalsContact O-N 3.1Å; I480-H482 VanDerWaalsContact C-N 3.3Å; I480-H482 PolarHBondContact O-N 2.99Å; H482-A484 VanDerWaalsContact C-N 3.28Å; H482-A484 PolarHBondContact O-N 3.39Å; H482-K485 WeakPolarHBondContact O-CB 3.37Å; H482-K485 PolarHBondContact O-N 3.12Å; H482-L486 PolarHBondContact O-N 2.85Å; H482-L486 VanDerWaalsContact O-N 3.09Å
483	M	80.4	Confident	78	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.02	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-39.2	174.9	-65.3	175.6	91.2	0	0	111.9	L450 V462 I465 L469 I479 K485 L486 F487 I499 L502	L450-M483 HydrophobicContact CD1-CE 3.98Å; L450-M483 HydrophobicContact CD1-CG 4.26Å; V462-M483 HydrophobicContact CG1-CE 4.3Å; I465-M483 HydrophobicContact CB-CE 4.27Å; I465-M483 HydrophobicContact CD1-CE 4.17Å; I465-M483 HydrophobicContact CG2-CE 3.62Å; I465-M483 HydrophobicContact CG2-SD 3.72Å; L469-M483 HydrophobicContact CD1-SD 4.28Å; I479-M483 HydrophobicContact CG2-CG 4.39Å; I479-M483 HydrophobicContact CG2-SD 4.17Å; I479-M483 WeakPolarHBondContact O-CG 3.09Å; I479-M483 PolarHBondContact O-N 3.39Å; M483-K485 VanDerWaalsContact C-N 3.27Å; M483-K485 PolarHBondContact O-N 3.3Å; M483-L486 PolarHBondContact O-N 3.13Å; M483-F487 PolarHBondContact O-N 3.07Å; M483-F487 VanDerWaalsContact O-N 3.08Å; M483-I499 HydrophobicContact CE-CG1 4.04Å; M483-L502 HydrophobicContact CE-CD1 4.09Å; M483-L502 HydrophobicContact SD-CD1 4.29Å
484	A	80.8	Confident	79	Confident	3 Å²	3	58 Å²	58	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-68.4	-21.5	177	0	0	0	0	0	114	I480 H482 M503 I513	I480-A484 WeakPolarHBondContact O-CB 3.42Å; I480-A484 PolarHBondContact O-N 3.04Å; H482-A484 VanDerWaalsContact C-N 3.28Å; H482-A484 PolarHBondContact O-N 3.39Å; A484-M503 HydrophobicContact CB-CE 4.34Å; A484-M503 HydrophobicContact CB-SD 4Å; A484-I513 HydrophobicContact CB-CG2 3.86Å
485	K	83.1	Confident	79.9	Confident	156 Å²	156	53 Å²	53	68%	0.678	27%	0.272	S	S	*	.	H	α-helix	trans	-78.6	-42.3	169.1	-72.1	174.7	177.6	-175.5	0	111.9	K481 H482 M483 F487	K481-K485 PolarHBondContact O-N 3.41Å; H482-K485 WeakPolarHBondContact O-CB 3.37Å; H482-K485 PolarHBondContact O-N 3.12Å; M483-K485 VanDerWaalsContact C-N 3.27Å; M483-K485 PolarHBondContact O-N 3.3Å; K485-F487 PolarHBondContact O-N 2.54Å
486	L	79.9	Confident	80.9	Confident	26 Å²	26	48.3 Å²	48.3	14%	0.136	25%	0.249	C	C	.	.	H	α-helix	trans	-71.5	-13.9	179.7	-67.2	178.2	0	0	0	113.9	V447 H482 M483 D488 N489 I490	V447-L486 HydrophobicContact CG1-CD1 4.34Å; H482-L486 PolarHBondContact O-N 2.85Å; H482-L486 VanDerWaalsContact O-N 3.09Å; M483-L486 PolarHBondContact O-N 3.13Å; L486-D488 PolarHBondContact O-N 3.22Å; L486-D488 VanDerWaalsContact O-N 3.07Å; L486-N489 PolarHBondContact O-N 3.25Å; L486-I490 HydrophobicContact CB-CD1 4.36Å
487	F	82.3	Confident	81.9	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.009	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-52	-31.9	-176.6	-175.1	-95	0	0	0	115.1	M483 K485 N489 R496 I499 L500 V517 M521	M483-F487 PolarHBondContact O-N 3.07Å; M483-F487 VanDerWaalsContact O-N 3.08Å; K485-F487 PolarHBondContact O-N 2.54Å; F487-N489 VanDerWaalsContact C-N 3.28Å; F487-N489 PolarHBondContact O-N 3.16Å; F487-R496 HydrophobicContact CE2-CB 4Å; F487-R496 HydrophobicContact CE2-CG 4.3Å; F487-R496 HydrophobicContact CZ-CB 4.31Å; F487-R496 PolarHBondContact O-NH1 3.19Å; F487-R496 VanDerWaalsContact O-NH1 3.12Å; F487-I499 HydrophobicContact CD2-CB 4.08Å; F487-I499 HydrophobicContact CD2-CD1 4.21Å; F487-I499 HydrophobicContact CD2-CG2 3.75Å; F487-I499 HydrophobicContact CE2-CB 4.41Å; F487-I499 HydrophobicContact CE2-CG2 4.41Å; F487-L500 HydrophobicContact CE2-CD1 4.5Å; F487-L500 HydrophobicContact CE2-CD2 4.12Å; F487-L500 HydrophobicContact CE2-CG 3.97Å; F487-L500 HydrophobicContact CZ-CD1 4.31Å; F487-L500 HydrophobicContact CZ-CD2 4.02Å; F487-L500 HydrophobicContact CZ-CG 4.12Å; F487-V517 HydrophobicContact CD1-CG1 3.94Å; F487-V517 HydrophobicContact CE1-CG1 3.99Å; F487-V517 HydrophobicContact CG-CG1 4.34Å; F487-V517 HydrophobicContact CZ-CG1 4.41Å; F487-M521 HydrophobicContact CE1-CG 4.35Å; F487-M521 HydrophobicContact CE1-SD 3.54Å; F487-M521 VanDerWaalsContact CE1-SD 3.54Å; F487-M521 HydrophobicContact CZ-CG 4.31Å; F487-M521 HydrophobicContact CZ-SD 3.44Å; F487-M521 WeakPolarHBondContact CZ-SD 3.33Å
488	D	81.8	Confident	82.4	Confident	92 Å²	92	47.3 Å²	47.3	49%	0.492	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-68.8	-27.2	179.1	-63.6	-17.9	0	0	0	112.7	L486 K520	L486-D488 PolarHBondContact O-N 3.22Å; L486-D488 VanDerWaalsContact O-N 3.07Å; D488-K520 WeakPolarHBondContact OD1-CD 3.36Å; D488-K520 WeakPolarHBondContact OD1-CE 3.4Å; D488-K520 IonicContact OD1-NZ 2.69Å; D488-K520 PolarHBondContact OD1-NZ 3.48Å; D488-K520 IonicContact OD2-NZ 2.72Å; D488-K520 PolarHBondContact OD2-NZ 3.43Å
489	N	82	Confident	82.8	Confident	127 Å²	127	42.6 Å²	42.6	68%	0.679	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-89.1	-12.9	-176.8	-62.3	-10	0	0	0	113.1	L486 F487	L486-N489 PolarHBondContact O-N 3.25Å; F487-N489 VanDerWaalsContact C-N 3.28Å; F487-N489 PolarHBondContact O-N 3.16Å
490	I	81	Confident	83.2	Confident	6 Å²	6	42 Å²	42	3%	0.031	22%	0.215	C	C	.	.			trans	-94	105.7	-171.3	-63.3	169.3	0	0	0	109.4	L450 V458 L486 V492 A495 R496 I499	L450-I490 HydrophobicContact CB-CD1 4.32Å; V458-I490 HydrophobicContact CG1-CG2 4.2Å; L486-I490 HydrophobicContact CB-CD1 4.36Å; I490-V492 HydrophobicContact CG2-CB 4.43Å; I490-A495 HydrophobicContact CG2-CB 3.68Å; I490-R496 HydrophobicContact CG2-CG 4.21Å; I490-R496 VanDerWaalsContact O-CD 3.23Å; I490-R496 WeakPolarHBondContact O-CD 3.28Å; I490-R496 VanDerWaalsContact O-CG 3.25Å; I490-R496 WeakPolarHBondContact O-CG 3.2Å; I490-R496 PolarHBondContact O-NH1 3.05Å; I490-I499 HydrophobicContact CD1-CD1 3.57Å
491	T	80.8	Confident	83.6	Confident	104 Å²	104	43 Å²	43	64%	0.638	22%	0.218	S	C	*	.			trans	-71	-38.8	173.9	52.3	0	0	0	0	112.5	P493 R496	T491-P493 WeakPolarHBondContact O-CD 3.4Å; T491-R496 VanDerWaalsContact O-CD 3.29Å; T491-R496 WeakPolarHBondContact O-CD 3.43Å
492	V	85.1	Confident	83.7	Confident	11 Å²	11	39.6 Å²	39.6	7%	0.067	20%	0.204	C	C	.	.			trans	-58.1	114.6	-166.4	-176.4	0	0	0	0	112.8	E455 V458 A459 I490 M494 A495 R496	E455-V492 HydrophobicContact CB-CG2 3.76Å; E455-V492 HydrophobicContact CG-CG2 3.89Å; V458-V492 HydrophobicContact CB-CG2 4.15Å; V458-V492 HydrophobicContact CG1-CB 4.36Å; V458-V492 HydrophobicContact CG1-CG2 4.1Å; A459-V492 HydrophobicContact CB-CG1 4.06Å; I490-V492 HydrophobicContact CG2-CB 4.43Å; V492-M494 PolarHBondContact O-N 3.29Å; V492-A495 HydrophobicContact CB-CB 4Å; V492-A495 HydrophobicContact CG1-CB 4.19Å; V492-A495 WeakPolarHBondContact O-CB 3.5Å; V492-A495 PolarHBondContact O-N 2.87Å; V492-A495 VanDerWaalsContact O-N 3.1Å; V492-R496 WeakPolarHBondContact O-CG 3.48Å; V492-R496 PolarHBondContact O-N 3.18Å
493	P	85.6	Confident	83.8	Confident	44 Å²	44	35.4 Å²	35.4	29%	0.286	18%	0.184	S	C	.	.	H	α-helix	trans	-54.9	-44.9	-175.1	-32.1	37.9	0	0	0	115.3	T491 A495 R496 A497 E529 V532	T491-P493 WeakPolarHBondContact O-CD 3.4Å; P493-A495 VanDerWaalsContact C-N 3.28Å; P493-A495 PolarHBondContact O-N 3Å; P493-R496 PolarHBondContact O-N 2.93Å; P493-A497 WeakPolarHBondContact O-CB 3.31Å; P493-A497 PolarHBondContact O-N 3.02Å; P493-E529 HydrophobicContact CB-CB 3.82Å; P493-E529 HydrophobicContact CB-CG 3.89Å; P493-E529 HydrophobicContact CG-CB 4.07Å; P493-E529 HydrophobicContact CG-CG 3.59Å; P493-V532 HydrophobicContact CB-CG2 4Å; P493-V532 WeakPolarHBondContact O-CG2 3.09Å
494	M	83.6	Confident	84	Confident	85 Å²	85	35.4 Å²	35.4	42%	0.419	19%	0.185	S	C	.	.	H	α-helix	trans	-66.8	-31.5	-178.6	-169.3	166.1	71.5	0	0	112.5	A459 V463 V492 S498	A459-M494 HydrophobicContact CB-CE 3.86Å; V463-M494 HydrophobicContact CG2-CE 3.86Å; V492-M494 PolarHBondContact O-N 3.29Å; M494-S498 VanDerWaalsContact O-CB 3.29Å; M494-S498 WeakPolarHBondContact O-CB 3.26Å; M494-S498 PolarHBondContact O-N 2.96Å; M494-S498 VanDerWaalsContact O-N 3.16Å; M494-S498 PolarHBondContact O-OG 3.31Å
495	A	84.3	Confident	84	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-70.9	-48.8	173.2	0	0	0	0	0	111	V458 V462 I490 V492 P493 A497 S498 I499	V458-A495 HydrophobicContact CG1-CB 3.97Å; V462-A495 HydrophobicContact CB-CB 4.16Å; V462-A495 HydrophobicContact CG2-CB 3.67Å; I490-A495 HydrophobicContact CG2-CB 3.68Å; V492-A495 HydrophobicContact CB-CB 4Å; V492-A495 HydrophobicContact CG1-CB 4.19Å; V492-A495 WeakPolarHBondContact O-CB 3.5Å; V492-A495 PolarHBondContact O-N 2.87Å; V492-A495 VanDerWaalsContact O-N 3.1Å; P493-A495 VanDerWaalsContact C-N 3.28Å; P493-A495 PolarHBondContact O-N 3Å; A495-A497 PolarHBondContact O-N 2.84Å; A495-S498 PolarHBondContact O-N 3.21Å; A495-S498 VanDerWaalsContact O-N 3.16Å; A495-I499 WeakPolarHBondContact O-CG1 3.38Å; A495-I499 PolarHBondContact O-N 3.33Å
496	R	86.9	Confident	83.8	Confident	30 Å²	30	30.9 Å²	30.9	11%	0.113	17%	0.165	C	C	.	.	H	α-helix	trans	-54.3	-52.4	175.8	-64.9	175.3	75.3	68.7	-2.5	111.2	F487 I490 T491 V492 P493 S498 I499 L500 E528 V532	F487-R496 HydrophobicContact CE2-CB 4Å; F487-R496 HydrophobicContact CE2-CG 4.3Å; F487-R496 HydrophobicContact CZ-CB 4.31Å; F487-R496 PolarHBondContact O-NH1 3.19Å; F487-R496 VanDerWaalsContact O-NH1 3.12Å; I490-R496 HydrophobicContact CG2-CG 4.21Å; I490-R496 VanDerWaalsContact O-CD 3.23Å; I490-R496 WeakPolarHBondContact O-CD 3.28Å; I490-R496 VanDerWaalsContact O-CG 3.25Å; I490-R496 WeakPolarHBondContact O-CG 3.2Å; I490-R496 PolarHBondContact O-NH1 3.05Å; T491-R496 VanDerWaalsContact O-CD 3.29Å; T491-R496 WeakPolarHBondContact O-CD 3.43Å; V492-R496 WeakPolarHBondContact O-CG 3.48Å; V492-R496 PolarHBondContact O-N 3.18Å; P493-R496 PolarHBondContact O-N 2.93Å; R496-S498 VanDerWaalsContact C-N 3.3Å; R496-S498 PolarHBondContact O-N 2.78Å; R496-I499 PolarHBondContact O-N 3.34Å; R496-L500 WeakPolarHBondContact O-CG 3.17Å; R496-L500 PolarHBondContact O-N 2.99Å; R496-E528 IonicContact CZ-OE1 3.68Å; R496-E528 IonicContact CZ-OE2 2.71Å; R496-E528 IonicContact NE-OE1 2.8Å; R496-E528 IonicContact NE-OE2 3.48Å; R496-E528 PolarHBondContact NE-OE2 3.32Å; R496-E528 IonicContact NH2-OE1 3.17Å; R496-E528 PolarHBondContact NH2-OE1 2.89Å; R496-E528 IonicContact NH2-OE2 3.89Å; R496-E528 PolarHBondContact NH2-OE2 3.32Å; R496-V532 HydrophobicContact CB-CG1 4.1Å; R496-V532 HydrophobicContact CB-CG2 4.07Å
497	A	88.1	Confident	83.6	Confident	4 Å²	4	29.9 Å²	29.9	3%	0.033	16%	0.16	C	C	.	.	H	α-helix	trans	-58.7	-39.2	178.1	0	0	0	0	0	113	P493 A495 W501 I531 V532 Q535	P493-A497 WeakPolarHBondContact O-CB 3.31Å; P493-A497 PolarHBondContact O-N 3.02Å; A495-A497 PolarHBondContact O-N 2.84Å; A497-W501 WeakPolarHBondContact O-CB 3.33Å; A497-W501 PolarHBondContact O-N 3.36Å; A497-I531 HydrophobicContact CB-CB 4.49Å; A497-I531 HydrophobicContact CB-CG2 3.77Å; A497-V532 HydrophobicContact CB-CG2 4.27Å; A497-Q535 HydrophobicContact CB-CB 4.42Å; A497-Q535 HydrophobicContact CB-CG 3.94Å
498	S	84.6	Confident	83.4	Confident	12 Å²	12	36.3 Å²	36.3	8%	0.084	19%	0.19	C	C	.	.	H	α-helix	trans	-74.3	-32.9	-179.8	-65.9	0	0	0	0	113.3	V462 M494 A495 R496 W501 L502	V462-S498 VanDerWaalsContact CG1-CB 3.43Å; M494-S498 VanDerWaalsContact O-CB 3.29Å; M494-S498 WeakPolarHBondContact O-CB 3.26Å; M494-S498 PolarHBondContact O-N 2.96Å; M494-S498 VanDerWaalsContact O-N 3.16Å; M494-S498 PolarHBondContact O-OG 3.31Å; A495-S498 PolarHBondContact O-N 3.21Å; A495-S498 VanDerWaalsContact O-N 3.16Å; R496-S498 VanDerWaalsContact C-N 3.3Å; R496-S498 PolarHBondContact O-N 2.78Å; S498-W501 PolarHBondContact O-N 3.19Å; S498-L502 WeakPolarHBondContact O-CG 3.48Å; S498-L502 PolarHBondContact O-N 3.3Å
499	I	86.3	Confident	83	Confident	5 Å²	5	36.4 Å²	36.4	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-67.2	-44.6	171.3	-66.2	162.8	0	0	0	110.6	V462 M483 F487 I490 A495 R496 W501 L502 M503	V462-I499 HydrophobicContact CG1-CG1 4.29Å; M483-I499 HydrophobicContact CE-CG1 4.04Å; F487-I499 HydrophobicContact CD2-CB 4.08Å; F487-I499 HydrophobicContact CD2-CD1 4.21Å; F487-I499 HydrophobicContact CD2-CG2 3.75Å; F487-I499 HydrophobicContact CE2-CB 4.41Å; F487-I499 HydrophobicContact CE2-CG2 4.41Å; I490-I499 HydrophobicContact CD1-CD1 3.57Å; A495-I499 WeakPolarHBondContact O-CG1 3.38Å; A495-I499 PolarHBondContact O-N 3.33Å; R496-I499 PolarHBondContact O-N 3.34Å; I499-W501 VanDerWaalsContact C-N 3.28Å; I499-W501 PolarHBondContact O-N 3.44Å; I499-L502 PolarHBondContact O-N 3.01Å; I499-M503 WeakPolarHBondContact O-CB 3.35Å; I499-M503 PolarHBondContact O-N 3.3Å
500	L	88.8	Confident	82.7	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.8	-38.3	174.2	-65.9	171	0	0	0	111.6	F487 R496 G504 V517 M521 V532 Q535 T536 L539	F487-L500 HydrophobicContact CE2-CD1 4.5Å; F487-L500 HydrophobicContact CE2-CD2 4.12Å; F487-L500 HydrophobicContact CE2-CG 3.97Å; F487-L500 HydrophobicContact CZ-CD1 4.31Å; F487-L500 HydrophobicContact CZ-CD2 4.02Å; F487-L500 HydrophobicContact CZ-CG 4.12Å; R496-L500 WeakPolarHBondContact O-CG 3.17Å; R496-L500 PolarHBondContact O-N 2.99Å; L500-G504 PolarHBondContact O-N 3.24Å; L500-V517 HydrophobicContact CD2-CG1 3.86Å; L500-M521 HydrophobicContact CD1-CE 4.22Å; L500-M521 HydrophobicContact CD1-CG 4.18Å; L500-M521 HydrophobicContact CD1-SD 4.25Å; L500-M521 HydrophobicContact CD2-CG 3.8Å; L500-V532 HydrophobicContact CD1-CG1 3.65Å; L500-Q535 HydrophobicContact CB-CB 4.19Å; L500-T536 WeakPolarHBondContact CD1-OG1 3.44Å; L500-L539 HydrophobicContact CB-CD2 4.45Å; L500-L539 HydrophobicContact CD2-CD2 3.65Å
501	W	88.1	Confident	82.4	Confident	27 Å²	27	33.6 Å²	33.6	10%	0.102	17%	0.172	C	C	.	.	H	α-helix	trans	-64.4	-49.5	174.4	-178.5	81.8	0	0	0	112.4	K466 Q470 A497 S498 I499 M503 G504 E505	K466-W501 HydrophobicContact CD-CE3 3.92Å; K466-W501 HydrophobicContact CD-CZ3 4.27Å; K466-W501 VanDerWaalsContact CE-CE3 3.46Å; K466-W501 HydrophobicContact CG-CE3 3.94Å; K466-W501 HydrophobicContact CG-CZ3 3.87Å; Q470-W501 HydrophobicContact CG-CH2 3.84Å; Q470-W501 HydrophobicContact CG-CZ3 4Å; A497-W501 WeakPolarHBondContact O-CB 3.33Å; A497-W501 PolarHBondContact O-N 3.36Å; S498-W501 PolarHBondContact O-N 3.19Å; I499-W501 VanDerWaalsContact C-N 3.28Å; I499-W501 PolarHBondContact O-N 3.44Å; W501-M503 VanDerWaalsContact C-N 3.33Å; W501-M503 PolarHBondContact O-N 3.23Å; W501-G504 CarbonylContact O-C 3.56Å; W501-G504 WeakPolarHBondContact O-CA 3.33Å; W501-G504 PolarHBondContact O-N 2.94Å; W501-E505 HydrophobicContact CH2-CB 4.16Å; W501-E505 HydrophobicContact CH2-CG 3.97Å; W501-E505 HydrophobicContact CZ2-CB 4.2Å; W501-E505 HydrophobicContact CZ2-CG 4.01Å; W501-E505 WeakPolarHBondContact CZ2-OE2 3.46Å; W501-E505 HydrophobicContact CZ3-CB 4.49Å; W501-E505 PolarHBondContact O-N 3.28Å
502	L	82.9	Confident	82.3	Confident	4 Å²	4	37 Å²	37	2%	0.021	18%	0.178	C	C	.	.	H	α-helix	trans	-57.8	-44.9	178.1	-81.5	166.3	0	0	0	112	K466 L469 M483 S498 I499 G504 E505 Y506	K466-L502 HydrophobicContact CB-CD1 4.11Å; K466-L502 HydrophobicContact CB-CD2 4.45Å; K466-L502 HydrophobicContact CB-CG 4.37Å; K466-L502 HydrophobicContact CG-CD2 4.25Å; K466-L502 HydrophobicContact CG-CG 4.28Å; L469-L502 HydrophobicContact CB-CD2 4.04Å; L469-L502 HydrophobicContact CD1-CD1 3.86Å; L469-L502 HydrophobicContact CD1-CD2 3.86Å; L469-L502 HydrophobicContact CD1-CG 4.49Å; M483-L502 HydrophobicContact CE-CD1 4.09Å; M483-L502 HydrophobicContact SD-CD1 4.29Å; S498-L502 WeakPolarHBondContact O-CG 3.48Å; S498-L502 PolarHBondContact O-N 3.3Å; I499-L502 PolarHBondContact O-N 3.01Å; L502-G504 VanDerWaalsContact C-N 3.27Å; L502-G504 PolarHBondContact O-N 2.85Å; L502-E505 PolarHBondContact O-N 3.27Å; L502-Y506 HydrophobicContact CD2-CD2 4.44Å; L502-Y506 HydrophobicContact CD2-CE2 4.01Å; L502-Y506 WeakPolarHBondContact O-CD2 3.34Å; L502-Y506 PolarHBondContact O-N 2.84Å
503	M	84.3	Confident	82.2	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-71.7	-22.1	178.2	-174.3	153.4	46.8	0	0	113	A484 I499 W501 C507 A514 V517	A484-M503 HydrophobicContact CB-CE 4.34Å; A484-M503 HydrophobicContact CB-SD 4Å; I499-M503 WeakPolarHBondContact O-CB 3.35Å; I499-M503 PolarHBondContact O-N 3.3Å; W501-M503 VanDerWaalsContact C-N 3.33Å; W501-M503 PolarHBondContact O-N 3.23Å; M503-C507 VanDerWaalsContact O-CA 3.27Å; M503-C507 WeakPolarHBondContact O-CA 3.34Å; M503-C507 WeakPolarHBondContact O-CB 3.35Å; M503-C507 PolarHBondContact O-N 2.8Å; M503-A514 HydrophobicContact CG-CB 3.58Å; M503-A514 HydrophobicContact SD-CB 3.96Å; M503-V517 HydrophobicContact CE-CB 3.65Å; M503-V517 HydrophobicContact CE-CG1 3.63Å; M503-V517 HydrophobicContact CE-CG2 3.83Å; M503-V517 HydrophobicContact SD-CG2 4.47Å
504	G	83.1	Confident	82.1	Confident	3 Å²	3	36.8 Å²	36.8	3%	0.031	17%	0.174	C	C	.	.	H	α-helix	trans	-76.4	-41.6	168.9	0	0	0	0	0	113	L500 W501 L502 C507 K542	L500-G504 PolarHBondContact O-N 3.24Å; W501-G504 CarbonylContact O-C 3.56Å; W501-G504 WeakPolarHBondContact O-CA 3.33Å; W501-G504 PolarHBondContact O-N 2.94Å; L502-G504 VanDerWaalsContact C-N 3.27Å; L502-G504 PolarHBondContact O-N 2.85Å; G504-C507 PolarHBondContact O-SG 2.98Å; G504-K542 WeakPolarHBondContact O-CD 3.18Å; G504-K542 PolarHBondContact O-NZ 3.13Å
505	E	80.9	Confident	82.3	Confident	40 Å²	40	33 Å²	33	19%	0.187	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-43.3	173.4	-154.2	74.8	-179.7	0	0	111.3	W501 L502 K542	W501-E505 HydrophobicContact CH2-CB 4.16Å; W501-E505 HydrophobicContact CH2-CG 3.97Å; W501-E505 HydrophobicContact CZ2-CB 4.2Å; W501-E505 HydrophobicContact CZ2-CG 4.01Å; W501-E505 WeakPolarHBondContact CZ2-OE2 3.46Å; W501-E505 HydrophobicContact CZ3-CB 4.49Å; W501-E505 PolarHBondContact O-N 3.28Å; L502-E505 PolarHBondContact O-N 3.27Å; E505-K542 IonicContact OE2-NZ 2.73Å; E505-K542 PolarHBondContact OE2-NZ 2.74Å
506	Y	79.8	Confident	82.4	Confident	25 Å²	25	36.1 Å²	36.1	10%	0.098	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	27.6	-175.9	-55.2	-47.4	0	0	0	114.3	L469 P473 I480 L502 E508 R509 V510	L469-Y506 PolarHBondContact O-OH 2.91Å; P473-Y506 HydrophobicContact CB-CE1 4.3Å; I480-Y506 HydrophobicContact CD1-CD2 3.48Å; I480-Y506 VanDerWaalsContact CD1-CD2 3.48Å; I480-Y506 HydrophobicContact CD1-CE2 4.23Å; I480-Y506 HydrophobicContact CD1-CG 4.05Å; L502-Y506 HydrophobicContact CD2-CD2 4.44Å; L502-Y506 HydrophobicContact CD2-CE2 4.01Å; L502-Y506 WeakPolarHBondContact O-CD2 3.34Å; L502-Y506 PolarHBondContact O-N 2.84Å; Y506-E508 PolarHBondContact O-N 2.76Å; Y506-E508 VanDerWaalsContact O-N 3.16Å; Y506-R509 VanDerWaalsContact CG-NH2 3.31Å; Y506-R509 PolarHBondContact O-N 3.05Å; Y506-V510 PolarHBondContact O-N 3.02Å
507	C	76.3	Confident	82.5	Confident	4 Å²	4	34.8 Å²	34.8	3%	0.027	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-28.2	-174.8	61.6	0	0	0	0	114.1	M503 G504 R509 L543	M503-C507 VanDerWaalsContact O-CA 3.27Å; M503-C507 WeakPolarHBondContact O-CA 3.34Å; M503-C507 WeakPolarHBondContact O-CB 3.35Å; M503-C507 PolarHBondContact O-N 2.8Å; G504-C507 PolarHBondContact O-SG 2.98Å; C507-R509 VanDerWaalsContact C-N 3.27Å; C507-R509 PolarHBondContact O-N 2.81Å; C507-L543 HydrophobicContact CB-CD2 3.89Å
508	E	76.2	Confident	82.5	Confident	138 Å²	138	34.6 Å²	34.6	65%	0.645	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-27.7	176.3	-60.4	-170.6	155.3	0	0	112.7	Y506 T546	Y506-E508 PolarHBondContact O-N 2.76Å; Y506-E508 VanDerWaalsContact O-N 3.16Å; E508-T546 HydrophobicContact CG-CG2 3.96Å
509	R	75.1	Confident	82.8	Confident	93 Å²	93	39.8 Å²	39.8	35%	0.351	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-11.8	-176.3	-55.8	-168.3	-60.4	-147.5	15.2	113.6	P473 Y506 C507	P473-R509 PolarHBondContact O-NH1 2.92Å; P473-R509 PolarHBondContact O-NH2 2.96Å; Y506-R509 VanDerWaalsContact CG-NH2 3.31Å; Y506-R509 PolarHBondContact O-N 3.05Å; C507-R509 VanDerWaalsContact C-N 3.27Å; C507-R509 PolarHBondContact O-N 2.81Å
510	V	75.1	Confident	82.9	Confident	8 Å²	8	43.5 Å²	43.5	5%	0.048	20%	0.2	C	C	.	.			trans	-128	51.5	178	-155.7	0	0	0	0	111.9	I480 Y506 K512 I513 A514	I480-V510 HydrophobicContact CG2-CG2 3.94Å; Y506-V510 PolarHBondContact O-N 3.02Å; V510-K512 PolarHBondContact O-N 3.25Å; V510-K512 VanDerWaalsContact O-N 3.07Å; V510-I513 HydrophobicContact CG1-CB 3.67Å; V510-I513 HydrophobicContact CG1-CD1 3.73Å; V510-I513 HydrophobicContact CG1-CG1 3.72Å; V510-I513 PolarHBondContact O-N 3.2Å; V510-A514 PolarHBondContact O-N 3.44Å
511	P	74	Confident	82.9	Confident	67 Å²	67	43.6 Å²	43.6	44%	0.435	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-15.6	-166.4	28.5	-37.6	0	0	0	115	P515	P511-P515 WeakPolarHBondContact O-CD 3.41Å; P511-P515 WeakPolarHBondContact O-CG 3.42Å
512	K	79.1	Confident	83	Confident	175 Å²	175	42.6 Å²	42.6	76%	0.761	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-48.6	176.2	-65.2	-174.2	179.1	-178.2	0	112.8	V510 P515	V510-K512 PolarHBondContact O-N 3.25Å; V510-K512 VanDerWaalsContact O-N 3.07Å; K512-P515 WeakPolarHBondContact O-CD 3.16Å
513	I	83.1	Confident	83.3	Confident	51 Å²	51	50.9 Å²	50.9	26%	0.262	23%	0.233	S	C	.	.	H	α-helix	trans	-77.3	-33.9	-171.9	-42.7	177.9	0	0	0	111.7	K481 A484 V510 D516 V517	K481-I513 HydrophobicContact CB-CD1 4.26Å; K481-I513 HydrophobicContact CG-CD1 4.25Å; A484-I513 HydrophobicContact CB-CG2 3.86Å; V510-I513 HydrophobicContact CG1-CB 3.67Å; V510-I513 HydrophobicContact CG1-CD1 3.73Å; V510-I513 HydrophobicContact CG1-CG1 3.72Å; V510-I513 PolarHBondContact O-N 3.2Å; I513-D516 WeakPolarHBondContact O-CB 3.24Å; I513-D516 PolarHBondContact O-N 2.95Å; I513-V517 HydrophobicContact CG2-CG2 4.24Å; I513-V517 PolarHBondContact O-N 3.35Å
514	A	83.5	Confident	83.5	Confident	0 Å²	0	53 Å²	53	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.7	-42.3	-178.1	0	0	0	0	0	113.5	M503 V510 D516 L518 L543	M503-A514 HydrophobicContact CG-CB 3.58Å; M503-A514 HydrophobicContact SD-CB 3.96Å; V510-A514 PolarHBondContact O-N 3.44Å; A514-D516 VanDerWaalsContact C-N 3.33Å; A514-D516 PolarHBondContact O-N 2.81Å; A514-L518 WeakPolarHBondContact O-CB 3.26Å; A514-L518 PolarHBondContact O-N 2.91Å; A514-L543 HydrophobicContact CB-CD1 4.14Å; A514-L543 HydrophobicContact CB-CD2 3.85Å
515	P	87	Confident	83.8	Confident	6 Å²	6	53 Å²	53	4%	0.039	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-34.2	167.2	-27.4	35.6	0	0	0	114.9	P511 K512 R519 T551	P511-P515 WeakPolarHBondContact O-CD 3.41Å; P511-P515 WeakPolarHBondContact O-CG 3.42Å; K512-P515 WeakPolarHBondContact O-CD 3.16Å; P515-R519 PolarHBondContact O-N 3.31Å; P515-T551 HydrophobicContact CB-CG2 4.04Å; P515-T551 HydrophobicContact CG-CG2 3.94Å
516	D	87.6	Confident	84.2	Confident	64 Å²	64	56.1 Å²	56.1	34%	0.342	27%	0.268	S	S	.	.	H	α-helix	trans	-70.2	-42.5	179.4	-69.8	-32.4	0	0	0	112	I513 A514 R519 K520	I513-D516 WeakPolarHBondContact O-CB 3.24Å; I513-D516 PolarHBondContact O-N 2.95Å; A514-D516 VanDerWaalsContact C-N 3.33Å; A514-D516 PolarHBondContact O-N 2.81Å; D516-R519 WeakPolarHBondContact O-CB 3.4Å; D516-R519 PolarHBondContact O-N 3.14Å; D516-R519 IonicContact OD1-CZ 2.72Å; D516-R519 IonicContact OD1-NH1 2.86Å; D516-R519 PolarHBondContact OD1-NH1 3.36Å; D516-R519 IonicContact OD1-NH2 3.02Å; D516-R519 PolarHBondContact OD1-NH2 2.72Å; D516-K520 PolarHBondContact O-N 3.27Å; D516-K520 VanDerWaalsContact O-N 3.13Å
517	V	87.8	Confident	84.6	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-70.2	-35.9	174.7	177.3	0	0	0	0	111	F487 L500 M503 I513 R519 K520 M521	F487-V517 HydrophobicContact CD1-CG1 3.94Å; F487-V517 HydrophobicContact CE1-CG1 3.99Å; F487-V517 HydrophobicContact CG-CG1 4.34Å; F487-V517 HydrophobicContact CZ-CG1 4.41Å; L500-V517 HydrophobicContact CD2-CG1 3.86Å; M503-V517 HydrophobicContact CE-CB 3.65Å; M503-V517 HydrophobicContact CE-CG1 3.63Å; M503-V517 HydrophobicContact CE-CG2 3.83Å; M503-V517 HydrophobicContact SD-CG2 4.47Å; I513-V517 HydrophobicContact CG2-CG2 4.24Å; I513-V517 PolarHBondContact O-N 3.35Å; V517-R519 VanDerWaalsContact C-N 3.26Å; V517-R519 PolarHBondContact O-N 3.04Å; V517-K520 WeakPolarHBondContact O-CB 3.1Å; V517-K520 PolarHBondContact O-N 3.43Å; V517-K520 VanDerWaalsContact O-N 3.13Å; V517-M521 HydrophobicContact CG1-CG 4.47Å; V517-M521 WeakPolarHBondContact O-CG 3.45Å; V517-M521 PolarHBondContact O-N 2.95Å
518	L	89.6	Confident	85.2	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-37.9	170.5	-171.3	71.2	0	0	0	111.8	A514 M521 A522 T536 L539 A540 L543 L554 I558	A514-L518 WeakPolarHBondContact O-CB 3.26Å; A514-L518 PolarHBondContact O-N 2.91Å; L518-M521 PolarHBondContact O-N 2.96Å; L518-A522 WeakPolarHBondContact O-CB 3.19Å; L518-A522 PolarHBondContact O-N 2.94Å; L518-T536 HydrophobicContact CD1-CG2 4.35Å; L518-L539 HydrophobicContact CD1-CD2 4.27Å; L518-L539 HydrophobicContact CD1-CG 4.25Å; L518-A540 HydrophobicContact CD1-CB 3.92Å; L518-A540 HydrophobicContact CD2-CB 4.38Å; L518-L543 HydrophobicContact CB-CD1 4.1Å; L518-L543 HydrophobicContact CD2-CD1 3.94Å; L518-L543 HydrophobicContact CG-CD1 4.46Å; L518-L554 HydrophobicContact CD2-CB 4.09Å; L518-I558 HydrophobicContact CD1-CD1 3.55Å; L518-I558 HydrophobicContact CD2-CD1 4.49Å; L518-I558 HydrophobicContact CG-CD1 3.91Å
519	R	90.5	Very high	85.9	Confident	122 Å²	122	59.6 Å²	59.6	46%	0.46	30%	0.295	S	S	.	.	H	α-helix	trans	-65.9	-34.9	175.2	-166.6	-167	-52.9	106.6	8.2	112.6	P515 D516 V517 L554	P515-R519 PolarHBondContact O-N 3.31Å; D516-R519 WeakPolarHBondContact O-CB 3.4Å; D516-R519 PolarHBondContact O-N 3.14Å; D516-R519 IonicContact OD1-CZ 2.72Å; D516-R519 IonicContact OD1-NH1 2.86Å; D516-R519 PolarHBondContact OD1-NH1 3.36Å; D516-R519 IonicContact OD1-NH2 3.02Å; D516-R519 PolarHBondContact OD1-NH2 2.72Å; V517-R519 VanDerWaalsContact C-N 3.26Å; V517-R519 PolarHBondContact O-N 3.04Å; R519-L554 HydrophobicContact CB-CD1 4.24Å; R519-L554 HydrophobicContact CB-CD2 4.38Å; R519-L554 HydrophobicContact CG-CD2 4.19Å
520	K	88.3	Confident	86.7	Confident	83 Å²	83	57.5 Å²	57.5	36%	0.361	29%	0.291	S	S	.	.	H	α-helix	trans	-66.9	-52.5	172.7	-68.5	176.4	175.5	179.3	0	110.7	D488 D516 V517 A522 K523 T524	D488-K520 WeakPolarHBondContact OD1-CD 3.36Å; D488-K520 WeakPolarHBondContact OD1-CE 3.4Å; D488-K520 IonicContact OD1-NZ 2.69Å; D488-K520 PolarHBondContact OD1-NZ 3.48Å; D488-K520 IonicContact OD2-NZ 2.72Å; D488-K520 PolarHBondContact OD2-NZ 3.43Å; D516-K520 PolarHBondContact O-N 3.27Å; D516-K520 VanDerWaalsContact O-N 3.13Å; V517-K520 WeakPolarHBondContact O-CB 3.1Å; V517-K520 PolarHBondContact O-N 3.43Å; V517-K520 VanDerWaalsContact O-N 3.13Å; K520-A522 VanDerWaalsContact C-N 3.25Å; K520-A522 PolarHBondContact O-N 3.48Å; K520-K523 WeakPolarHBondContact O-CB 3.3Å; K520-K523 PolarHBondContact O-N 2.72Å; K520-T524 PolarHBondContact O-N 3.37Å
521	M	89.2	Confident	87.5	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-32.5	178.8	-67.8	-50.4	-53.5	0	0	113.5	F487 L500 V517 L518 K523 T524 F525 E528 V532 T536	F487-M521 HydrophobicContact CE1-CG 4.35Å; F487-M521 HydrophobicContact CE1-SD 3.54Å; F487-M521 VanDerWaalsContact CE1-SD 3.54Å; F487-M521 HydrophobicContact CZ-CG 4.31Å; F487-M521 HydrophobicContact CZ-SD 3.44Å; F487-M521 WeakPolarHBondContact CZ-SD 3.33Å; L500-M521 HydrophobicContact CD1-CE 4.22Å; L500-M521 HydrophobicContact CD1-CG 4.18Å; L500-M521 HydrophobicContact CD1-SD 4.25Å; L500-M521 HydrophobicContact CD2-CG 3.8Å; V517-M521 HydrophobicContact CG1-CG 4.47Å; V517-M521 WeakPolarHBondContact O-CG 3.45Å; V517-M521 PolarHBondContact O-N 2.95Å; L518-M521 PolarHBondContact O-N 2.96Å; M521-K523 PolarHBondContact O-N 3.37Å; M521-T524 PolarHBondContact O-N 2.87Å; M521-F525 WeakPolarHBondContact O-CA 3.11Å; M521-F525 WeakPolarHBondContact O-CB 3.11Å; M521-F525 PolarHBondContact O-N 3.43Å; M521-E528 HydrophobicContact CE-CB 4.5Å; M521-E528 VanDerWaalsContact CE-CD 3.43Å; M521-E528 HydrophobicContact CE-CG 3.81Å; M521-E528 WeakPolarHBondContact CE-OE1 3.28Å; M521-V532 HydrophobicContact CE-CG1 3.61Å; M521-T536 HydrophobicContact CB-CG2 3.74Å; M521-T536 HydrophobicContact CG-CG2 4.49Å
522	A	89.3	Confident	88.3	Confident	7 Å²	7	58.6 Å²	58.6	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-27.9	173.1	0	0	0	0	0	113.1	L518 K520 L554 Y557 I558	L518-A522 WeakPolarHBondContact O-CB 3.19Å; L518-A522 PolarHBondContact O-N 2.94Å; K520-A522 VanDerWaalsContact C-N 3.25Å; K520-A522 PolarHBondContact O-N 3.48Å; A522-L554 HydrophobicContact CB-CD2 4.31Å; A522-Y557 HydrophobicContact CB-CD1 4.23Å; A522-Y557 HydrophobicContact CB-CE1 4.44Å; A522-Y557 WeakPolarHBondContact O-CE1 3.49Å; A522-I558 HydrophobicContact CB-CD1 4.14Å; A522-I558 HydrophobicContact CB-CG1 4.1Å
523	K	90.2	Very high	89	Confident	177 Å²	177	51.2 Å²	51.2	77%	0.77	26%	0.26	S	S	*	.	H	α-helix	trans	-80.3	-39.7	176.3	-64.2	-174.7	176.1	-171	0	112.7	K520 M521	K520-K523 WeakPolarHBondContact O-CB 3.3Å; K520-K523 PolarHBondContact O-N 2.72Å; M521-K523 PolarHBondContact O-N 3.37Å
524	T	88.1	Confident	89.4	Confident	48 Å²	48	50.7 Å²	50.7	29%	0.294	26%	0.257	S	S	.	.	H	α-helix	trans	-92.7	-5.2	-175.7	55.7	0	0	0	0	114.1	K520 M521 T526 S527 E528	K520-T524 PolarHBondContact O-N 3.37Å; M521-T524 PolarHBondContact O-N 2.87Å; T524-T526 PolarHBondContact O-N 3.46Å; T524-S527 PolarHBondContact O-N 3.27Å; T524-S527 PolarHBondContact O-OG 3.06Å; T524-E528 VanDerWaalsContact CB-OE1 3.24Å; T524-E528 WeakPolarHBondContact CB-OE1 3.34Å; T524-E528 WeakPolarHBondContact O-CG 3.48Å; T524-E528 PolarHBondContact O-N 3.43Å; T524-E528 PolarHBondContact OG1-OE1 3.38Å
525	F	89.9	Confident	89.7	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.009	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-46	-36.3	-171.9	-172.7	-94.2	0	0	0	115.7	M521 K533 T536 V537 I558 L561	M521-F525 WeakPolarHBondContact O-CA 3.11Å; M521-F525 WeakPolarHBondContact O-CB 3.11Å; M521-F525 PolarHBondContact O-N 3.43Å; F525-K533 HydrophobicContact CE2-CB 3.87Å; F525-K533 HydrophobicContact CE2-CG 4.2Å; F525-K533 HydrophobicContact CZ-CB 3.98Å; F525-K533 HydrophobicContact CZ-CG 4.23Å; F525-T536 HydrophobicContact CD2-CG2 4Å; F525-T536 HydrophobicContact CE2-CG2 4.3Å; F525-V537 HydrophobicContact CE2-CG2 4.05Å; F525-V537 HydrophobicContact CZ-CG2 4.14Å; F525-I558 HydrophobicContact CD2-CG2 4.17Å; F525-I558 HydrophobicContact CE2-CG2 3.92Å; F525-I558 HydrophobicContact CZ-CG2 4.44Å; F525-L561 HydrophobicContact CB-CD1 4.08Å; F525-L561 HydrophobicContact CD1-CB 3.83Å; F525-L561 HydrophobicContact CD1-CD1 3.97Å; F525-L561 HydrophobicContact CE1-CB 4.01Å; F525-L561 HydrophobicContact CG-CD1 4.27Å
526	T	88.5	Confident	89.9	Confident	105 Å²	105	52.2 Å²	52.2	64%	0.644	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-81.1	-14.3	-179.2	50.3	0	0	0	0	114.7	T524	T524-T526 PolarHBondContact O-N 3.46Å
527	S	89.2	Confident	90.1	Very high	99 Å²	99	49.2 Å²	49.2	69%	0.692	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-113.8	12	-178.8	65.1	0	0	0	0	113.2	T524	T524-S527 PolarHBondContact O-N 3.27Å; T524-S527 PolarHBondContact O-OG 3.06Å
528	E	89.1	Confident	90.2	Very high	27 Å²	27	50.7 Å²	50.7	13%	0.126	26%	0.256	C	S	.	.	S	Bend	trans	-106.8	155.7	-179.3	-61.3	-104.5	-170.4	0	0	110.2	R496 M521 T524 V532 K533	R496-E528 IonicContact CZ-OE1 3.68Å; R496-E528 IonicContact CZ-OE2 2.71Å; R496-E528 IonicContact NE-OE1 2.8Å; R496-E528 IonicContact NE-OE2 3.48Å; R496-E528 PolarHBondContact NE-OE2 3.32Å; R496-E528 IonicContact NH2-OE1 3.17Å; R496-E528 PolarHBondContact NH2-OE1 2.89Å; R496-E528 IonicContact NH2-OE2 3.89Å; R496-E528 PolarHBondContact NH2-OE2 3.32Å; M521-E528 HydrophobicContact CE-CB 4.5Å; M521-E528 VanDerWaalsContact CE-CD 3.43Å; M521-E528 HydrophobicContact CE-CG 3.81Å; M521-E528 WeakPolarHBondContact CE-OE1 3.28Å; T524-E528 VanDerWaalsContact CB-OE1 3.24Å; T524-E528 WeakPolarHBondContact CB-OE1 3.34Å; T524-E528 WeakPolarHBondContact O-CG 3.48Å; T524-E528 PolarHBondContact O-N 3.43Å; T524-E528 PolarHBondContact OG1-OE1 3.38Å; E528-V532 HydrophobicContact CB-CB 4.29Å; E528-V532 HydrophobicContact CB-CG1 4.42Å; E528-K533 WeakPolarHBondContact O-CE 3.14Å
529	E	90.4	Very high	90.2	Very high	114 Å²	114	50.8 Å²	50.8	53%	0.533	26%	0.256	S	S	.	.			trans	-65.9	153	178.1	-79.7	-59.1	153.8	0	0	113.8	P493 I531 V532 K533	P493-E529 HydrophobicContact CB-CB 3.82Å; P493-E529 HydrophobicContact CB-CG 3.89Å; P493-E529 HydrophobicContact CG-CB 4.07Å; P493-E529 HydrophobicContact CG-CG 3.59Å; E529-I531 VanDerWaalsContact C-N 3.26Å; E529-I531 PolarHBondContact O-N 3.2Å; E529-I531 VanDerWaalsContact O-N 3.16Å; E529-V532 HydrophobicContact CB-CG2 4.24Å; E529-V532 WeakPolarHBondContact O-CA 3.24Å; E529-V532 WeakPolarHBondContact O-CB 3.5Å; E529-V532 PolarHBondContact O-N 2.7Å; E529-K533 PolarHBondContact O-N 2.93Å
530	D	91.9	Very high	90.2	Very high	50 Å²	50	45 Å²	45	27%	0.267	23%	0.234	S	C	.	.	H	α-helix	trans	-59.5	-34.5	-172.6	-77.9	-15.6	0	0	0	113.6	V532 K533 L534 N567 I570	D530-V532 VanDerWaalsContact C-N 3.28Å; D530-V532 PolarHBondContact O-N 3.16Å; D530-K533 PolarHBondContact O-N 3.12Å; D530-K533 WeakPolarHBondContact OD1-CD 3.4Å; D530-K533 WeakPolarHBondContact OD1-CE 3.31Å; D530-K533 IonicContact OD1-NZ 2.7Å; D530-K533 PolarHBondContact OD1-NZ 2.86Å; D530-L534 WeakPolarHBondContact O-CB 3.34Å; D530-L534 PolarHBondContact O-N 2.71Å; D530-N567 WeakPolarHBondContact OD2-CB 3.43Å; D530-N567 PolarHBondContact OD2-ND2 3.31Å; D530-I570 HydrophobicContact CB-CD1 3.57Å; D530-I570 VanDerWaalsContact CG-CD1 3.49Å; D530-I570 VanDerWaalsContact OD1-CD1 3.26Å; D530-I570 WeakPolarHBondContact OD1-CD1 3.42Å
531	I	90.4	Very high	90.2	Very high	96 Å²	96	41 Å²	41	49%	0.492	22%	0.218	S	C	.	.	H	α-helix	trans	-63	-37.2	174.7	-49.2	178.8	0	0	0	110.7	A497 E529 Q535	A497-I531 HydrophobicContact CB-CB 4.49Å; A497-I531 HydrophobicContact CB-CG2 3.77Å; E529-I531 VanDerWaalsContact C-N 3.26Å; E529-I531 PolarHBondContact O-N 3.2Å; E529-I531 VanDerWaalsContact O-N 3.16Å; I531-Q535 WeakPolarHBondContact O-CG 3.47Å; I531-Q535 PolarHBondContact O-N 3.48Å
532	V	92.1	Very high	90.1	Very high	1 Å²	1	42 Å²	42	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-75.3	-42.6	178.9	-168.6	0	0	0	0	110.6	P493 R496 A497 L500 M521 E528 E529 D530 L534 Q535 T536	P493-V532 HydrophobicContact CB-CG2 4Å; P493-V532 WeakPolarHBondContact O-CG2 3.09Å; R496-V532 HydrophobicContact CB-CG1 4.1Å; R496-V532 HydrophobicContact CB-CG2 4.07Å; A497-V532 HydrophobicContact CB-CG2 4.27Å; L500-V532 HydrophobicContact CD1-CG1 3.65Å; M521-V532 HydrophobicContact CE-CG1 3.61Å; E528-V532 HydrophobicContact CB-CB 4.29Å; E528-V532 HydrophobicContact CB-CG1 4.42Å; E529-V532 HydrophobicContact CB-CG2 4.24Å; E529-V532 WeakPolarHBondContact O-CA 3.24Å; E529-V532 WeakPolarHBondContact O-CB 3.5Å; E529-V532 PolarHBondContact O-N 2.7Å; D530-V532 VanDerWaalsContact C-N 3.28Å; D530-V532 PolarHBondContact O-N 3.16Å; V532-L534 VanDerWaalsContact C-N 3.34Å; V532-L534 PolarHBondContact O-N 2.78Å; V532-Q535 PolarHBondContact O-N 2.95Å; V532-T536 WeakPolarHBondContact O-CB 3.29Å; V532-T536 PolarHBondContact O-N 3.4Å; V532-T536 PolarHBondContact O-OG1 3.2Å
533	K	92.8	Very high	90	Very high	21 Å²	21	41.8 Å²	41.8	9%	0.091	22%	0.22	C	C	.	.	H	α-helix	trans	-55.4	-48.9	172.4	-63.8	177.3	-169.8	167	0	111.1	F525 E528 E529 D530 Q535 T536 V537 D565 I570	F525-K533 HydrophobicContact CE2-CB 3.87Å; F525-K533 HydrophobicContact CE2-CG 4.2Å; F525-K533 HydrophobicContact CZ-CB 3.98Å; F525-K533 HydrophobicContact CZ-CG 4.23Å; E528-K533 WeakPolarHBondContact O-CE 3.14Å; E529-K533 PolarHBondContact O-N 2.93Å; D530-K533 PolarHBondContact O-N 3.12Å; D530-K533 WeakPolarHBondContact OD1-CD 3.4Å; D530-K533 WeakPolarHBondContact OD1-CE 3.31Å; D530-K533 IonicContact OD1-NZ 2.7Å; D530-K533 PolarHBondContact OD1-NZ 2.86Å; K533-Q535 PolarHBondContact O-N 3.09Å; K533-T536 WeakPolarHBondContact O-CA 3.48Å; K533-T536 WeakPolarHBondContact O-CB 3.42Å; K533-T536 PolarHBondContact O-N 2.67Å; K533-T536 VanDerWaalsContact O-N 3.09Å; K533-V537 WeakPolarHBondContact O-CG2 3.49Å; K533-V537 PolarHBondContact O-N 2.94Å; K533-D565 VanDerWaalsContact CD-OD2 3.31Å; K533-D565 WeakPolarHBondContact CD-OD2 3.41Å; K533-D565 VanDerWaalsContact CE-OD2 3.29Å; K533-D565 WeakPolarHBondContact CE-OD2 3.3Å; K533-D565 VanDerWaalsContact NZ-CG 3.32Å; K533-D565 IonicContact NZ-OD1 3.2Å; K533-D565 PolarHBondContact NZ-OD1 3.48Å; K533-D565 IonicContact NZ-OD2 2.86Å; K533-D565 PolarHBondContact NZ-OD2 2.92Å; K533-I570 HydrophobicContact CB-CD1 3.9Å; K533-I570 HydrophobicContact CD-CD1 3.73Å; K533-I570 HydrophobicContact CG-CD1 4.49Å
534	L	91.3	Very high	89.8	Confident	39 Å²	39	34.4 Å²	34.4	20%	0.204	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-44.2	-179.4	-177.8	62.9	0	0	0	112.2	D530 V532 V537 N538 R573	D530-L534 WeakPolarHBondContact O-CB 3.34Å; D530-L534 PolarHBondContact O-N 2.71Å; V532-L534 VanDerWaalsContact C-N 3.34Å; V532-L534 PolarHBondContact O-N 2.78Å; L534-V537 PolarHBondContact O-N 2.88Å; L534-N538 PolarHBondContact O-N 3.02Å; L534-N538 VanDerWaalsContact O-N 3.11Å; L534-N538 PolarHBondContact O-ND2 3.07Å; L534-R573 HydrophobicContact CD1-CB 4.26Å; L534-R573 HydrophobicContact CD1-CG 3.75Å
535	Q	91.1	Very high	89.6	Confident	38 Å²	38	33.4 Å²	33.4	18%	0.178	18%	0.18	C	C	.	.	H	α-helix	trans	-72.6	-27.7	175.1	-58.1	-50.6	-25.5	0	0	113.1	A497 L500 I531 V532 K533 N538 L539	A497-Q535 HydrophobicContact CB-CB 4.42Å; A497-Q535 HydrophobicContact CB-CG 3.94Å; L500-Q535 HydrophobicContact CB-CB 4.19Å; I531-Q535 WeakPolarHBondContact O-CG 3.47Å; I531-Q535 PolarHBondContact O-N 3.48Å; V532-Q535 PolarHBondContact O-N 2.95Å; K533-Q535 PolarHBondContact O-N 3.09Å; Q535-N538 PolarHBondContact O-N 3.45Å; Q535-N538 PolarHBondContact OE1-ND2 3.48Å; Q535-L539 WeakPolarHBondContact O-CB 3.18Å; Q535-L539 PolarHBondContact O-N 3Å
536	T	91.8	Very high	89.2	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-42.6	171.6	-58.1	0	0	0	0	111.5	L500 L518 M521 F525 V532 K533 L539 A540 I558	L500-T536 WeakPolarHBondContact CD1-OG1 3.44Å; L518-T536 HydrophobicContact CD1-CG2 4.35Å; M521-T536 HydrophobicContact CB-CG2 3.74Å; M521-T536 HydrophobicContact CG-CG2 4.49Å; F525-T536 HydrophobicContact CD2-CG2 4Å; F525-T536 HydrophobicContact CE2-CG2 4.3Å; V532-T536 WeakPolarHBondContact O-CB 3.29Å; V532-T536 PolarHBondContact O-N 3.4Å; V532-T536 PolarHBondContact O-OG1 3.2Å; K533-T536 WeakPolarHBondContact O-CA 3.48Å; K533-T536 WeakPolarHBondContact O-CB 3.42Å; K533-T536 PolarHBondContact O-N 2.67Å; K533-T536 VanDerWaalsContact O-N 3.09Å; T536-L539 PolarHBondContact O-N 2.99Å; T536-A540 WeakPolarHBondContact O-CB 3.27Å; T536-A540 PolarHBondContact O-N 2.99Å; T536-I558 HydrophobicContact CG2-CD1 4.15Å; T536-I558 HydrophobicContact CG2-CG2 4.39Å
537	V	91.5	Very high	88.8	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.012	17%	0.171	C	C	.	.	H	α-helix	trans	-65.6	-40.7	174.4	-179.2	0	0	0	0	111.2	F525 K533 L534 A540 A541 I558 L559 I577	F525-V537 HydrophobicContact CE2-CG2 4.05Å; F525-V537 HydrophobicContact CZ-CG2 4.14Å; K533-V537 WeakPolarHBondContact O-CG2 3.49Å; K533-V537 PolarHBondContact O-N 2.94Å; L534-V537 PolarHBondContact O-N 2.88Å; V537-A540 PolarHBondContact O-N 3.11Å; V537-A541 VanDerWaalsContact O-CB 3.28Å; V537-A541 WeakPolarHBondContact O-CB 3.24Å; V537-A541 PolarHBondContact O-N 3.25Å; V537-I558 HydrophobicContact CG2-CG2 4.12Å; V537-L559 HydrophobicContact CG1-CD2 3.98Å; V537-I577 HydrophobicContact CG1-CB 4.49Å; V537-I577 HydrophobicContact CG1-CD1 3.75Å; V537-I577 HydrophobicContact CG1-CG2 4.27Å
538	N	89.9	Confident	88.2	Confident	32 Å²	32	29.8 Å²	29.8	17%	0.171	15%	0.154	C	C	.	.	H	α-helix	trans	-62.9	-40.1	173.8	-69.5	-34	0	0	0	112.5	L534 Q535 A541 K542	L534-N538 PolarHBondContact O-N 3.02Å; L534-N538 VanDerWaalsContact O-N 3.11Å; L534-N538 PolarHBondContact O-ND2 3.07Å; Q535-N538 PolarHBondContact O-N 3.45Å; Q535-N538 PolarHBondContact OE1-ND2 3.48Å; N538-A541 WeakPolarHBondContact O-CB 3.42Å; N538-A541 PolarHBondContact O-N 2.94Å; N538-K542 WeakPolarHBondContact O-CG 3.42Å; N538-K542 PolarHBondContact O-N 3.04Å; N538-K542 VanDerWaalsContact O-N 3.09Å
539	L	89.6	Confident	87.7	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-46.3	176.4	177	62.4	0	0	0	111.2	L500 L518 Q535 T536 A541 K542 L543	L500-L539 HydrophobicContact CB-CD2 4.45Å; L500-L539 HydrophobicContact CD2-CD2 3.65Å; L518-L539 HydrophobicContact CD1-CD2 4.27Å; L518-L539 HydrophobicContact CD1-CG 4.25Å; Q535-L539 WeakPolarHBondContact O-CB 3.18Å; Q535-L539 PolarHBondContact O-N 3Å; T536-L539 PolarHBondContact O-N 2.99Å; L539-A541 VanDerWaalsContact C-N 3.31Å; L539-A541 PolarHBondContact O-N 3.43Å; L539-K542 PolarHBondContact O-N 3.07Å; L539-L543 HydrophobicContact CD1-CD1 3.74Å; L539-L543 HydrophobicContact CD1-CG 4.03Å; L539-L543 HydrophobicContact CG-CD1 3.83Å; L539-L543 HydrophobicContact CG-CG 4.48Å; L539-L543 WeakPolarHBondContact O-CB 3.48Å; L539-L543 WeakPolarHBondContact O-CG 3.4Å; L539-L543 PolarHBondContact O-N 2.92Å
540	A	89.7	Confident	87.2	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.2	-43.8	175.4	0	0	0	0	0	111.7	L518 T536 V537 L543 Y544 T555 I558	L518-A540 HydrophobicContact CD1-CB 3.92Å; L518-A540 HydrophobicContact CD2-CB 4.38Å; T536-A540 WeakPolarHBondContact O-CB 3.27Å; T536-A540 PolarHBondContact O-N 2.99Å; V537-A540 PolarHBondContact O-N 3.11Å; A540-L543 PolarHBondContact O-N 2.8Å; A540-Y544 WeakPolarHBondContact O-CB 2.98Å; A540-Y544 PolarHBondContact O-N 3.11Å; A540-T555 HydrophobicContact CB-CG2 3.93Å; A540-T555 PolarHBondContact O-OG1 2.94Å; A540-I558 HydrophobicContact CB-CD1 4.26Å
541	A	88.6	Confident	86.8	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.008	18%	0.182	C	C	.	.	H	α-helix	trans	-58.8	-49.3	176.9	0	0	0	0	0	112.9	V537 N538 L539 I577 I581 L598	V537-A541 VanDerWaalsContact O-CB 3.28Å; V537-A541 WeakPolarHBondContact O-CB 3.24Å; V537-A541 PolarHBondContact O-N 3.25Å; N538-A541 WeakPolarHBondContact O-CB 3.42Å; N538-A541 PolarHBondContact O-N 2.94Å; L539-A541 VanDerWaalsContact C-N 3.31Å; L539-A541 PolarHBondContact O-N 3.43Å; A541-I577 HydrophobicContact CB-CG2 3.72Å; A541-I581 HydrophobicContact CB-CD1 3.45Å; A541-I581 VanDerWaalsContact CB-CD1 3.45Å; A541-L598 HydrophobicContact CB-CD1 4.34Å
542	K	87.6	Confident	86.5	Confident	22 Å²	22	37 Å²	37	10%	0.096	18%	0.179	C	C	.	.	H	α-helix	trans	-68.1	-43.2	178.6	-69.2	-171.9	179.9	-161.7	0	112.3	G504 E505 N538 L539 Y544 L545 T546 L598 L599	G504-K542 WeakPolarHBondContact O-CD 3.18Å; G504-K542 PolarHBondContact O-NZ 3.13Å; E505-K542 IonicContact OE2-NZ 2.73Å; E505-K542 PolarHBondContact OE2-NZ 2.74Å; N538-K542 WeakPolarHBondContact O-CG 3.42Å; N538-K542 PolarHBondContact O-N 3.04Å; N538-K542 VanDerWaalsContact O-N 3.09Å; L539-K542 PolarHBondContact O-N 3.07Å; K542-Y544 VanDerWaalsContact C-N 3.32Å; K542-Y544 PolarHBondContact O-N 3.28Å; K542-L545 PolarHBondContact O-N 3.16Å; K542-L545 VanDerWaalsContact O-N 3.07Å; K542-T546 PolarHBondContact O-N 2.83Å; K542-T546 VanDerWaalsContact O-N 3.12Å; K542-T546 PolarHBondContact O-OG1 3.03Å; K542-L598 VanDerWaalsContact CE-O 3.24Å; K542-L598 WeakPolarHBondContact CE-O 3.35Å; K542-L599 HydrophobicContact CB-CD2 4.23Å; K542-L599 HydrophobicContact CD-CD2 4.1Å; K542-L599 HydrophobicContact CG-CD2 4.01Å
543	L	86.4	Confident	86.3	Confident	2 Å²	2	43.6 Å²	43.6	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-33.1	179.2	-78.3	174.2	0	0	0	113.2	C507 A514 L518 L539 A540 L545 T546 N547 T551	C507-L543 HydrophobicContact CB-CD2 3.89Å; A514-L543 HydrophobicContact CB-CD1 4.14Å; A514-L543 HydrophobicContact CB-CD2 3.85Å; L518-L543 HydrophobicContact CB-CD1 4.1Å; L518-L543 HydrophobicContact CD2-CD1 3.94Å; L518-L543 HydrophobicContact CG-CD1 4.46Å; L539-L543 HydrophobicContact CD1-CD1 3.74Å; L539-L543 HydrophobicContact CD1-CG 4.03Å; L539-L543 HydrophobicContact CG-CD1 3.83Å; L539-L543 HydrophobicContact CG-CG 4.48Å; L539-L543 WeakPolarHBondContact O-CB 3.48Å; L539-L543 WeakPolarHBondContact O-CG 3.4Å; L539-L543 PolarHBondContact O-N 2.92Å; A540-L543 PolarHBondContact O-N 2.8Å; L543-L545 PolarHBondContact O-N 3.31Å; L543-T546 PolarHBondContact O-N 3.39Å; L543-N547 CarbonylContact O-C 3.56Å; L543-N547 VanDerWaalsContact O-C 3.24Å; L543-N547 WeakPolarHBondContact O-CA 3.45Å; L543-N547 PolarHBondContact O-N 3.03Å; L543-T551 HydrophobicContact CB-CG2 4.12Å; L543-T551 PolarHBondContact O-OG1 2.94Å; L543-T551 VanDerWaalsContact O-OG1 3.09Å
544	Y	86.1	Confident	86.1	Confident	22 Å²	22	44.4 Å²	44.4	9%	0.086	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-35.9	172.2	-171	-77	0	0	0	112.2	A540 K542 S548 K552 T555 I581	A540-Y544 WeakPolarHBondContact O-CB 2.98Å; A540-Y544 PolarHBondContact O-N 3.11Å; K542-Y544 VanDerWaalsContact C-N 3.32Å; K542-Y544 PolarHBondContact O-N 3.28Å; Y544-S548 VanDerWaalsContact O-CA 3.29Å; Y544-S548 WeakPolarHBondContact O-CA 3.35Å; Y544-S548 WeakPolarHBondContact O-CB 3.05Å; Y544-S548 PolarHBondContact O-N 3.13Å; Y544-S548 PolarHBondContact O-OG 3.01Å; Y544-K552 HydrophobicContact CD2-CB 4.49Å; Y544-K552 HydrophobicContact CE2-CB 4.16Å; Y544-K552 HydrophobicContact CE2-CG 3.91Å; Y544-T555 HydrophobicContact CD2-CG2 3.9Å; Y544-T555 HydrophobicContact CG-CG2 4.48Å; Y544-I581 HydrophobicContact CD1-CG2 3.23Å; Y544-I581 HydrophobicContact CD2-CG2 4.22Å; Y544-I581 HydrophobicContact CE1-CG2 3.53Å; Y544-I581 HydrophobicContact CE2-CG2 4.43Å; Y544-I581 HydrophobicContact CG-CG2 3.62Å
545	L	83.6	Confident	85.9	Confident	27 Å²	27	42.5 Å²	42.5	14%	0.141	21%	0.209	C	C	.	.	H	α-helix	trans	-81.3	-30.3	-178.2	-65.5	169.6	0	0	0	112.9	K542 L543 R595 L598	K542-L545 PolarHBondContact O-N 3.16Å; K542-L545 VanDerWaalsContact O-N 3.07Å; L543-L545 PolarHBondContact O-N 3.31Å; L545-R595 PolarHBondContact O-NH1 3.05Å; L545-R595 PolarHBondContact O-NH2 3.02Å; L545-L598 HydrophobicContact CD1-CB 4.08Å; L545-L598 HydrophobicContact CD1-CD1 3.81Å
546	T	80.9	Confident	85.8	Confident	47 Å²	47	43.9 Å²	43.9	29%	0.288	22%	0.216	S	C	.	.	H	α-helix	trans	-92.7	-47.6	178.6	52.4	0	0	0	0	113	E508 K542 L543 L599	E508-T546 HydrophobicContact CG-CG2 3.96Å; K542-T546 PolarHBondContact O-N 2.83Å; K542-T546 VanDerWaalsContact O-N 3.12Å; K542-T546 PolarHBondContact O-OG1 3.03Å; L543-T546 PolarHBondContact O-N 3.39Å; T546-L599 HydrophobicContact CG2-CD1 4.24Å
547	N	81.3	Confident	85.7	Confident	34 Å²	34	49.9 Å²	49.9	18%	0.182	24%	0.239	C	C	.	.			trans	-125.2	64.6	179.1	-174.3	-1	0	0	0	111.6	L543 K549 Q550 T551	L543-N547 CarbonylContact O-C 3.56Å; L543-N547 VanDerWaalsContact O-C 3.24Å; L543-N547 WeakPolarHBondContact O-CA 3.45Å; L543-N547 PolarHBondContact O-N 3.03Å; N547-K549 PolarHBondContact O-N 3.26Å; N547-Q550 PolarHBondContact ND2-OE1 3.16Å; N547-Q550 PolarHBondContact OD1-N 3.35Å; N547-T551 PolarHBondContact O-N 3.27Å; N547-T551 PolarHBondContact O-OG1 2.97Å
548	S	76.9	Confident	85.7	Confident	48 Å²	48	49.8 Å²	49.8	34%	0.336	24%	0.239	S	C	.	.	H	α-helix	trans	-58	-35.6	179	-158	0	0	0	0	113	Y544 Q550 T551 K552	Y544-S548 VanDerWaalsContact O-CA 3.29Å; Y544-S548 WeakPolarHBondContact O-CA 3.35Å; Y544-S548 WeakPolarHBondContact O-CB 3.05Å; Y544-S548 PolarHBondContact O-N 3.13Å; Y544-S548 PolarHBondContact O-OG 3.01Å; S548-Q550 VanDerWaalsContact C-N 3.33Å; S548-Q550 PolarHBondContact O-N 3.15Å; S548-T551 PolarHBondContact O-N 3.21Å; S548-K552 VanDerWaalsContact O-CB 3.23Å; S548-K552 WeakPolarHBondContact O-CB 3.34Å; S548-K552 PolarHBondContact O-N 3Å; S548-K552 VanDerWaalsContact O-N 3.16Å
549	K	78.1	Confident	85.7	Confident	209 Å²	209	48.3 Å²	48.3	91%	0.909	23%	0.231	S	C	*	.	H	α-helix	trans	-58	-40.3	-174.6	-70.7	-173.7	178.9	-178.3	0	113.3	N547	N547-K549 PolarHBondContact O-N 3.26Å
550	Q	80.4	Confident	85.8	Confident	129 Å²	129	51.7 Å²	51.7	60%	0.603	25%	0.249	S	C	*	.	H	α-helix	trans	-98.6	-27.9	-178.7	-69.3	175.9	-36.3	0	0	113.3	N547 S548	N547-Q550 PolarHBondContact ND2-OE1 3.16Å; N547-Q550 PolarHBondContact OD1-N 3.35Å; S548-Q550 VanDerWaalsContact C-N 3.33Å; S548-Q550 PolarHBondContact O-N 3.15Å
551	T	82.1	Confident	85.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-102.5	-8.9	-167.5	67.5	0	0	0	0	114.9	P515 L543 N547 S548 L553 L554 T555	P515-T551 HydrophobicContact CB-CG2 4.04Å; P515-T551 HydrophobicContact CG-CG2 3.94Å; L543-T551 HydrophobicContact CB-CG2 4.12Å; L543-T551 PolarHBondContact O-OG1 2.94Å; L543-T551 VanDerWaalsContact O-OG1 3.09Å; N547-T551 PolarHBondContact O-N 3.27Å; N547-T551 PolarHBondContact O-OG1 2.97Å; S548-T551 PolarHBondContact O-N 3.21Å; T551-L553 PolarHBondContact O-N 3.23Å; T551-L554 PolarHBondContact O-N 2.9Å; T551-T555 WeakPolarHBondContact O-CB 3.48Å; T551-T555 PolarHBondContact O-N 3.43Å; T551-T555 PolarHBondContact O-OG1 3.36Å
552	K	85.4	Confident	85.7	Confident	100 Å²	100	53.8 Å²	53.8	44%	0.435	26%	0.26	S	S	.	.	H	α-helix	trans	-52.1	-48.3	-179.5	175.6	171.7	-179.5	-180	0	113.5	Y544 S548 Q556	Y544-K552 HydrophobicContact CD2-CB 4.49Å; Y544-K552 HydrophobicContact CE2-CB 4.16Å; Y544-K552 HydrophobicContact CE2-CG 3.91Å; S548-K552 VanDerWaalsContact O-CB 3.23Å; S548-K552 WeakPolarHBondContact O-CB 3.34Å; S548-K552 PolarHBondContact O-N 3Å; S548-K552 VanDerWaalsContact O-N 3.16Å; K552-Q556 WeakPolarHBondContact O-CB 3.36Å; K552-Q556 WeakPolarHBondContact O-CG 3.3Å; K552-Q556 PolarHBondContact O-N 2.89Å
553	L	87.7	Confident	85.7	Confident	140 Å²	140	56.5 Å²	56.5	73%	0.733	27%	0.271	S	S	*	.	H	α-helix	trans	-68	-45.4	180	-77.3	160.7	0	0	0	112.4	T551 T555 Q556 Y557	T551-L553 PolarHBondContact O-N 3.23Å; L553-T555 VanDerWaalsContact C-N 3.34Å; L553-T555 PolarHBondContact O-N 3.22Å; L553-Q556 PolarHBondContact O-N 3.39Å; L553-Y557 PolarHBondContact O-N 3.19Å
554	L	87.9	Confident	85.8	Confident	38 Å²	38	64.5 Å²	64.5	20%	0.199	30%	0.303	C	S	.	.	H	α-helix	trans	-60.2	-43.9	176.8	-71.1	169	0	0	0	111.7	L518 R519 A522 T551 Y557 I558	L518-L554 HydrophobicContact CD2-CB 4.09Å; R519-L554 HydrophobicContact CB-CD1 4.24Å; R519-L554 HydrophobicContact CB-CD2 4.38Å; R519-L554 HydrophobicContact CG-CD2 4.19Å; A522-L554 HydrophobicContact CB-CD2 4.31Å; T551-L554 PolarHBondContact O-N 2.9Å; L554-Y557 PolarHBondContact O-N 3.14Å; L554-I558 WeakPolarHBondContact O-CG1 3.21Å; L554-I558 PolarHBondContact O-N 3.18Å
555	T	87.5	Confident	85.9	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-42.5	177.5	-56.6	0	0	0	0	111.4	A540 Y544 T551 L553 Y557 I558 L559	A540-T555 HydrophobicContact CB-CG2 3.93Å; A540-T555 PolarHBondContact O-OG1 2.94Å; Y544-T555 HydrophobicContact CD2-CG2 3.9Å; Y544-T555 HydrophobicContact CG-CG2 4.48Å; T551-T555 WeakPolarHBondContact O-CB 3.48Å; T551-T555 PolarHBondContact O-N 3.43Å; T551-T555 PolarHBondContact O-OG1 3.36Å; L553-T555 VanDerWaalsContact C-N 3.34Å; L553-T555 PolarHBondContact O-N 3.22Å; T555-Y557 VanDerWaalsContact C-N 3.31Å; T555-Y557 PolarHBondContact O-N 2.66Å; T555-I558 PolarHBondContact O-N 3.01Å; T555-L559 HydrophobicContact CG2-CD1 3.79Å; T555-L559 HydrophobicContact CG2-CG 4.2Å; T555-L559 WeakPolarHBondContact O-CB 3.32Å; T555-L559 WeakPolarHBondContact O-CG 3.24Å; T555-L559 PolarHBondContact O-N 3.3Å
556	Q	88.2	Confident	86.1	Confident	66 Å²	66	71.8 Å²	71.8	31%	0.308	34%	0.337	S	S	.	.	H	α-helix	trans	-62.4	-37.6	175.2	-78	178.6	-33.8	0	0	112.6	K552 L553 N560	K552-Q556 WeakPolarHBondContact O-CB 3.36Å; K552-Q556 WeakPolarHBondContact O-CG 3.3Å; K552-Q556 PolarHBondContact O-N 2.89Å; L553-Q556 PolarHBondContact O-N 3.39Å; Q556-N560 WeakPolarHBondContact O-CB 3.29Å; Q556-N560 PolarHBondContact O-N 3.43Å; Q556-N560 VanDerWaalsContact O-N 3.09Å; Q556-N560 PolarHBondContact O-ND2 2.87Å
557	Y	90.3	Very high	86.6	Confident	126 Å²	126	71.6 Å²	71.6	49%	0.494	34%	0.335	S	S	.	.	H	α-helix	trans	-64.5	-51.8	174.9	179.8	-103.1	0	0	0	111.8	A522 L553 L554 T555 L559 N560 L561	A522-Y557 HydrophobicContact CB-CD1 4.23Å; A522-Y557 HydrophobicContact CB-CE1 4.44Å; A522-Y557 WeakPolarHBondContact O-CE1 3.49Å; L553-Y557 PolarHBondContact O-N 3.19Å; L554-Y557 PolarHBondContact O-N 3.14Å; T555-Y557 VanDerWaalsContact C-N 3.31Å; T555-Y557 PolarHBondContact O-N 2.66Å; Y557-L559 VanDerWaalsContact C-N 3.35Å; Y557-L559 PolarHBondContact O-N 3.08Å; Y557-N560 PolarHBondContact O-N 2.93Å; Y557-L561 HydrophobicContact CD1-CD1 4.13Å; Y557-L561 HydrophobicContact CE1-CD1 3.55Å; Y557-L561 HydrophobicContact CE1-CG 4.22Å; Y557-L561 PolarHBondContact O-N 2.85Å
558	I	91.8	Very high	87.1	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-59.3	-43.5	177.6	-66.9	164	0	0	0	111.4	L518 A522 F525 T536 V537 A540 L554 T555 N560 L561 G562	L518-I558 HydrophobicContact CD1-CD1 3.55Å; L518-I558 HydrophobicContact CD2-CD1 4.49Å; L518-I558 HydrophobicContact CG-CD1 3.91Å; A522-I558 HydrophobicContact CB-CD1 4.14Å; A522-I558 HydrophobicContact CB-CG1 4.1Å; F525-I558 HydrophobicContact CD2-CG2 4.17Å; F525-I558 HydrophobicContact CE2-CG2 3.92Å; F525-I558 HydrophobicContact CZ-CG2 4.44Å; T536-I558 HydrophobicContact CG2-CD1 4.15Å; T536-I558 HydrophobicContact CG2-CG2 4.39Å; V537-I558 HydrophobicContact CG2-CG2 4.12Å; A540-I558 HydrophobicContact CB-CD1 4.26Å; L554-I558 WeakPolarHBondContact O-CG1 3.21Å; L554-I558 PolarHBondContact O-N 3.18Å; T555-I558 PolarHBondContact O-N 3.01Å; I558-N560 PolarHBondContact O-N 3.31Å; I558-L561 PolarHBondContact O-N 3.43Å; I558-G562 PolarHBondContact O-N 3.16Å
559	L	90	Very high	87.8	Confident	1 Å²	1	79.4 Å²	79.4	1%	0.005	36%	0.361	C	S	.	.	H	α-helix	trans	-68.1	-20.2	177	-68	174.4	0	0	0	113.6	V537 T555 Y557 T574 I577 R578 V582	V537-L559 HydrophobicContact CG1-CD2 3.98Å; T555-L559 HydrophobicContact CG2-CD1 3.79Å; T555-L559 HydrophobicContact CG2-CG 4.2Å; T555-L559 WeakPolarHBondContact O-CB 3.32Å; T555-L559 WeakPolarHBondContact O-CG 3.24Å; T555-L559 PolarHBondContact O-N 3.3Å; Y557-L559 VanDerWaalsContact C-N 3.35Å; Y557-L559 PolarHBondContact O-N 3.08Å; L559-T574 HydrophobicContact CB-CG2 4.28Å; L559-T574 HydrophobicContact CD2-CG2 3.87Å; L559-T574 VanDerWaalsContact O-CG2 3.22Å; L559-T574 WeakPolarHBondContact O-CG2 3.19Å; L559-I577 HydrophobicContact CD2-CG2 3.98Å; L559-R578 HydrophobicContact CD1-CB 4.21Å; L559-R578 HydrophobicContact CD1-CG 4.3Å; L559-R578 HydrophobicContact CD2-CB 4.46Å; L559-V582 HydrophobicContact CD1-CG2 4.18Å
560	N	90.3	Very high	88.4	Confident	73 Å²	73	69.5 Å²	69.5	39%	0.39	32%	0.318	S	S	.	.	H	α-helix	trans	-85.1	-34	173.2	-73.8	-19.4	0	0	0	111.6	Q556 Y557 I558 Y564 R578	Q556-N560 WeakPolarHBondContact O-CB 3.29Å; Q556-N560 PolarHBondContact O-N 3.43Å; Q556-N560 VanDerWaalsContact O-N 3.09Å; Q556-N560 PolarHBondContact O-ND2 2.87Å; Y557-N560 PolarHBondContact O-N 2.93Å; I558-N560 PolarHBondContact O-N 3.31Å; N560-Y564 WeakPolarHBondContact O-CD2 3.36Å; N560-R578 PolarHBondContact OD1-NH2 3.04Å; N560-R578 VanDerWaalsContact OD1-NH2 3.1Å
561	L	88.4	Confident	89	Confident	46 Å²	46	67.1 Å²	67.1	24%	0.241	30%	0.304	C	S	.	.	H	α-helix	trans	-64.1	-56.4	170.1	-67.1	180	0	0	0	110.9	F525 Y557 I558 K563 Y564	F525-L561 HydrophobicContact CB-CD1 4.08Å; F525-L561 HydrophobicContact CD1-CB 3.83Å; F525-L561 HydrophobicContact CD1-CD1 3.97Å; F525-L561 HydrophobicContact CE1-CB 4.01Å; F525-L561 HydrophobicContact CG-CD1 4.27Å; Y557-L561 HydrophobicContact CD1-CD1 4.13Å; Y557-L561 HydrophobicContact CE1-CD1 3.55Å; Y557-L561 HydrophobicContact CE1-CG 4.22Å; Y557-L561 PolarHBondContact O-N 2.85Å; I558-L561 PolarHBondContact O-N 3.43Å; L561-K563 PolarHBondContact O-N 3.01Å; L561-Y564 PolarHBondContact O-N 3.31Å
562	G	88.5	Confident	89.4	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-60.8	-18	-177.8	0	0	0	0	0	114.7	I558 Y564 R571	I558-G562 PolarHBondContact O-N 3.16Å; G562-Y564 PolarHBondContact O-N 3.33Å; G562-R571 WeakPolarHBondContact O-CA 3.22Å; G562-R571 WeakPolarHBondContact O-CG 3.36Å
563	K	88.4	Confident	89.6	Confident	78 Å²	78	71.3 Å²	71.3	34%	0.339	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-61.5	-29	172.9	-172.5	-165.6	166.8	-159.9	0	112.4	L561	L561-K563 PolarHBondContact O-N 3.01Å
564	Y	87.1	Confident	89.8	Confident	171 Å²	171	64.6 Å²	64.6	67%	0.671	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-119.1	16.4	-173.6	-54.6	-68.1	0	0	0	113.3	N560 L561 G562	N560-Y564 WeakPolarHBondContact O-CD2 3.36Å; L561-Y564 PolarHBondContact O-N 3.31Å; G562-Y564 PolarHBondContact O-N 3.33Å
565	D	89.9	Confident	89.8	Confident	19 Å²	19	68.4 Å²	68.4	10%	0.102	30%	0.3	C	S	.	.			trans	-61.1	160.2	174.6	-158.5	-78.1	0	0	0	111.7	K533 N567 I570 R571	K533-D565 VanDerWaalsContact CD-OD2 3.31Å; K533-D565 WeakPolarHBondContact CD-OD2 3.41Å; K533-D565 VanDerWaalsContact CE-OD2 3.29Å; K533-D565 WeakPolarHBondContact CE-OD2 3.3Å; K533-D565 VanDerWaalsContact NZ-CG 3.32Å; K533-D565 IonicContact NZ-OD1 3.2Å; K533-D565 PolarHBondContact NZ-OD1 3.48Å; K533-D565 IonicContact NZ-OD2 2.86Å; K533-D565 PolarHBondContact NZ-OD2 2.92Å; D565-N567 PolarHBondContact OD1-N 3.45Å; D565-I570 HydrophobicContact CB-CB 4.5Å; D565-I570 HydrophobicContact CB-CG2 3.92Å; D565-R571 HydrophobicContact CB-CG 4.27Å; D565-R571 WeakPolarHBondContact O-CD 3.41Å; D565-R571 WeakPolarHBondContact O-CG 3.26Å; D565-R571 PolarHBondContact O-NE 3.4Å
566	Q	88.1	Confident	89.8	Confident	182 Å²	182	74 Å²	74	85%	0.85	32%	0.324	S	S	*	.	S	Bend	trans	-72.9	-38.3	176.6	-60.4	-173.8	13.5	0	0	111.2	R571	Q566-R571 PolarHBondContact O-NH2 3.33Å
567	N	91.3	Very high	89.8	Confident	43 Å²	43	70.9 Å²	70.9	23%	0.23	31%	0.31	C	S	.	.	S	Bend	trans	-68.3	139.5	179.3	-170.8	-45.4	0	0	0	111	D530 D565 D569 I570 R571	D530-N567 WeakPolarHBondContact OD2-CB 3.43Å; D530-N567 PolarHBondContact OD2-ND2 3.31Å; D565-N567 PolarHBondContact OD1-N 3.45Å; N567-D569 PolarHBondContact OD1-N 3.33Å; N567-I570 HydrophobicContact CB-CB 4.25Å; N567-I570 HydrophobicContact CB-CD1 3.83Å; N567-I570 HydrophobicContact CB-CG1 4.32Å; N567-R571 WeakPolarHBondContact O-CG 3.32Å; N567-R571 PolarHBondContact O-N 3.41Å; N567-R571 PolarHBondContact O-NE 3.19Å
568	Y	91.1	Very high	89.6	Confident	172 Å²	172	69.8 Å²	69.8	68%	0.675	31%	0.305	S	S	*	.	H	α-helix	trans	-75.8	-42.3	180	60.3	-90.6	0	0	0	112.6	I570 R571 D572	Y568-I570 PolarHBondContact O-N 2.89Å; Y568-R571 WeakPolarHBondContact O-CB 3.49Å; Y568-R571 PolarHBondContact O-N 3.49Å; Y568-D572 PolarHBondContact O-N 3.16Å
569	D	91.5	Very high	89.1	Confident	74 Å²	74	74.6 Å²	74.6	40%	0.396	33%	0.327	S	S	.	.	H	α-helix	trans	-63	-45.5	179.1	177.6	46.3	0	0	0	110.4	N567 R571 D572 R573	N567-D569 PolarHBondContact OD1-N 3.33Å; D569-R571 VanDerWaalsContact C-N 3.29Å; D569-R571 PolarHBondContact O-N 3.22Å; D569-D572 PolarHBondContact O-N 3.02Å; D569-R573 WeakPolarHBondContact O-CA 3.25Å; D569-R573 WeakPolarHBondContact O-CB 3.34Å; D569-R573 PolarHBondContact O-N 3.04Å
570	I	91.3	Very high	88.7	Confident	2 Å²	2	75 Å²	75	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-60.2	-40.1	176.8	-70	161	0	0	0	111.5	D530 K533 D565 N567 Y568 T574	D530-I570 HydrophobicContact CB-CD1 3.57Å; D530-I570 VanDerWaalsContact CG-CD1 3.49Å; D530-I570 VanDerWaalsContact OD1-CD1 3.26Å; D530-I570 WeakPolarHBondContact OD1-CD1 3.42Å; K533-I570 HydrophobicContact CB-CD1 3.9Å; K533-I570 HydrophobicContact CD-CD1 3.73Å; K533-I570 HydrophobicContact CG-CD1 4.49Å; D565-I570 HydrophobicContact CB-CB 4.5Å; D565-I570 HydrophobicContact CB-CG2 3.92Å; N567-I570 HydrophobicContact CB-CB 4.25Å; N567-I570 HydrophobicContact CB-CD1 3.83Å; N567-I570 HydrophobicContact CB-CG1 4.32Å; Y568-I570 PolarHBondContact O-N 2.89Å; I570-T574 WeakPolarHBondContact O-CB 2.99Å; I570-T574 PolarHBondContact O-N 3.13Å; I570-T574 PolarHBondContact O-OG1 3.33Å
571	R	92.3	Very high	88.1	Confident	79 Å²	79	71.8 Å²	71.8	30%	0.298	31%	0.312	S	S	.	.	H	α-helix	trans	-62.7	-51.1	175.7	-80.9	-178.4	-78.1	173	-4	112	G562 D565 Q566 N567 Y568 D569 T574 R575	G562-R571 WeakPolarHBondContact O-CA 3.22Å; G562-R571 WeakPolarHBondContact O-CG 3.36Å; D565-R571 HydrophobicContact CB-CG 4.27Å; D565-R571 WeakPolarHBondContact O-CD 3.41Å; D565-R571 WeakPolarHBondContact O-CG 3.26Å; D565-R571 PolarHBondContact O-NE 3.4Å; Q566-R571 PolarHBondContact O-NH2 3.33Å; N567-R571 WeakPolarHBondContact O-CG 3.32Å; N567-R571 PolarHBondContact O-N 3.41Å; N567-R571 PolarHBondContact O-NE 3.19Å; Y568-R571 WeakPolarHBondContact O-CB 3.49Å; Y568-R571 PolarHBondContact O-N 3.49Å; D569-R571 VanDerWaalsContact C-N 3.29Å; D569-R571 PolarHBondContact O-N 3.22Å; R571-T574 PolarHBondContact O-N 3.42Å; R571-R575 WeakPolarHBondContact O-CD 3.36Å; R571-R575 WeakPolarHBondContact O-CG 3.44Å; R571-R575 PolarHBondContact O-N 2.88Å
572	D	91.3	Very high	87.4	Confident	84 Å²	84	70.9 Å²	70.9	45%	0.449	31%	0.308	S	S	.	.	H	α-helix	trans	-75.2	-34.9	-175.6	-72	-32.1	0	0	0	112.9	Y568 D569 T574 R575 F576	Y568-D572 PolarHBondContact O-N 3.16Å; D569-D572 PolarHBondContact O-N 3.02Å; D572-T574 VanDerWaalsContact C-N 3.35Å; D572-T574 PolarHBondContact O-N 3.37Å; D572-R575 PolarHBondContact O-N 2.93Å; D572-R575 WeakPolarHBondContact OD1-CD 3.33Å; D572-R575 IonicContact OD1-CZ 3.53Å; D572-R575 IonicContact OD1-NE 3.71Å; D572-R575 IonicContact OD1-NH1 2.67Å; D572-R575 PolarHBondContact OD1-NH1 3.36Å; D572-F576 VanDerWaalsContact O-CB 3.3Å; D572-F576 WeakPolarHBondContact O-CB 3.1Å; D572-F576 PolarHBondContact O-N 3.35Å
573	R	89.5	Confident	86.3	Confident	103 Å²	103	75.4 Å²	75.4	39%	0.389	34%	0.337	S	S	.	.	H	α-helix	trans	-59.5	-44.8	166.8	-162.8	81.4	-176.7	175.6	1.1	111.4	L534 D569 F576 I577	L534-R573 HydrophobicContact CD1-CB 4.26Å; L534-R573 HydrophobicContact CD1-CG 3.75Å; D569-R573 WeakPolarHBondContact O-CA 3.25Å; D569-R573 WeakPolarHBondContact O-CB 3.34Å; D569-R573 PolarHBondContact O-N 3.04Å; R573-F576 PolarHBondContact O-N 2.63Å; R573-I577 HydrophobicContact CG-CD1 3.91Å; R573-I577 WeakPolarHBondContact O-CB 3.48Å; R573-I577 VanDerWaalsContact O-CG1 3.31Å; R573-I577 WeakPolarHBondContact O-CG1 3.37Å; R573-I577 PolarHBondContact O-N 3.48Å
574	T	91	Very high	84.9	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.5	-44.6	176.8	-67.4	0	0	0	0	111.3	L559 I570 R571 D572 R578	L559-T574 HydrophobicContact CB-CG2 4.28Å; L559-T574 HydrophobicContact CD2-CG2 3.87Å; L559-T574 VanDerWaalsContact O-CG2 3.22Å; L559-T574 WeakPolarHBondContact O-CG2 3.19Å; I570-T574 WeakPolarHBondContact O-CB 2.99Å; I570-T574 PolarHBondContact O-N 3.13Å; I570-T574 PolarHBondContact O-OG1 3.33Å; R571-T574 PolarHBondContact O-N 3.42Å; D572-T574 VanDerWaalsContact C-N 3.35Å; D572-T574 PolarHBondContact O-N 3.37Å; T574-R578 WeakPolarHBondContact O-CB 3.39Å; T574-R578 PolarHBondContact O-N 3.26Å
575	R	88.5	Confident	83.3	Confident	118 Å²	118	76.4 Å²	76.4	45%	0.445	36%	0.357	S	S	.	.	H	α-helix	trans	-60.5	-46.5	175.9	-69.4	157	-173.7	-178.5	-2.4	111.6	R571 D572 R578 Q579	R571-R575 WeakPolarHBondContact O-CD 3.36Å; R571-R575 WeakPolarHBondContact O-CG 3.44Å; R571-R575 PolarHBondContact O-N 2.88Å; D572-R575 PolarHBondContact O-N 2.93Å; D572-R575 WeakPolarHBondContact OD1-CD 3.33Å; D572-R575 IonicContact OD1-CZ 3.53Å; D572-R575 IonicContact OD1-NE 3.71Å; D572-R575 IonicContact OD1-NH1 2.67Å; D572-R575 PolarHBondContact OD1-NH1 3.36Å; R575-R578 PolarHBondContact O-N 3.46Å; R575-Q579 PolarHBondContact O-N 3.3Å
576	F	87.7	Confident	81.7	Confident	116 Å²	116	84 Å²	84	51%	0.509	39%	0.389	S	S	.	.	H	α-helix	trans	-61.3	-51.3	177.4	178.6	-98.8	0	0	0	112.1	D572 R573 R578 Q579 L580	D572-F576 VanDerWaalsContact O-CB 3.3Å; D572-F576 WeakPolarHBondContact O-CB 3.1Å; D572-F576 PolarHBondContact O-N 3.35Å; R573-F576 PolarHBondContact O-N 2.63Å; F576-R578 VanDerWaalsContact C-N 3.33Å; F576-R578 PolarHBondContact O-N 2.79Å; F576-Q579 PolarHBondContact O-N 3.4Å; F576-L580 HydrophobicContact CE1-CD2 4.47Å; F576-L580 WeakPolarHBondContact O-CB 3.49Å; F576-L580 PolarHBondContact O-N 2.86Å
577	I	87.4	Confident	80.1	Confident	2 Å²	2	77.3 Å²	77.3	1%	0.01	36%	0.362	C	S	.	.	H	α-helix	trans	-62.4	-40.1	178.6	-73	175.1	0	0	0	111.1	V537 A541 L559 R573 Q579 L580 I581	V537-I577 HydrophobicContact CG1-CB 4.49Å; V537-I577 HydrophobicContact CG1-CD1 3.75Å; V537-I577 HydrophobicContact CG1-CG2 4.27Å; A541-I577 HydrophobicContact CB-CG2 3.72Å; L559-I577 HydrophobicContact CD2-CG2 3.98Å; R573-I577 HydrophobicContact CG-CD1 3.91Å; R573-I577 WeakPolarHBondContact O-CB 3.48Å; R573-I577 VanDerWaalsContact O-CG1 3.31Å; R573-I577 WeakPolarHBondContact O-CG1 3.37Å; R573-I577 PolarHBondContact O-N 3.48Å; I577-Q579 PolarHBondContact O-N 2.69Å; I577-L580 PolarHBondContact O-N 3.06Å; I577-I581 HydrophobicContact CG2-CD1 3.72Å; I577-I581 WeakPolarHBondContact O-CB 3.45Å; I577-I581 WeakPolarHBondContact O-CG1 3.43Å; I577-I581 PolarHBondContact O-N 3.1Å
578	R	86.3	Confident	78.6	Confident	103 Å²	103	77.7 Å²	77.7	39%	0.389	38%	0.376	S	S	.	.	H	α-helix	trans	-60.9	-43.9	175.3	-169.4	178.7	-165.1	-90.1	7.6	111.7	L559 N560 T574 R575 F576 V582	L559-R578 HydrophobicContact CD1-CB 4.21Å; L559-R578 HydrophobicContact CD1-CG 4.3Å; L559-R578 HydrophobicContact CD2-CB 4.46Å; N560-R578 PolarHBondContact OD1-NH2 3.04Å; N560-R578 VanDerWaalsContact OD1-NH2 3.1Å; T574-R578 WeakPolarHBondContact O-CB 3.39Å; T574-R578 PolarHBondContact O-N 3.26Å; R575-R578 PolarHBondContact O-N 3.46Å; F576-R578 VanDerWaalsContact C-N 3.33Å; F576-R578 PolarHBondContact O-N 2.79Å; R578-V582 HydrophobicContact CG-CG2 4.03Å; R578-V582 VanDerWaalsContact O-CB 3.26Å; R578-V582 WeakPolarHBondContact O-CB 3.21Å; R578-V582 WeakPolarHBondContact O-CG2 3.4Å; R578-V582 PolarHBondContact O-N 3.01Å
579	Q	82.1	Confident	77.3	Confident	101 Å²	101	72.9 Å²	72.9	47%	0.472	37%	0.372	S	S	.	.	H	α-helix	trans	-71.3	-30.4	178.2	-174.5	61.5	15	0	0	113.3	R575 F576 I577 K586	R575-Q579 PolarHBondContact O-N 3.3Å; F576-Q579 PolarHBondContact O-N 3.4Å; I577-Q579 PolarHBondContact O-N 2.69Å; Q579-K586 PolarHBondContact NE2-O 2.95Å
580	L	81.3	Confident	76.1	Confident	10 Å²	10	74.6 Å²	74.6	5%	0.052	38%	0.381	C	S	.	.	H	α-helix	trans	-73.6	-36.5	177.5	-173	70.6	0	0	0	112.6	F576 I577 L590 N591 A594 L598	F576-L580 HydrophobicContact CE1-CD2 4.47Å; F576-L580 WeakPolarHBondContact O-CB 3.49Å; F576-L580 PolarHBondContact O-N 2.86Å; I577-L580 PolarHBondContact O-N 3.06Å; L580-L590 HydrophobicContact CD1-CB 3.95Å; L580-N591 PolarHBondContact O-ND2 3.05Å; L580-A594 HydrophobicContact CD1-CB 4.22Å; L580-A594 HydrophobicContact CD2-CB 4.3Å; L580-A594 HydrophobicContact CG-CB 3.87Å; L580-L598 HydrophobicContact CD2-CD1 3.88Å; L580-L598 HydrophobicContact CD2-CG 4.15Å
581	I	78.3	Confident	75	Confident	4 Å²	4	76.9 Å²	76.9	2%	0.021	39%	0.393	C	S	.	.	H	α-helix	trans	-106.6	-41.5	-167.3	-61.2	179.2	0	0	0	113.4	A541 Y544 I577 P583 L598	A541-I581 HydrophobicContact CB-CD1 3.45Å; A541-I581 VanDerWaalsContact CB-CD1 3.45Å; Y544-I581 HydrophobicContact CD1-CG2 3.23Å; Y544-I581 HydrophobicContact CD2-CG2 4.22Å; Y544-I581 HydrophobicContact CE1-CG2 3.53Å; Y544-I581 HydrophobicContact CE2-CG2 4.43Å; Y544-I581 HydrophobicContact CG-CG2 3.62Å; I577-I581 HydrophobicContact CG2-CD1 3.72Å; I577-I581 WeakPolarHBondContact O-CB 3.45Å; I577-I581 WeakPolarHBondContact O-CG1 3.43Å; I577-I581 PolarHBondContact O-N 3.1Å; I581-P583 VanDerWaalsContact O-CD 3.3Å; I581-P583 WeakPolarHBondContact O-CD 3.41Å; I581-L598 HydrophobicContact CD1-CD1 3.62Å; I581-L598 HydrophobicContact CG1-CD1 4.04Å
582	V	73.6	Confident	74	Confident	28 Å²	28	81.8 Å²	81.8	17%	0.17	42%	0.417	C	S	.	.	S	Bend	trans	-78.4	120.8	-176.3	-176.4	0	0	0	0	109.1	L559 R578 S584 S587	L559-V582 HydrophobicContact CD1-CG2 4.18Å; R578-V582 HydrophobicContact CG-CG2 4.03Å; R578-V582 VanDerWaalsContact O-CB 3.26Å; R578-V582 WeakPolarHBondContact O-CB 3.21Å; R578-V582 WeakPolarHBondContact O-CG2 3.4Å; R578-V582 PolarHBondContact O-N 3.01Å; V582-S584 PolarHBondContact O-N 2.85Å; V582-S587 PolarHBondContact O-OG 3.23Å
583	P	64.6	Low	73.3	Confident	94 Å²	94	84.1 Å²	84.1	61%	0.61	42%	0.42	S	S	*	.			trans	-62.9	126.1	174.4	-21.2	34.2	0	0	0	110.5	I581	I581-P583 VanDerWaalsContact O-CD 3.3Å; I581-P583 WeakPolarHBondContact O-CD 3.41Å
584	S	58.1	Low	72.5	Confident	67 Å²	67	79.2 Å²	79.2	47%	0.469	40%	0.402	S	S	.	.			trans	-132.7	157	172.8	179	0	0	0	0	107.9	V582 K586 S587	V582-S584 PolarHBondContact O-N 2.85Å; S584-K586 PolarHBondContact O-N 3.22Å; S584-S587 PolarHBondContact N-OG 3.43Å; S584-S587 WeakPolarHBondContact O-CB 3.47Å; S584-S587 PolarHBondContact O-N 3.15Å; S584-S587 PolarHBondContact O-OG 3.05Å
585	E	55.2	Low	71.8	Confident	204 Å²	204	85.7 Å²	85.7	95%	0.953	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-13.8	175.6	-60.7	175.4	160	0	0	112.8
586	K	56.2	Low	71.2	Confident	179 Å²	179	89.7 Å²	89.7	78%	0.778	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.2	24.9	172.8	-57.6	-175.1	-178.4	-178.1	0	113.7	Q579 S584 G588	Q579-K586 PolarHBondContact NE2-O 2.95Å; S584-K586 PolarHBondContact O-N 3.22Å; K586-G588 PolarHBondContact O-N 3.28Å
587	S	54.3	Low	70.9	Confident	41 Å²	41	88.3 Å²	88.3	29%	0.287	44%	0.438	S	S	.	.			trans	-69.9	108.7	173.9	-75.2	0	0	0	0	111.2	V582 S584	V582-S587 PolarHBondContact O-OG 3.23Å; S584-S587 PolarHBondContact N-OG 3.43Å; S584-S587 WeakPolarHBondContact O-CB 3.47Å; S584-S587 PolarHBondContact O-N 3.15Å; S584-S587 PolarHBondContact O-OG 3.05Å
588	G	59.7	Low	70.4	Confident	50 Å²	50	89.7 Å²	89.7	52%	0.515	45%	0.445	S	S	.	.			trans	-68	170.2	177.7	0	0	0	0	0	114.2	K586 L590 N591	K586-G588 PolarHBondContact O-N 3.28Å; G588-L590 PolarHBondContact O-N 2.99Å; G588-N591 PolarHBondContact O-N 2.94Å; G588-N591 VanDerWaalsContact O-N 3.1Å
589	A	64.2	Low	70	Confident	72 Å²	72	87.3 Å²	87.3	60%	0.595	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-53.4	-25.3	-174.3	0	0	0	0	0	115	N591 K592	A589-N591 PolarHBondContact O-N 3.22Å; A589-K592 WeakPolarHBondContact O-CB 3.35Å; A589-K592 PolarHBondContact O-N 3.21Å; A589-K592 VanDerWaalsContact O-N 3.15Å
590	L	65.1	Low	69.7	Low	109 Å²	109	85 Å²	85	57%	0.571	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-57.5	-27.4	177.2	-68	170.8	0	0	0	114.2	L580 G588 K592 Y593 A594	L580-L590 HydrophobicContact CD1-CB 3.95Å; G588-L590 PolarHBondContact O-N 2.99Å; L590-K592 VanDerWaalsContact C-N 3.25Å; L590-K592 PolarHBondContact O-N 3.27Å; L590-Y593 CarbonylContact O-C 3.51Å; L590-Y593 WeakPolarHBondContact O-CA 3.31Å; L590-Y593 PolarHBondContact O-N 2.88Å; L590-A594 PolarHBondContact O-N 3.02Å; L590-A594 VanDerWaalsContact O-N 3.07Å
591	N	69.1	Low	68.9	Low	50 Å²	50	89.8 Å²	89.8	27%	0.267	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-60.1	-37	177.2	-168.9	-38.5	0	0	0	111.1	L580 G588 A589 Y593 A594	L580-N591 PolarHBondContact O-ND2 3.05Å; G588-N591 PolarHBondContact O-N 2.94Å; G588-N591 VanDerWaalsContact O-N 3.1Å; A589-N591 PolarHBondContact O-N 3.22Å; N591-Y593 PolarHBondContact O-N 3.22Å; N591-Y593 VanDerWaalsContact O-N 3.09Å; N591-A594 VanDerWaalsContact O-CB 3.27Å; N591-A594 WeakPolarHBondContact O-CB 3.5Å; N591-A594 PolarHBondContact O-N 3.28Å
592	K	70.9	Confident	68.5	Low	183 Å²	183	95.9 Å²	95.9	80%	0.796	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-58.4	-26.1	173.7	-60.7	-176.1	178.2	-178.2	0	113.2	A589 L590	A589-K592 WeakPolarHBondContact O-CB 3.35Å; A589-K592 PolarHBondContact O-N 3.21Å; A589-K592 VanDerWaalsContact O-N 3.15Å; L590-K592 VanDerWaalsContact C-N 3.25Å; L590-K592 PolarHBondContact O-N 3.27Å
593	Y	75.6	Confident	68	Low	132 Å²	132	100.2 Å²	100.2	52%	0.518	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-102.4	-3.2	179.5	-60	-77.1	0	0	0	113.5	L590 N591 R595 R596 I597	L590-Y593 CarbonylContact O-C 3.51Å; L590-Y593 WeakPolarHBondContact O-CA 3.31Å; L590-Y593 PolarHBondContact O-N 2.88Å; N591-Y593 PolarHBondContact O-N 3.22Å; N591-Y593 VanDerWaalsContact O-N 3.09Å; Y593-R595 VanDerWaalsContact C-N 3.27Å; Y593-R595 PolarHBondContact O-N 3.38Å; Y593-R596 WeakPolarHBondContact O-CA 3.39Å; Y593-R596 PolarHBondContact O-N 2.95Å; Y593-I597 WeakPolarHBondContact O-CG1 3.47Å; Y593-I597 PolarHBondContact O-N 2.95Å
594	A	74.5	Confident	67.8	Low	1 Å²	1	97.8 Å²	97.8	1%	0.008	52%	0.515	C	S	.	.	H	α-helix	trans	-54.7	-40.3	-175.5	0	0	0	0	0	113	L580 L590 N591 I597 L598	L580-A594 HydrophobicContact CD1-CB 4.22Å; L580-A594 HydrophobicContact CD2-CB 4.3Å; L580-A594 HydrophobicContact CG-CB 3.87Å; L590-A594 PolarHBondContact O-N 3.02Å; L590-A594 VanDerWaalsContact O-N 3.07Å; N591-A594 VanDerWaalsContact O-CB 3.27Å; N591-A594 WeakPolarHBondContact O-CB 3.5Å; N591-A594 PolarHBondContact O-N 3.28Å; A594-I597 PolarHBondContact O-N 3.2Å; A594-L598 WeakPolarHBondContact O-CB 3.23Å; A594-L598 PolarHBondContact O-N 3.46Å
595	R	75.1	Confident	67.9	Low	135 Å²	135	97.3 Å²	97.3	51%	0.509	51%	0.511	S	S	.	.	H	α-helix	trans	-60.1	-44.3	173.6	-173.6	-177.9	-72.1	-82.7	-4.8	112.2	L545 Y593 L599	L545-R595 PolarHBondContact O-NH1 3.05Å; L545-R595 PolarHBondContact O-NH2 3.02Å; Y593-R595 VanDerWaalsContact C-N 3.27Å; Y593-R595 PolarHBondContact O-N 3.38Å; R595-L599 HydrophobicContact CG-CD1 3.85Å; R595-L599 VanDerWaalsContact O-CB 3.31Å; R595-L599 WeakPolarHBondContact O-CB 3.41Å; R595-L599 PolarHBondContact O-N 2.8Å; R595-L599 VanDerWaalsContact O-N 3.09Å
596	R	76.8	Confident	68.1	Low	202 Å²	202	92 Å²	92	76%	0.762	49%	0.492	S	S	*	.	H	α-helix	trans	-72.2	-31.1	-179.5	-169.2	176.2	-176.9	178.3	1.3	112.5	Y593	Y593-R596 WeakPolarHBondContact O-CA 3.39Å; Y593-R596 PolarHBondContact O-N 2.95Å
597	I	80.2	Confident	68.2	Low	88 Å²	88	84.4 Å²	84.4	45%	0.451	46%	0.46	S	S	.	.	H	α-helix	trans	-77.6	-43	179.4	-65.5	164.5	0	0	0	111.3	Y593 A594	Y593-I597 WeakPolarHBondContact O-CG1 3.47Å; Y593-I597 PolarHBondContact O-N 2.95Å; A594-I597 PolarHBondContact O-N 3.2Å
598	L	78.4	Confident	68.5	Low	30 Å²	30	85 Å²	85	16%	0.157	46%	0.458	C	S	.	.	H	α-helix	trans	-90.7	-18.7	-173.6	-68.1	173.4	0	0	0	114.7	A541 K542 L545 L580 I581 A594	A541-L598 HydrophobicContact CB-CD1 4.34Å; K542-L598 VanDerWaalsContact CE-O 3.24Å; K542-L598 WeakPolarHBondContact CE-O 3.35Å; L545-L598 HydrophobicContact CD1-CB 4.08Å; L545-L598 HydrophobicContact CD1-CD1 3.81Å; L580-L598 HydrophobicContact CD2-CD1 3.88Å; L580-L598 HydrophobicContact CD2-CG 4.15Å; I581-L598 HydrophobicContact CD1-CD1 3.62Å; I581-L598 HydrophobicContact CG1-CD1 4.04Å; A594-L598 WeakPolarHBondContact O-CB 3.23Å; A594-L598 PolarHBondContact O-N 3.46Å
599	L	75.9	Confident	68.4	Low	53 Å²	53	83.5 Å²	83.5	28%	0.277	44%	0.44	S	S	.	.	S	Bend	trans	-108	18.5	173.6	-53.1	178.5	0	0	0	112.6	K542 T546 R595 S601	K542-L599 HydrophobicContact CB-CD2 4.23Å; K542-L599 HydrophobicContact CD-CD2 4.1Å; K542-L599 HydrophobicContact CG-CD2 4.01Å; T546-L599 HydrophobicContact CG2-CD1 4.24Å; R595-L599 HydrophobicContact CG-CD1 3.85Å; R595-L599 VanDerWaalsContact O-CB 3.31Å; R595-L599 WeakPolarHBondContact O-CB 3.41Å; R595-L599 PolarHBondContact O-N 2.8Å; R595-L599 VanDerWaalsContact O-N 3.09Å; L599-S601 PolarHBondContact O-N 3.01Å
600	A	76.2	Confident	67.9	Low	53 Å²	53	84.1 Å²	84.1	44%	0.438	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-64.5	124.5	169.3	0	0	0	0	0	109.8	K602	A600-K602 PolarHBondContact O-N 3.07Å
601	S	65.2	Low	67.2	Low	110 Å²	110	80.4 Å²	80.4	77%	0.769	42%	0.424	S	S	*	.	P	Polyproline II helix	trans	-62.3	133.7	175.4	44.1	0	0	0	0	110.5	L599	L599-S601 PolarHBondContact O-N 3.01Å
602	K	70.4	Confident	66.5	Low	133 Å²	133	81.9 Å²	81.9	58%	0.578	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-94	140	175.9	-61.1	-169.5	178.2	-166.5	0	110.5	A600	A600-K602 PolarHBondContact O-N 3.07Å
603	P	61.7	Low	65.2	Low	119 Å²	119	74 Å²	74	77%	0.773	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-59	142.7	174	25.7	-33.8	0	0	0	110.6
604	A	60.1	Low	63.4	Low	42 Å²	42	72.5 Å²	72.5	35%	0.347	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-70	130.5	175.6	0	0	0	0	0	109.7	Q470	Q470-A604 HydrophobicContact CB-CB 3.8Å
605	P	62	Low	61.5	Low	57 Å²	57	78.9 Å²	78.9	37%	0.37	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-74.7	133	175.2	27.6	-28	0	0	0	109.7	K467	K467-P605 HydrophobicContact CD-CG 4.21Å; K467-P605 VanDerWaalsContact CE-C 3.42Å; K467-P605 WeakPolarHBondContact CE-O 3.46Å; K467-P605 HydrophobicContact CG-CG 4.08Å; K467-P605 VanDerWaalsContact CG-O 3.27Å; K467-P605 WeakPolarHBondContact CG-O 3.46Å
606	V	58.5	Low	59.4	Low	94 Å²	94	75.7 Å²	75.7	57%	0.57	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-77.9	140.5	-172.2	-166.6	0	0	0	0	111.9	K467 E608	K467-V606 WeakPolarHBondContact CE-O 3.38Å; K467-V606 PolarHBondContact NZ-O 2.98Å; V606-E608 HydrophobicContact CB-CG 3.97Å; V606-E608 HydrophobicContact CG1-CG 3.55Å; V606-E608 PolarHBondContact O-N 3.48Å
607	L	59	Low	57.2	Low	19 Å²	19	72.7 Å²	72.7	10%	0.099	43%	0.434	C	S	.	.			trans	-88.4	68.7	176.1	-94.1	163.1	0	0	0	111.4	R430 T433 K467 L468	R430-L607 HydrophobicContact CG-CB 4.23Å; R430-L607 HydrophobicContact CG-CD2 4.25Å; T433-L607 HydrophobicContact CG2-CB 4.5Å; T433-L607 VanDerWaalsContact OG1-CD1 3.26Å; T433-L607 WeakPolarHBondContact OG1-CD1 3.12Å; K467-L607 HydrophobicContact CB-CD1 4.24Å; K467-L607 HydrophobicContact CD-CD1 4.16Å; K467-L607 HydrophobicContact CD-CD2 3.95Å; K467-L607 HydrophobicContact CD-CG 3.63Å; K467-L607 HydrophobicContact CG-CD1 3.93Å; K467-L607 HydrophobicContact CG-CG 3.86Å; L468-L607 HydrophobicContact CD2-CD1 4.33Å
608	E	60.6	Low	54.6	Low	53 Å²	53	75 Å²	75	25%	0.248	45%	0.452	C	S	.	.			trans	-82.6	158.5	178.1	-51.1	-149	99.2	0	0	112.2	R430 V606 K612	R430-E608 VanDerWaalsContact CZ-O 3.31Å; R430-E608 PolarHBondContact NE-O 3.18Å; R430-E608 PolarHBondContact NH2-O 3.43Å; V606-E608 HydrophobicContact CB-CG 3.97Å; V606-E608 HydrophobicContact CG1-CG 3.55Å; V606-E608 PolarHBondContact O-N 3.48Å; E608-K612 WeakPolarHBondContact OE1-CD 3.42Å; E608-K612 WeakPolarHBondContact OE1-CE 3.48Å; E608-K612 IonicContact OE1-NZ 3.42Å; E608-K612 PolarHBondContact OE1-NZ 2.96Å
609	S	57.6	Low	52.2	Low	18 Å²	18	78.6 Å²	78.6	13%	0.126	48%	0.477	C	S	.	.			trans	-70.4	152.8	171.8	41.8	0	0	0	0	110.6	E391 F611 K612	E391-S609 WeakPolarHBondContact OE1-CA 3.44Å; E391-S609 WeakPolarHBondContact OE1-CB 3.46Å; S609-F611 PolarHBondContact O-N 2.82Å; S609-F611 VanDerWaalsContact O-N 3.08Å; S609-K612 PolarHBondContact O-N 3.16Å; S609-K612 VanDerWaalsContact OG-CB 3.24Å; S609-K612 WeakPolarHBondContact OG-CB 3.31Å; S609-K612 PolarHBondContact OG-N 3.02Å
610	A	52.3	Low	50.2	Low	86 Å²	86	82.1 Å²	82.1	71%	0.711	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-0.7	175	0	0	0	0	0	112.5	E391	E391-A610 PolarHBondContact OE1-N 3.31Å
611	F	51.4	Low	48.1	Very low	31 Å²	31	85 Å²	85	14%	0.136	51%	0.51	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-12.9	-177.1	-77.4	-115.8	0	0	0	112.5	Q355 A358 I362 L388 E391 S609 R628	Q355-F611 HydrophobicContact CG-CE1 4.43Å; A358-F611 HydrophobicContact CB-CD1 3.74Å; A358-F611 HydrophobicContact CB-CE1 3.53Å; A358-F611 HydrophobicContact CB-CZ 4.27Å; I362-F611 HydrophobicContact CD1-CB 3.52Å; L388-F611 HydrophobicContact CD2-CE1 4.05Å; L388-F611 HydrophobicContact CD2-CE2 4.37Å; L388-F611 HydrophobicContact CD2-CZ 3.45Å; L388-F611 VanDerWaalsContact CD2-CZ 3.45Å; E391-F611 HydrophobicContact CG-CD2 3.8Å; E391-F611 HydrophobicContact CG-CE2 4.18Å; E391-F611 HydrophobicContact CG-CG 4.4Å; S609-F611 PolarHBondContact O-N 2.82Å; S609-F611 VanDerWaalsContact O-N 3.08Å; F611-R628 VanDerWaalsContact CD1-NH1 3.33Å
612	K	53.6	Low	46.7	Very low	80 Å²	80	90.9 Å²	90.9	35%	0.348	52%	0.516	S	S	.	.	S	Bend	trans	-100.2	120	170	-172.7	-167.4	175.8	-157.6	0	107.2	E608 S609	E608-K612 WeakPolarHBondContact OE1-CD 3.42Å; E608-K612 WeakPolarHBondContact OE1-CE 3.48Å; E608-K612 IonicContact OE1-NZ 3.42Å; E608-K612 PolarHBondContact OE1-NZ 2.96Å; S609-K612 PolarHBondContact O-N 3.16Å; S609-K612 VanDerWaalsContact OG-CB 3.24Å; S609-K612 WeakPolarHBondContact OG-CB 3.31Å; S609-K612 PolarHBondContact OG-N 3.02Å
613	G	44.6	Very low	44.9	Very low	18 Å²	18	88.4 Å²	88.4	19%	0.186	51%	0.512	C	S	.	.			trans	-65.3	165.7	174.2	0	0	0	0	0	111.9	L615 D627	G613-L615 VanDerWaalsContact C-N 3.28Å; G613-L615 PolarHBondContact O-N 3.42Å; G613-D627 VanDerWaalsContact CA-OD1 3.31Å; G613-D627 WeakPolarHBondContact CA-OD1 3.5Å
614	Q	37	Very low	43.6	Very low	100 Å²	100	89.2 Å²	89.2	47%	0.467	51%	0.51	S	S	.	.			trans	-68.3	75.5	-172.3	-65.3	-170.8	28	0	0	113.5	G616 E625	Q614-G616 PolarHBondContact O-N 3.33Å; Q614-E625 WeakPolarHBondContact CG-OE2 3.24Å; Q614-E625 PolarHBondContact NE2-OE2 3.03Å
615	L	34.7	Very low	42.8	Very low	136 Å²	136	93 Å²	93	71%	0.712	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	58.7	176.1	-160	77.5	0	0	0	111.1	G613	G613-L615 VanDerWaalsContact C-N 3.28Å; G613-L615 PolarHBondContact O-N 3.42Å
616	G	30.2	Very low	42.1	Very low	68 Å²	68	93.2 Å²	93.2	70%	0.701	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-174.9	-5.2	-175.2	0	0	0	0	0	117.9	Q614	Q614-G616 PolarHBondContact O-N 3.33Å
617	Q	31.7	Very low	41.9	Very low	139 Å²	139	90.9 Å²	90.9	65%	0.65	50%	0.501	S	S	*	.	S	Bend	trans	-127.3	138.2	170.1	-65	-172.5	39.1	0	0	109.7	P619	Q617-P619 VanDerWaalsContact O-CD 3.29Å; Q617-P619 WeakPolarHBondContact O-CD 3.49Å
618	T	25	Very low	42.2	Very low	135 Å²	135	90.9 Å²	90.9	83%	0.828	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-59.1	118.4	175.5	46.5	0	0	0	0	109.2	L620	T618-L620 PolarHBondContact O-N 2.9Å
619	P	29.6	Very low	42.3	Very low	106 Å²	106	92.2 Å²	92.2	69%	0.688	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-58.5	133.3	-178.8	-25.6	35	0	0	0	111	Q617	Q617-P619 VanDerWaalsContact O-CD 3.29Å; Q617-P619 WeakPolarHBondContact O-CD 3.49Å
620	L	32.7	Very low	42.8	Very low	128 Å²	128	98.1 Å²	98.1	67%	0.67	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-62.9	132.4	158.5	-72.6	169.2	0	0	0	106.6	T618 W622 T623	T618-L620 PolarHBondContact O-N 2.9Å; L620-W622 PolarHBondContact O-N 2.99Å; L620-T623 PolarHBondContact O-N 3.47Å; L620-T623 PolarHBondContact O-OG1 3.27Å
621	P	33.1	Very low	44.2	Very low	114 Å²	114	94.5 Å²	94.5	74%	0.74	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	11.9	-169.8	-26.7	35.7	0	0	0	117.6
622	W	35.7	Very low	45.6	Very low	233 Å²	233	93.4 Å²	93.4	88%	0.883	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.2	-2	-170.6	-59.9	90.6	0	0	0	113.5	L620	L620-W622 PolarHBondContact O-N 2.99Å
623	T	31.7	Very low	46.9	Very low	81 Å²	81	89.7 Å²	89.7	50%	0.497	48%	0.476	S	S	.	.			trans	-102.6	101.5	178.9	49.4	0	0	0	0	111.2	L620 E625	L620-T623 PolarHBondContact O-N 3.47Å; L620-T623 PolarHBondContact O-OG1 3.27Å; T623-E625 PolarHBondContact O-N 3.5Å
624	N	35	Very low	48.5	Very low	136 Å²	136	90.3 Å²	90.3	73%	0.727	48%	0.482	S	S	*	.			trans	-75.2	50.6	-180	-74.3	-21.7	0	0	0	113.7	M626	N624-M626 VanDerWaalsContact C-N 3.26Å; N624-M626 PolarHBondContact O-N 2.97Å
625	E	42	Very low	50.8	Low	122 Å²	122	86.9 Å²	86.9	57%	0.57	47%	0.468	S	S	*	.			trans	-73.9	83.8	164.5	-72.7	-170.5	-169.1	0	0	108.9	Q614 T623	Q614-E625 WeakPolarHBondContact CG-OE2 3.24Å; Q614-E625 PolarHBondContact NE2-OE2 3.03Å; T623-E625 PolarHBondContact O-N 3.5Å
626	M	47.2	Very low	53.1	Low	60 Å²	60	85.5 Å²	85.5	30%	0.296	46%	0.461	S	S	.	.			trans	-77.6	124.9	178	-67.2	-174.5	172.9	0	0	110.8	N624 R628 F631 N641	N624-M626 VanDerWaalsContact C-N 3.26Å; N624-M626 PolarHBondContact O-N 2.97Å; M626-R628 PolarHBondContact O-N 3.03Å; M626-F631 HydrophobicContact CB-CE2 4.1Å; M626-F631 HydrophobicContact CB-CZ 4.17Å; M626-F631 HydrophobicContact SD-CZ 4.04Å; M626-N641 PolarHBondContact O-ND2 2.69Å
627	D	56	Low	55.7	Low	45 Å²	45	82.3 Å²	82.3	24%	0.241	43%	0.428	C	S	.	.			trans	-56.3	131	174.9	-56.2	-75.7	0	0	0	111.3	G613 D629 R630	G613-D627 VanDerWaalsContact CA-OD1 3.31Å; G613-D627 WeakPolarHBondContact CA-OD1 3.5Å; D627-D629 PolarHBondContact O-N 2.82Å; D627-D629 VanDerWaalsContact O-N 3.08Å; D627-R630 WeakPolarHBondContact O-CB 3.27Å; D627-R630 PolarHBondContact O-N 3.2Å; D627-R630 VanDerWaalsContact O-N 3.07Å; D627-R630 IonicContact OD2-CZ 2.66Å; D627-R630 IonicContact OD2-NE 2.67Å; D627-R630 IonicContact OD2-NH2 3.16Å; D627-R630 PolarHBondContact OD2-NH2 3.32Å
628	R	64.6	Low	58.2	Low	19 Å²	19	75.8 Å²	75.8	7%	0.072	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-55.6	-30.5	-178.1	-176.1	154.4	-83.2	-168.8	-15.6	113.3	Q355 T359 F611 M626 R630 F631 H638 S639 N641	Q355-R628 VanDerWaalsContact NE2-NH2 3.13Å; T359-R628 HydrophobicContact CG2-CG 4.08Å; T359-R628 WeakPolarHBondContact OG1-CD 3.46Å; F611-R628 VanDerWaalsContact CD1-NH1 3.33Å; M626-R628 PolarHBondContact O-N 3.03Å; R628-R630 PolarHBondContact O-N 3.33Å; R628-F631 PolarHBondContact O-N 3.09Å; R628-H638 WeakPolarHBondContact CD-NE2 3.14Å; R628-H638 WeakPolarHBondContact CG-NE2 3.46Å; R628-H638 VanDerWaalsContact CZ-O 3.29Å; R628-H638 PolarHBondContact NE-O 3.07Å; R628-H638 PolarHBondContact NH2-O 3.3Å; R628-S639 PolarHBondContact NH2-O 3.14Å; R628-N641 WeakPolarHBondContact CA-OD1 3.48Å; R628-N641 WeakPolarHBondContact CB-OD1 3.34Å; R628-N641 PolarHBondContact NE-OD1 3.27Å
629	D	62.1	Low	60.9	Low	82 Å²	82	70.3 Å²	70.3	44%	0.439	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-64	-17.4	-179.3	-63.1	-46.7	0	0	0	114	Q363 D627 F631	Q363-D629 PolarHBondContact NE2-OD1 3.37Å; D627-D629 PolarHBondContact O-N 2.82Å; D627-D629 VanDerWaalsContact O-N 3.08Å; D629-F631 VanDerWaalsContact C-N 3.31Å
630	R	69.5	Low	63.3	Low	141 Å²	141	69.9 Å²	69.9	53%	0.532	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-75.9	-15.6	172.6	-71.3	-178.8	-103	179	-8.7	113.6	D627 R628 Y647	D627-R630 WeakPolarHBondContact O-CB 3.27Å; D627-R630 PolarHBondContact O-N 3.2Å; D627-R630 VanDerWaalsContact O-N 3.07Å; D627-R630 IonicContact OD2-CZ 2.66Å; D627-R630 IonicContact OD2-NE 2.67Å; D627-R630 IonicContact OD2-NH2 3.16Å; D627-R630 PolarHBondContact OD2-NH2 3.32Å; R628-R630 PolarHBondContact O-N 3.33Å; R630-Y647 PolarHBondContact O-OH 3.24Å
631	F	80.4	Confident	65.5	Low	10 Å²	10	66.1 Å²	66.1	4%	0.044	34%	0.336	C	S	.	.	S	Bend	trans	-96.4	131.6	-179	-61.7	-64.6	0	0	0	111.8	M626 R628 D629 L633 H638 K643 Y647	M626-F631 HydrophobicContact CB-CE2 4.1Å; M626-F631 HydrophobicContact CB-CZ 4.17Å; M626-F631 HydrophobicContact SD-CZ 4.04Å; R628-F631 PolarHBondContact O-N 3.09Å; D629-F631 VanDerWaalsContact C-N 3.31Å; F631-L633 PolarHBondContact O-N 3.3Å; F631-H638 HydrophobicContact CB-CB 3.68Å; F631-K643 HydrophobicContact CE1-CB 3.99Å; F631-K643 HydrophobicContact CZ-CB 4.35Å; F631-Y647 WeakPolarHBondContact CA-OH 3.24Å; F631-Y647 HydrophobicContact CD1-CD1 4.18Å; F631-Y647 AromaticContact CD1-CE1 3.63Å; F631-Y647 HydrophobicContact CD1-CE1 3.63Å; F631-Y647 AromaticContact CD1-CZ 3.92Å; F631-Y647 HydrophobicContact CE1-CD1 4.33Å; F631-Y647 HydrophobicContact CE1-CE1 4.08Å
632	Q	80.5	Confident	67.8	Low	8 Å²	8	66 Å²	66	4%	0.037	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-59	127.7	176.6	-167.3	-177.3	18.6	0	0	109.7	Q321 H325 T635 H638 Y647 L650	Q321-Q632 HydrophobicContact CG-CG 4.29Å; Q321-Q632 VanDerWaalsContact NE2-NE2 3.11Å; H325-Q632 WeakPolarHBondContact NE2-CG 3.27Å; Q632-T635 HydrophobicContact CB-CG2 3.92Å; Q632-T635 HydrophobicContact CG-CG2 4.46Å; Q632-T635 WeakPolarHBondContact O-CB 3.36Å; Q632-T635 WeakPolarHBondContact O-CG2 3.23Å; Q632-T635 PolarHBondContact O-N 3.06Å; Q632-T635 PolarHBondContact O-OG1 3.09Å; Q632-H638 WeakPolarHBondContact O-CB 3.45Å; Q632-Y647 HydrophobicContact CB-CE2 4.29Å; Q632-Y647 PolarHBondContact N-OH 3.29Å; Q632-L650 HydrophobicContact CG-CD2 4.44Å
633	L	82.4	Confident	69.9	Low	3 Å²	3	59.8 Å²	59.8	2%	0.016	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	139.1	-176.6	-165.5	74.1	0	0	0	110.4	Q321 W324 H325 N356 M360 F631 T635	Q321-L633 VanDerWaalsContact CG-O 3.24Å; Q321-L633 WeakPolarHBondContact CG-O 3.4Å; Q321-L633 PolarHBondContact OE1-O 3.14Å; W324-L633 HydrophobicContact CB-CD2 4.09Å; W324-L633 HydrophobicContact CD2-CD2 4.43Å; W324-L633 HydrophobicContact CG-CD2 3.88Å; H325-L633 PolarHBondContact NE2-N 3.31Å; N356-L633 HydrophobicContact CB-CD1 3.87Å; N356-L633 HydrophobicContact CB-CD2 4.5Å; N356-L633 HydrophobicContact CB-CG 4.1Å; N356-L633 WeakPolarHBondContact OD1-CD1 3.36Å; N356-L633 VanDerWaalsContact OD1-CG 3.26Å; N356-L633 WeakPolarHBondContact OD1-CG 3.41Å; M360-L633 HydrophobicContact CE-CD2 3.54Å; M360-L633 HydrophobicContact CG-CD1 4.39Å; M360-L633 HydrophobicContact CG-CD2 3.94Å; M360-L633 HydrophobicContact SD-CD2 3.9Å; F631-L633 PolarHBondContact O-N 3.3Å; L633-T635 VanDerWaalsContact C-N 3.31Å; L633-T635 PolarHBondContact O-N 2.9Å
634	G	77	Confident	72.1	Confident	30 Å²	30	57.8 Å²	57.8	31%	0.309	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.5	-10	-179.8	0	0	0	0	0	115.7	N356	N356-G634 WeakPolarHBondContact OD1-CA 3.34Å; N356-G634 PolarHBondContact OD1-N 2.6Å
635	T	84.8	Confident	74	Confident	28 Å²	28	56 Å²	56	17%	0.172	29%	0.289	C	S	.	.	S	Bend	trans	-80.2	159.2	179.2	64.5	0	0	0	0	113.5	Q632 L633 S637 H638 S639 Y647	Q632-T635 HydrophobicContact CB-CG2 3.92Å; Q632-T635 HydrophobicContact CG-CG2 4.46Å; Q632-T635 WeakPolarHBondContact O-CB 3.36Å; Q632-T635 WeakPolarHBondContact O-CG2 3.23Å; Q632-T635 PolarHBondContact O-N 3.06Å; Q632-T635 PolarHBondContact O-OG1 3.09Å; L633-T635 VanDerWaalsContact C-N 3.31Å; L633-T635 PolarHBondContact O-N 2.9Å; T635-S637 VanDerWaalsContact C-N 3.28Å; T635-S637 PolarHBondContact O-N 3.11Å; T635-H638 WeakPolarHBondContact O-CB 3.47Å; T635-H638 PolarHBondContact O-N 2.87Å; T635-H638 PolarHBondContact OG1-N 3.24Å; T635-S639 PolarHBondContact O-N 2.87Å; T635-Y647 HydrophobicContact CG2-CE2 4.18Å
636	L	85.1	Confident	75.3	Confident	108 Å²	108	53.8 Å²	53.8	57%	0.565	30%	0.3	S	S	*	.	H	α-helix	trans	-60.9	-36.3	175	-176.6	62.8	0	0	0	112.3	S639 L640 T644	L636-S639 PolarHBondContact O-N 3.28Å; L636-L640 HydrophobicContact CD1-CD1 3.92Å; L636-L640 HydrophobicContact CD1-CG 4.01Å; L636-L640 HydrophobicContact CD2-CD1 4.47Å; L636-L640 HydrophobicContact CG-CD1 3.95Å; L636-L640 HydrophobicContact CG-CG 4.34Å; L636-L640 WeakPolarHBondContact O-CG 3.41Å; L636-L640 PolarHBondContact O-N 2.93Å; L636-T644 HydrophobicContact CD2-CG2 4.27Å; L636-T644 HydrophobicContact CG-CG2 4.27Å
637	S	84.3	Confident	76.8	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.007	29%	0.29	C	S	.	.	H	α-helix	trans	-65.4	-39.7	176.7	-57.8	0	0	0	0	112.3	T635 L640 N641 I642 T644 Y647	T635-S637 VanDerWaalsContact C-N 3.28Å; T635-S637 PolarHBondContact O-N 3.11Å; S637-L640 PolarHBondContact O-N 2.82Å; S637-N641 VanDerWaalsContact O-CA 3.27Å; S637-N641 WeakPolarHBondContact O-CA 3.31Å; S637-N641 PolarHBondContact O-N 2.85Å; S637-I642 WeakPolarHBondContact CA-O 3.47Å; S637-I642 WeakPolarHBondContact CB-O 3.48Å; S637-I642 PolarHBondContact O-N 3.19Å; S637-I642 PolarHBondContact OG-O 3.43Å; S637-T644 PolarHBondContact OG-N 3.14Å; S637-T644 VanDerWaalsContact OG-N 3.07Å; S637-T644 PolarHBondContact OG-OG1 3.26Å; S637-Y647 VanDerWaalsContact OG-CB 3.3Å; S637-Y647 WeakPolarHBondContact OG-CB 3.16Å; S637-Y647 VanDerWaalsContact OG-CG 3.3Å
638	H	83.4	Confident	77.4	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-61	-45.8	170.7	175.6	-89.8	0	0	0	111.3	Q355 N356 T359 R628 F631 Q632 T635 L640 N641	Q355-H638 PolarHBondContact O-CE1 2.95Å; N356-H638 WeakPolarHBondContact CA-CE1 3.4Å; N356-H638 PolarHBondContact N-CE1 2.99Å; N356-H638 PolarHBondContact OD1-CE1 2.94Å; N356-H638 PolarHBondContact OD1-ND1 2.89Å; T359-H638 WeakPolarHBondContact CB-NE2 3.22Å; T359-H638 WeakPolarHBondContact CG2-NE2 3.46Å; T359-H638 PolarHBondContact OG1-CE1 2.95Å; T359-H638 PolarHBondContact OG1-NE2 3.12Å; R628-H638 WeakPolarHBondContact CD-NE2 3.14Å; R628-H638 WeakPolarHBondContact CG-NE2 3.46Å; R628-H638 VanDerWaalsContact CZ-O 3.29Å; R628-H638 PolarHBondContact NE-O 3.07Å; R628-H638 PolarHBondContact NH2-O 3.3Å; F631-H638 HydrophobicContact CB-CB 3.68Å; Q632-H638 WeakPolarHBondContact O-CB 3.45Å; T635-H638 WeakPolarHBondContact O-CB 3.47Å; T635-H638 PolarHBondContact O-N 2.87Å; T635-H638 PolarHBondContact OG1-N 3.24Å; H638-L640 PolarHBondContact O-N 3.47Å; H638-N641 PolarHBondContact O-N 2.92Å
639	S	82.4	Confident	77.9	Confident	20 Å²	20	58.7 Å²	58.7	14%	0.14	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-39	178.1	-81.1	0	0	0	0	114.1	Q355 R628 T635 L636	Q355-S639 PolarHBondContact NE2-O 3.31Å; Q355-S639 PolarHBondContact OE1-OG 3.31Å; Q355-S639 VanDerWaalsContact OE1-OG 3.07Å; R628-S639 PolarHBondContact NH2-O 3.14Å; T635-S639 PolarHBondContact O-N 2.87Å; L636-S639 PolarHBondContact O-N 3.28Å
640	L	80.6	Confident	78.5	Confident	98 Å²	98	56.1 Å²	56.1	51%	0.513	31%	0.306	S	S	.	.	H	α-helix	trans	-89.1	-12.5	179.2	-63	-180	0	0	0	113.9	L636 S637 H638 I642 T644	L636-L640 HydrophobicContact CD1-CD1 3.92Å; L636-L640 HydrophobicContact CD1-CG 4.01Å; L636-L640 HydrophobicContact CD2-CD1 4.47Å; L636-L640 HydrophobicContact CG-CD1 3.95Å; L636-L640 HydrophobicContact CG-CG 4.34Å; L636-L640 WeakPolarHBondContact O-CG 3.41Å; L636-L640 PolarHBondContact O-N 2.93Å; S637-L640 PolarHBondContact O-N 2.82Å; H638-L640 PolarHBondContact O-N 3.47Å; L640-I642 PolarHBondContact O-N 3.18Å; L640-T644 HydrophobicContact CD1-CG2 4.1Å
641	N	78.6	Confident	78.5	Confident	49 Å²	49	52 Å²	52	26%	0.262	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	27.4	-169	-144.7	76.4	0	0	0	115	M626 R628 S637 H638	M626-N641 PolarHBondContact O-ND2 2.69Å; R628-N641 WeakPolarHBondContact CA-OD1 3.48Å; R628-N641 WeakPolarHBondContact CB-OD1 3.34Å; R628-N641 PolarHBondContact NE-OD1 3.27Å; S637-N641 VanDerWaalsContact O-CA 3.27Å; S637-N641 WeakPolarHBondContact O-CA 3.31Å; S637-N641 PolarHBondContact O-N 2.85Å; H638-N641 PolarHBondContact O-N 2.92Å
642	I	81.4	Confident	77.9	Confident	112 Å²	112	58.5 Å²	58.5	57%	0.574	33%	0.334	S	S	*	.	S	Bend	trans	-139.2	134.9	-175.3	-62.5	171.9	0	0	0	107.7	S637 L640 T644	S637-I642 WeakPolarHBondContact CA-O 3.47Å; S637-I642 WeakPolarHBondContact CB-O 3.48Å; S637-I642 PolarHBondContact O-N 3.19Å; S637-I642 PolarHBondContact OG-O 3.43Å; L640-I642 PolarHBondContact O-N 3.18Å; I642-T644 PolarHBondContact O-N 3.04Å; I642-T644 VanDerWaalsContact O-N 3.11Å
643	K	78.7	Confident	77.4	Confident	102 Å²	102	60.5 Å²	60.5	44%	0.443	34%	0.342	S	S	.	.			trans	-64.8	110.1	173.9	-177.9	160.4	-177	172.6	0	109.9	F631 Y647 E649	F631-K643 HydrophobicContact CE1-CB 3.99Å; F631-K643 HydrophobicContact CZ-CB 4.35Å; K643-Y647 HydrophobicContact CD-CD1 4.33Å; K643-Y647 WeakPolarHBondContact CE-O 3.47Å; K643-Y647 HydrophobicContact CG-CD1 4.03Å; K643-E649 WeakPolarHBondContact CE-OE1 3.4Å; K643-E649 IonicContact NZ-OE1 2.66Å; K643-E649 PolarHBondContact NZ-OE1 3.43Å
644	T	78.7	Confident	76.7	Confident	38 Å²	38	62 Å²	62	23%	0.233	35%	0.351	C	S	.	.			trans	-87.2	159.5	179.5	54.1	0	0	0	0	111.5	L636 S637 L640 I642 G646 Y647	L636-T644 HydrophobicContact CD2-CG2 4.27Å; L636-T644 HydrophobicContact CG-CG2 4.27Å; S637-T644 PolarHBondContact OG-N 3.14Å; S637-T644 VanDerWaalsContact OG-N 3.07Å; S637-T644 PolarHBondContact OG-OG1 3.26Å; L640-T644 HydrophobicContact CD1-CG2 4.1Å; I642-T644 PolarHBondContact O-N 3.04Å; I642-T644 VanDerWaalsContact O-N 3.11Å; T644-G646 PolarHBondContact O-N 3.11Å; T644-Y647 VanDerWaalsContact O-CB 3.29Å; T644-Y647 WeakPolarHBondContact O-CB 3.48Å; T644-Y647 PolarHBondContact O-N 3.48Å
645	T	74.4	Confident	75.8	Confident	99 Å²	99	64.5 Å²	64.5	61%	0.607	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	134.5	170.6	46.7	0	0	0	0	111.2	Y647 L879	T645-Y647 VanDerWaalsContact C-N 3.25Å; T645-Y647 PolarHBondContact O-N 2.98Å; T645-L879 HydrophobicContact CG2-CD1 3.95Å; T645-L879 HydrophobicContact CG2-CD2 3.65Å; T645-L879 HydrophobicContact CG2-CG 3.74Å
646	G	68.9	Low	74.5	Confident	76 Å²	76	68.8 Å²	68.8	78%	0.784	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.5	-1.5	-178.5	0	0	0	0	0	115.6	T644 Q648	T644-G646 PolarHBondContact O-N 3.11Å; G646-Q648 PolarHBondContact O-N 2.91Å
647	Y	78.6	Confident	73.4	Confident	25 Å²	25	66 Å²	66	10%	0.098	39%	0.388	C	S	.	.			trans	-72.1	103.4	173.4	-179.9	-104.2	0	0	0	111.2	R630 F631 Q632 T635 S637 K643 T644 T645 E649	R630-Y647 PolarHBondContact O-OH 3.24Å; F631-Y647 WeakPolarHBondContact CA-OH 3.24Å; F631-Y647 HydrophobicContact CD1-CD1 4.18Å; F631-Y647 AromaticContact CD1-CE1 3.63Å; F631-Y647 HydrophobicContact CD1-CE1 3.63Å; F631-Y647 AromaticContact CD1-CZ 3.92Å; F631-Y647 HydrophobicContact CE1-CD1 4.33Å; F631-Y647 HydrophobicContact CE1-CE1 4.08Å; Q632-Y647 HydrophobicContact CB-CE2 4.29Å; Q632-Y647 PolarHBondContact N-OH 3.29Å; T635-Y647 HydrophobicContact CG2-CE2 4.18Å; S637-Y647 VanDerWaalsContact OG-CB 3.3Å; S637-Y647 WeakPolarHBondContact OG-CB 3.16Å; S637-Y647 VanDerWaalsContact OG-CG 3.3Å; K643-Y647 HydrophobicContact CD-CD1 4.33Å; K643-Y647 WeakPolarHBondContact CE-O 3.47Å; K643-Y647 HydrophobicContact CG-CD1 4.03Å; T644-Y647 VanDerWaalsContact O-CB 3.29Å; T644-Y647 WeakPolarHBondContact O-CB 3.48Å; T644-Y647 PolarHBondContact O-N 3.48Å; T645-Y647 VanDerWaalsContact C-N 3.25Å; T645-Y647 PolarHBondContact O-N 2.98Å; Y647-E649 HydrophobicContact CD1-CG 4.12Å; Y647-E649 HydrophobicContact CE1-CB 4.41Å; Y647-E649 HydrophobicContact CE1-CG 3.4Å
648	Q	69.1	Low	72.3	Confident	91 Å²	91	68.3 Å²	68.3	43%	0.425	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-87.7	128.3	167.2	-62.1	159.8	-18.8	0	0	108.8	G646	G646-Q648 PolarHBondContact O-N 2.91Å
649	E	75.7	Confident	71.1	Confident	111 Å²	111	72.4 Å²	72.4	52%	0.519	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-70.6	151	178.5	-78	155.1	-144.2	0	0	111.4	K643 Y647 S651	K643-E649 WeakPolarHBondContact CE-OE1 3.4Å; K643-E649 IonicContact NZ-OE1 2.66Å; K643-E649 PolarHBondContact NZ-OE1 3.43Å; Y647-E649 HydrophobicContact CD1-CG 4.12Å; Y647-E649 HydrophobicContact CE1-CB 4.41Å; Y647-E649 HydrophobicContact CE1-CG 3.4Å; E649-S651 PolarHBondContact O-N 2.9Å
650	L	73.3	Confident	70.1	Confident	27 Å²	27	74.5 Å²	74.5	14%	0.141	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-79.7	120.4	179.2	-176.4	66.5	0	0	0	109.2	T250 R251 R254 H325 Q632	T250-L650 HydrophobicContact CG2-CD1 4.35Å; R251-L650 HydrophobicContact CG-CD1 3.98Å; R254-L650 HydrophobicContact CB-CD1 4.18Å; R254-L650 HydrophobicContact CB-CG 4.48Å; R254-L650 HydrophobicContact CG-CD1 3.83Å; R254-L650 HydrophobicContact CG-CD2 3.96Å; R254-L650 HydrophobicContact CG-CG 3.86Å; H325-L650 HydrophobicContact CB-CD2 3.88Å; Q632-L650 HydrophobicContact CG-CD2 4.44Å
651	S	69.8	Low	69	Low	56 Å²	56	73 Å²	73	39%	0.392	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-53.5	145	-177.9	-48.4	0	0	0	0	113.4	R254 E649	R254-S651 PolarHBondContact NH1-O 2.98Å; E649-S651 PolarHBondContact O-N 2.9Å
652	D	67.5	Low	68.3	Low	145 Å²	145	74 Å²	74	78%	0.775	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-65.2	156.6	166.7	-74	-50	0	0	0	111.4
653	W	70.3	Confident	67.6	Low	51 Å²	51	69 Å²	69	19%	0.193	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-70	136.8	-178.2	-64.2	104.6	0	0	0	111.5	R254 F257 P260 W261 H325 L326	R254-W653 VanDerWaalsContact CD-CE2 3.44Å; R254-W653 VanDerWaalsContact NE-CE2 3.33Å; R254-W653 VanDerWaalsContact NE-CZ2 3.32Å; F257-W653 VanDerWaalsContact O-CE3 3.27Å; P260-W653 HydrophobicContact CG-CH2 4.15Å; W261-W653 AromaticContact CD1-CZ2 3.89Å; W261-W653 AromaticContact NE1-CZ2 3.61Å; H325-W653 WeakPolarHBondContact O-CZ2 3.4Å; L326-W653 HydrophobicContact CD2-CH2 3.42Å; L326-W653 VanDerWaalsContact CD2-CH2 3.42Å; L326-W653 HydrophobicContact CD2-CZ2 4.16Å; L326-W653 HydrophobicContact CD2-CZ3 3.96Å
654	P	68.3	Low	66.5	Low	34 Å²	34	68.6 Å²	68.6	22%	0.221	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-65.8	143.5	171.9	30.9	-38.5	0	0	0	111.1	R254 F257 T656	R254-P654 WeakPolarHBondContact O-CD 3.48Å; F257-P654 WeakPolarHBondContact O-CD 3.5Å; F257-P654 WeakPolarHBondContact O-CG 3.36Å; P654-T656 VanDerWaalsContact C-N 3.34Å
655	A	58.9	Low	65.4	Low	83 Å²	83	70.3 Å²	70.3	69%	0.686	43%	0.43	S	S	*	.	S	Bend	trans	-67	-36.7	177.4	0	0	0	0	0	112.4
656	T	57.4	Low	63.8	Low	117 Å²	117	74.1 Å²	74.1	72%	0.718	44%	0.441	S	S	*	.	S	Bend	trans	-125.3	132.1	177.6	46.9	0	0	0	0	109.2	P654	P654-T656 VanDerWaalsContact C-N 3.34Å
657	A	60.9	Low	62.3	Low	49 Å²	49	77 Å²	77	41%	0.405	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-71.6	136.4	176.4	0	0	0	0	0	110.9	T258	T258-A657 HydrophobicContact CG2-CB 4.21Å
658	P	62	Low	60.1	Low	50 Å²	50	83 Å²	83	33%	0.325	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-60.4	151.7	165.1	-24.7	37.1	0	0	0	111.7
659	D	57	Low	58.2	Low	88 Å²	88	86.3 Å²	86.3	47%	0.471	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-52.5	120.8	-171.7	179.4	6.1	0	0	0	113.1	S661 V662	D659-S661 PolarHBondContact O-N 3.14Å; D659-S661 VanDerWaalsContact O-N 3.1Å; D659-S661 VanDerWaalsContact OD1-CB 3.22Å; D659-S661 WeakPolarHBondContact OD1-CB 3.26Å; D659-S661 PolarHBondContact OD1-N 3.39Å; D659-S661 PolarHBondContact OD1-OG 2.95Å; D659-S661 VanDerWaalsContact OD2-CB 3.28Å; D659-S661 WeakPolarHBondContact OD2-CB 3.35Å; D659-S661 PolarHBondContact OD2-OG 3.34Å; D659-V662 HydrophobicContact CB-CG2 4.34Å; D659-V662 WeakPolarHBondContact O-CG2 3.46Å; D659-V662 PolarHBondContact O-N 3.13Å
660	P	61.1	Low	56.2	Low	64 Å²	64	86.4 Å²	86.4	42%	0.416	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-54.3	-26.1	174.3	-26.9	35.7	0	0	0	114.2	V662 R663	P660-V662 PolarHBondContact O-N 3.11Å; P660-R663 WeakPolarHBondContact O-CB 3.46Å; P660-R663 PolarHBondContact O-N 3.42Å
661	S	59.3	Low	54.2	Low	65 Å²	65	91.7 Å²	91.7	46%	0.455	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-59.2	-29	-179.4	-48.5	0	0	0	0	112.8	D659 R663 N664	D659-S661 PolarHBondContact O-N 3.14Å; D659-S661 VanDerWaalsContact O-N 3.1Å; D659-S661 VanDerWaalsContact OD1-CB 3.22Å; D659-S661 WeakPolarHBondContact OD1-CB 3.26Å; D659-S661 PolarHBondContact OD1-N 3.39Å; D659-S661 PolarHBondContact OD1-OG 2.95Å; D659-S661 VanDerWaalsContact OD2-CB 3.28Å; D659-S661 WeakPolarHBondContact OD2-CB 3.35Å; D659-S661 PolarHBondContact OD2-OG 3.34Å; S661-R663 PolarHBondContact O-N 3.41Å; S661-R663 VanDerWaalsContact O-N 3.12Å; S661-N664 VanDerWaalsContact O-CB 3.31Å; S661-N664 WeakPolarHBondContact O-CB 3.49Å; S661-N664 PolarHBondContact O-N 3.13Å
662	V	61.9	Low	52.2	Low	72 Å²	72	97.8 Å²	97.8	44%	0.436	56%	0.557	S	S	.	*	G	3₁₀ helix	trans	-63	-20.2	176.7	-171.7	0	0	0	0	112.2	H224 D659 P660	H224-V662 HydrophobicContact CB-CG1 3.9Å; H224-V662 WeakPolarHBondContact CB-O 3.31Å; D659-V662 HydrophobicContact CB-CG2 4.34Å; D659-V662 WeakPolarHBondContact O-CG2 3.46Å; D659-V662 PolarHBondContact O-N 3.13Å; P660-V662 PolarHBondContact O-N 3.11Å
663	R	66.9	Low	50.1	Low	5 Å²	5	100.3 Å²	100.3	2%	0.019	56%	0.564	C	S	.	*	G	3₁₀ helix	trans	-89.9	-6.7	175.3	-51.7	-177.5	-161	118.2	5.9	113.3	H224 R228 Y252 Q256 D294 D296 P660 S661	H224-R663 HydrophobicContact CB-CG 4.35Å; R228-R663 PolarHBondContact NH1-O 3.16Å; Y252-R663 PolarHBondContact OH-NE 3.1Å; Y252-R663 VanDerWaalsContact OH-NE 3.14Å; Q256-R663 PolarHBondContact O-NH2 3.13Å; D294-R663 IonicContact OD1-NH1 2.66Å; D294-R663 IonicContact OD2-CZ 3.67Å; D294-R663 IonicContact OD2-NH1 3.64Å; D294-R663 PolarHBondContact OD2-NH1 3.24Å; D294-R663 IonicContact OD2-NH2 2.66Å; D296-R663 WeakPolarHBondContact OD2-CD 3.36Å; D296-R663 IonicContact OD2-NH1 2.68Å; P660-R663 WeakPolarHBondContact O-CB 3.46Å; P660-R663 PolarHBondContact O-N 3.42Å; S661-R663 PolarHBondContact O-N 3.41Å; S661-R663 VanDerWaalsContact O-N 3.12Å
664	N	57.3	Low	47.9	Very low	94 Å²	94	109.1 Å²	109.1	50%	0.503	60%	0.597	S	S	.	*			trans	-81	125	173.6	-62.2	-22.3	0	0	0	109.3	R228 S661	R228-N664 PolarHBondContact NH1-OD1 2.89Å; R228-N664 PolarHBondContact NH2-OD1 3.47Å; S661-N664 VanDerWaalsContact O-CB 3.31Å; S661-N664 WeakPolarHBondContact O-CB 3.49Å; S661-N664 PolarHBondContact O-N 3.13Å
665	V	54.5	Low	45.7	Very low	74 Å²	74	112 Å²	112	45%	0.448	62%	0.624	S	S	.	*			trans	-122.5	122.2	170	177.2	0	0	0	0	107.3	R225 V667	R225-V665 HydrophobicContact CB-CG2 3.71Å; R225-V665 HydrophobicContact CG-CG2 3.98Å; R225-V665 WeakPolarHBondContact O-CG2 3.47Å; V665-V667 PolarHBondContact O-N 3.42Å
666	E	40.7	Very low	44.3	Very low	179 Å²	179	112.7 Å²	112.7	84%	0.836	62%	0.621	S	S	*	*			trans	-56.4	134.8	173.8	-61.8	179.6	145.9	0	0	110	I668	E666-I668 PolarHBondContact O-N 3.22Å
667	V	37.6	Very low	42.6	Very low	137 Å²	137	112.6 Å²	112.6	83%	0.83	63%	0.625	S	S	*	*			trans	-77.4	95.6	-175.2	-178.9	0	0	0	0	109.1	V665 E669	V665-V667 PolarHBondContact O-N 3.42Å; V667-E669 PolarHBondContact O-N 2.98Å; V667-E669 VanDerWaalsContact O-N 3.08Å
668	I	33.4	Very low	40.8	Very low	152 Å²	152	118.4 Å²	118.4	78%	0.779	65%	0.649	S	S	*	*			trans	-64.3	108.3	171.9	-59.1	172.7	0	0	0	108.7	E666	E666-I668 PolarHBondContact O-N 3.22Å
669	E	27.6	Very low	39	Very low	159 Å²	159	118.6 Å²	118.6	74%	0.743	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-63.8	149.5	172.5	-64.7	-165.5	129.9	0	0	111.4	V667 V671	V667-E669 PolarHBondContact O-N 2.98Å; V667-E669 VanDerWaalsContact O-N 3.08Å; E669-V671 PolarHBondContact O-N 3.39Å
670	P	34	Very low	37.5	Very low	113 Å²	113	124.8 Å²	124.8	73%	0.734	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-69.4	116.7	177.4	-14.7	30.3	0	0	0	111.2	Q672	P670-Q672 PolarHBondContact O-N 2.91Å
671	V	31.8	Very low	35.8	Very low	138 Å²	138	125.8 Å²	125.8	84%	0.836	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-58.5	124.5	174.5	176.5	0	0	0	0	110.7	E669	E669-V671 PolarHBondContact O-N 3.39Å
672	Q	28	Very low	34.1	Very low	184 Å²	184	132.8 Å²	132.8	86%	0.86	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-89.2	151.7	168.2	-168.3	161.4	-13.4	0	0	110.6	P670	P670-Q672 PolarHBondContact O-N 2.91Å
673	E	23.8	Very low	32.7	Very low	198 Å²	198	138.3 Å²	138.3	93%	0.925	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-72.2	161.5	-162.1	-63.5	178.9	119.7	0	0	115.4
674	W	24.2	Very low	30.9	Very low	236 Å²	236	144.3 Å²	144.3	89%	0.894	78%	0.776	S	S	*	*			trans	-105.1	132.1	-157.7	-175.6	-67.6	0	0	0	114
675	A	21.9	Very low	29.4	Very low	94 Å²	94	147.1 Å²	147.1	78%	0.777	78%	0.784	S	S	*	*			trans	-145.7	149	161.4	0	0	0	0	0	111.1
676	P	29	Very low	28.1	Very low	98 Å²	98	149 Å²	149	64%	0.636	80%	0.801	S	S	*	*			trans	-129.6	179.6	-144.6	40.6	-24.9	0	0	0	118
677	S	21.5	Very low	27.4	Very low	115 Å²	115	145.9 Å²	145.9	80%	0.804	79%	0.79	S	S	*	*			trans	78.8	146.6	175.3	80.7	0	0	0	0	115
678	L	23.1	Very low	26.9	Very low	171 Å²	171	148.9 Å²	148.9	90%	0.895	79%	0.791	S	S	*	*			cis	-155.7	153.5	9.5	-170.6	70.9	0	0	0	108.8
679	G	24.6	Very low	26.5	Very low	54 Å²	54	150.1 Å²	150.1	56%	0.557	79%	0.792	S	S	*	*			cis	148.7	144.5	-5.1	0	0	0	0	0	112.3
680	K	25.3	Very low	26.6	Very low	218 Å²	218	151.5 Å²	151.5	95%	0.948	79%	0.791	S	S	*	*			trans	92.3	150.3	-170.4	-60.9	171.3	-176.4	173.5	0	114.7
681	A	24.9	Very low	26.2	Very low	86 Å²	86	151 Å²	151	71%	0.711	79%	0.79	S	S	*	*			cis	-166.2	148.3	-22.4	0	0	0	0	0	114
682	K	24.5	Very low	25.8	Very low	211 Å²	211	151.3 Å²	151.3	92%	0.917	79%	0.787	S	S	*	*			trans	63.3	131.9	155.9	-72.5	-171	176.7	-176.2	0	121.9
683	K	31.9	Very low	25.8	Very low	189 Å²	189	149.2 Å²	149.2	82%	0.822	78%	0.782	S	S	*	*			trans	-77.6	172.8	165.3	-50.6	-179.9	177.8	-172.7	0	111.7
684	P	28.8	Very low	25.8	Very low	130 Å²	130	147.8 Å²	147.8	84%	0.844	78%	0.775	S	S	*	*				-136.8	-173.2	93.6	40.3	-30.9	0	0	0	114.1
685	K	27	Very low	25.9	Very low	153 Å²	153	144.9 Å²	144.9	67%	0.665	77%	0.772	S	S	*	*				167.6	112	-58	-177.5	-174.4	-161.4	-66.7	0	110.4	D687	K685-D687 IonicContact NZ-OD1 3.27Å; K685-D687 PolarHBondContact NZ-OD1 3.46Å; K685-D687 IonicContact NZ-OD2 2.72Å; K685-D687 PolarHBondContact NZ-OD2 2.98Å
686	S	25.5	Very low	26	Very low	115 Å²	115	148.4 Å²	148.4	80%	0.804	77%	0.772	S	S	*	*			trans	-173	107.4	160.9	48	0	0	0	0	107.5
687	D	26.7	Very low	25.7	Very low	112 Å²	112	151.5 Å²	151.5	60%	0.599	78%	0.778	S	S	*	*			cis	80.9	129.2	46.1	-64	-36	0	0	0	114.9	K685	K685-D687 IonicContact NZ-OD1 3.27Å; K685-D687 PolarHBondContact NZ-OD1 3.46Å; K685-D687 IonicContact NZ-OD2 2.72Å; K685-D687 PolarHBondContact NZ-OD2 2.98Å
688	K	26.5	Very low	25.7	Very low	200 Å²	200	153.7 Å²	153.7	87%	0.87	78%	0.776	S	S	*	*			trans	83.4	132.3	-178.8	-53.8	174.6	-177.6	178.7	0	115.2
689	F	26.6	Very low	25.7	Very low	179 Å²	179	154 Å²	154	79%	0.785	77%	0.773	S	S	*	*			cis	98.4	130.9	7.7	-164.7	-124.6	0	0	0	117.2
690	Y	29.9	Very low	25.7	Very low	188 Å²	188	159.3 Å²	159.3	74%	0.737	78%	0.783	S	S	*	*			trans	81.9	136.1	178.9	-98.1	-64.1	0	0	0	120.3
691	S	23.9	Very low	25.6	Very low	101 Å²	101	157.3 Å²	157.3	71%	0.706	78%	0.777	S	S	*	*			trans	61.3	150.7	156.4	46	0	0	0	0	119.3
692	D	24.8	Very low	25.5	Very low	145 Å²	145	156 Å²	156	78%	0.775	77%	0.772	S	S	*	*			cis	-165.2	157.2	-26.1	-117.2	-12.3	0	0	0	108.7
693	D	26.5	Very low	25.3	Very low	141 Å²	141	152 Å²	152	75%	0.754	77%	0.77	S	S	*	*			trans	43.3	155	156.4	-76.1	-31.7	0	0	0	125.2
694	E	25.5	Very low	24.8	Very low	167 Å²	167	146.7 Å²	146.7	78%	0.78	77%	0.769	S	S	*	*			trans	66.3	103.4	154.2	-74	172.8	-167.9	0	0	123.5
695	E	25.7	Very low	24.5	Very low	175 Å²	175	146.6 Å²	146.6	82%	0.818	77%	0.772	S	S	*	*				62.7	159.5	120.1	-60.3	-164.6	151.1	0	0	125.4
696	E	23.4	Very low	24.4	Very low	169 Å²	169	141.9 Å²	141.9	79%	0.79	77%	0.767	S	S	*	*			trans	75.1	117.9	165	-68.6	-176.6	171.5	0	0	124.1
697	E	22.9	Very low	24.4	Very low	163 Å²	163	141.4 Å²	141.4	76%	0.762	76%	0.764	S	S	*	*			trans	59.3	122.1	135.1	-57.6	-165.9	160.1	0	0	126.2
698	E	22.4	Very low	24.3	Very low	161 Å²	161	144.4 Å²	144.4	75%	0.752	77%	0.774	S	S	*	*				55.5	142.7	129.4	-55.2	-159	148.3	0	0	125.7
699	E	23	Very low	24.1	Very low	178 Å²	178	142.1 Å²	142.1	83%	0.832	77%	0.771	S	S	*	*			trans	59.1	159.9	156.6	-71.4	-173.4	-177.9	0	0	120.8
700	E	23.3	Very low	24	Very low	165 Å²	165	141 Å²	141	77%	0.771	77%	0.774	S	S	*	*			cis	-156.4	172.3	-48.1	-138.5	-164.6	-162.8	0	0	109.9
701	E	22.9	Very low	23.7	Very low	175 Å²	175	137.1 Å²	137.1	82%	0.818	77%	0.774	S	S	*	*			trans	64.6	162	156.5	-83.2	-73.9	106.8	0	0	122.5
702	G	23.1	Very low	23.8	Very low	59 Å²	59	137.8 Å²	137.8	61%	0.608	78%	0.779	S	S	*	*			trans	94.3	73.2	163.4	0	0	0	0	0	117.8
703	S	21.5	Very low	23.8	Very low	126 Å²	126	135.5 Å²	135.5	88%	0.881	77%	0.774	S	S	*	*				71.8	136.2	74.4	90.8	0	0	0	0	116.4
704	G	21.9	Very low	23.8	Very low	78 Å²	78	134.1 Å²	134.1	80%	0.804	78%	0.775	S	S	*	*			trans	142.4	107.5	163.4	0	0	0	0	0	118.6
705	S	21.9	Very low	23.8	Very low	128 Å²	128	130.7 Å²	130.7	90%	0.895	77%	0.77	S	S	*	*			trans	-54.9	157	157.9	-175.6	0	0	0	0	112.3
706	G	23.8	Very low	23.7	Very low	54 Å²	54	127.5 Å²	127.5	56%	0.557	77%	0.767	S	S	*	*			cis	149.7	-158.5	7.6	0	0	0	0	0	110
707	S	25.7	Very low	23.7	Very low	106 Å²	106	125 Å²	125	74%	0.741	77%	0.768	S	S	*	*			trans	66.6	147.2	173.6	74.8	0	0	0	0	117.3
708	E	25.3	Very low	23.7	Very low	174 Å²	174	122.4 Å²	122.4	81%	0.813	77%	0.768	S	S	*	*			cis	-161.8	-143.2	-27.3	-123.5	146.5	-114.3	0	0	109.5
709	D	22.3	Very low	23.7	Very low	153 Å²	153	120.6 Å²	120.6	82%	0.818	77%	0.773	S	S	*	*			trans	67.2	97.8	169.5	-53.6	6.3	0	0	0	115.9
710	D	23.6	Very low	23.7	Very low	156 Å²	156	117.1 Å²	117.1	83%	0.834	77%	0.768	S	S	*	*			cis	81.1	118	23	-156.6	11.6	0	0	0	116.9
711	S	23.7	Very low	23.7	Very low	105 Å²	105	115.3 Å²	115.3	73%	0.734	77%	0.774	S	S	*	*			trans	-179.6	91.1	148.1	59.9	0	0	0	0	115.4
712	S	26.2	Very low	23.6	Very low	116 Å²	116	110.8 Å²	110.8	81%	0.811	77%	0.774	S	S	*	*			trans	69.9	160	134.6	84.3	0	0	0	0	120.9
713	S	25.4	Very low	23.4	Very low	97 Å²	97	111.1 Å²	111.1	68%	0.678	78%	0.778	S	S	*	*			cis	-149	122.5	4.8	66.5	0	0	0	0	110.8
714	S	26.5	Very low	23.4	Very low	111 Å²	111	110.5 Å²	110.5	78%	0.776	77%	0.774	S	S	*	*				82	145.8	96.6	86.1	0	0	0	0	115.6
715	S	25	Very low	23.5	Very low	96 Å²	96	111.9 Å²	111.9	67%	0.671	77%	0.771	S	S	*	*			cis	-159.5	165.2	8.8	59.4	0	0	0	0	113.7
716	S	24.8	Very low	23.5	Very low	108 Å²	108	113.5 Å²	113.5	76%	0.755	76%	0.764	S	S	*	*			trans	64.4	145.2	149.9	47.3	0	0	0	0	120
717	S	22.6	Very low	23.4	Very low	117 Å²	117	118.4 Å²	118.4	82%	0.818	77%	0.772	S	S	*	*			cis	-155.7	164.4	-1	42.4	0	0	0	0	113.3
718	S	22.6	Very low	23.2	Very low	107 Å²	107	118 Å²	118	75%	0.748	77%	0.77	S	S	*	*			trans	-65.5	156.7	-179.1	54.7	0	0	0	0	117.1
719	S	22	Very low	23.1	Very low	123 Å²	123	112.7 Å²	112.7	86%	0.86	76%	0.762	S	S	*	*				147.5	166.1	114.2	64.5	0	0	0	0	114.2
720	S	23.9	Very low	23.1	Very low	105 Å²	105	111.5 Å²	111.5	73%	0.734	77%	0.766	S	S	*	*			trans	-99.9	152.8	-169.8	55.6	0	0	0	0	114.1
721	S	22.3	Very low	23	Very low	127 Å²	127	108.2 Å²	108.2	89%	0.888	76%	0.76	S	S	*	*			trans	153.8	178.4	135.2	58.1	0	0	0	0	111.7
722	G	21.4	Very low	23.1	Very low	81 Å²	81	108.7 Å²	108.7	84%	0.835	76%	0.763	S	S	*	*			trans	100.9	141.9	164.3	0	0	0	0	0	114.3
723	G	19.3	Very low	23	Very low	66 Å²	66	111 Å²	111	68%	0.68	76%	0.761	S	S	*	*			trans	-144.6	-179.7	170.9	0	0	0	0	0	110.6
724	S	21.7	Very low	22.9	Very low	113 Å²	113	114.5 Å²	114.5	79%	0.79	77%	0.767	S	S	*	*			trans	74.2	118.9	167.4	-51	0	0	0	0	118.3
725	S	23.1	Very low	22.8	Very low	107 Å²	107	116.1 Å²	116.1	75%	0.748	76%	0.762	S	S	*	*			trans	63.6	159.9	132.4	66.9	0	0	0	0	119
726	E	22.3	Very low	22.7	Very low	162 Å²	162	115.6 Å²	115.6	76%	0.757	76%	0.758	S	S	*	*			cis	-143	-167.8	22	-70.4	179.2	132.9	0	0	112.1
727	E	21.9	Very low	22.7	Very low	156 Å²	156	115.9 Å²	115.9	73%	0.729	76%	0.761	S	S	*	*			trans	71.6	147.3	157.9	-58.4	-45.6	86.7	0	0	121.8
728	S	21	Very low	22.7	Very low	98 Å²	98	114.2 Å²	114.2	69%	0.685	76%	0.762	S	S	*	*			cis	-174.8	161.9	-33.4	-115.9	0	0	0	0	111.5
729	G	23	Very low	22.8	Very low	63 Å²	63	112.4 Å²	112.4	65%	0.649	76%	0.76	S	S	*	*			trans	92.8	127.1	166	0	0	0	0	0	115.1
730	S	21.8	Very low	23	Very low	128 Å²	128	112 Å²	112	90%	0.895	76%	0.757	S	S	*	*				89.1	134.4	50.7	-74.5	0	0	0	0	112.8
731	A	23.3	Very low	23	Very low	86 Å²	86	113.4 Å²	113.4	71%	0.711	75%	0.752	S	S	*	*			cis	-164.5	-161.4	-6	0	0	0	0	0	110
732	S	24.3	Very low	23.1	Very low	116 Å²	116	114.9 Å²	114.9	81%	0.811	74%	0.743	S	S	*	*			trans	88.4	135	165.1	73.1	0	0	0	0	119.4
733	E	25.1	Very low	23.1	Very low	164 Å²	164	116.7 Å²	116.7	77%	0.766	74%	0.738	S	S	*	*			cis	-177.6	168.1	-34.4	-108.6	-76.8	-166.7	0	0	108.7
734	E	23.8	Very low	23.4	Very low	170 Å²	170	118.5 Å²	118.5	79%	0.794	74%	0.74	S	S	*	*			trans	62.4	143	160.6	-72.8	-160.9	-135.6	0	0	121.7
735	E	22.9	Very low	23.5	Very low	146 Å²	146	118.7 Å²	118.7	68%	0.682	74%	0.741	S	S	*	*			cis	-169.2	167.2	-25.7	-127.2	-63.7	109.7	0	0	111.1
736	S	22.7	Very low	23.4	Very low	84 Å²	84	121.1 Å²	121.1	59%	0.587	75%	0.746	S	S	*	*			trans	65.3	124.3	156.7	-88	0	0	0	0	120.8
737	S	24.6	Very low	23.6	Very low	115 Å²	115	118.5 Å²	118.5	80%	0.804	75%	0.746	S	S	*	*			cis	89.3	145.9	46.4	88.9	0	0	0	0	113.2
738	G	24.5	Very low	23.7	Very low	81 Å²	81	114.7 Å²	114.7	84%	0.835	75%	0.748	S	S	*	*			cis	-160.2	-169	-5.4	0	0	0	0	0	109
739	G	24.5	Very low	23.8	Very low	69 Å²	69	119.6 Å²	119.6	71%	0.711	76%	0.757	S	S	*	*			cis	167.4	-177.7	-0.7	0	0	0	0	0	111.1
740	S	25.4	Very low	23.8	Very low	116 Å²	116	121.1 Å²	121.1	81%	0.811	76%	0.758	S	S	*	*			trans	75.9	145.2	157.4	-56.6	0	0	0	0	120.4
741	E	23.5	Very low	23.8	Very low	134 Å²	134	120.4 Å²	120.4	63%	0.626	75%	0.753	S	S	*	*			cis	-170.9	162.2	-10	-116.6	-171.1	141.8	0	0	114.2
742	K	24.2	Very low	23.7	Very low	157 Å²	157	122.5 Å²	122.5	68%	0.683	76%	0.762	S	S	*	*			trans	67.1	156.3	147.6	-70.6	167.1	174	140.7	0	119.1
743	T	23	Very low	23.6	Very low	119 Å²	119	120 Å²	120	73%	0.73	76%	0.755	S	S	*	*			cis	-174.9	165.5	-9.7	29.1	0	0	0	0	107.5
744	S	23.9	Very low	23.5	Very low	104 Å²	104	117.8 Å²	117.8	73%	0.727	76%	0.757	S	S	*	*			cis	160.8	116.5	-28.6	60.9	0	0	0	0	109.6
745	S	23.8	Very low	23.3	Very low	117 Å²	117	118.1 Å²	118.1	82%	0.818	76%	0.759	S	S	*	*			trans	-175.4	136.2	160.1	48.4	0	0	0	0	107.7
746	D	22.9	Very low	23.2	Very low	158 Å²	158	117.3 Å²	117.3	85%	0.845	76%	0.763	S	S	*	*			cis	76.4	127.8	30.8	-154.1	45.8	0	0	0	113.5
747	S	25.7	Very low	23.1	Very low	108 Å²	108	118.2 Å²	118.2	76%	0.755	77%	0.77	S	S	*	*			cis	-149.2	169.1	21.8	55.2	0	0	0	0	114.2
748	G	23.4	Very low	23	Very low	75 Å²	75	117.2 Å²	117.2	77%	0.773	76%	0.763	S	S	*	*			trans	-171.3	19.7	-173.2	0	0	0	0	0	124.9
749	K	23.8	Very low	22.7	Very low	202 Å²	202	118.5 Å²	118.5	88%	0.878	76%	0.759	S	S	*	*			trans	55.3	103.9	164.1	-84.6	-170.9	173.4	-178.2	0	123.1
750	S	21.8	Very low	22.5	Very low	95 Å²	95	123.2 Å²	123.2	66%	0.664	76%	0.762	S	S	*	*				44.9	101.6	118.8	66.7	0	0	0	0	124.2
751	S	23.6	Very low	22.3	Very low	113 Å²	113	122 Å²	122	79%	0.79	75%	0.754	S	S	*	*				31	122.3	120.5	63.1	0	0	0	0	124.4
752	S	21.1	Very low	22.2	Very low	130 Å²	130	123.4 Å²	123.4	91%	0.909	76%	0.761	S	S	*	*			trans	171	161.9	130.5	47.7	0	0	0	0	109.3
753	G	22.3	Very low	22	Very low	64 Å²	64	119 Å²	119	66%	0.66	75%	0.75	S	S	*	*			cis	170	134.7	-11	0	0	0	0	0	111.4
754	S	21.9	Very low	21.9	Very low	117 Å²	117	121.7 Å²	121.7	82%	0.818	75%	0.751	S	S	*	*			trans	49	145.1	156.8	59.6	0	0	0	0	123.8
755	E	20.4	Very low	21.8	Very low	176 Å²	176	123.9 Å²	123.9	82%	0.822	75%	0.75	S	S	*	*			trans	93.5	115.8	153.5	-48.5	-145.4	140.6	0	0	122.3
756	V	21.2	Very low	21.6	Very low	129 Å²	129	127.1 Å²	127.1	78%	0.782	75%	0.749	S	S	*	*				49.6	146.5	124	-168.3	0	0	0	0	122.2
757	S	20.6	Very low	21.6	Very low	104 Å²	104	127.6 Å²	127.6	73%	0.727	74%	0.744	S	S	*	*			trans	-59.1	168.3	175	62.2	0	0	0	0	115.4
758	S	20.8	Very low	21.5	Very low	93 Å²	93	128.2 Å²	128.2	65%	0.65	73%	0.733	S	S	*	*			cis	-170.2	166.3	36.4	59.2	0	0	0	0	114.6
759	S	19.8	Very low	21.4	Very low	108 Å²	108	134.1 Å²	134.1	76%	0.755	74%	0.737	S	S	*	*			trans	66.8	148	147.1	71.5	0	0	0	0	118.9
760	E	20	Very low	21.3	Very low	168 Å²	168	131.7 Å²	131.7	79%	0.785	73%	0.733	S	S	*	*			cis	-150.4	172.7	2.8	-102.4	-123	140.3	0	0	110.2
761	S	20.1	Very low	21.3	Very low	91 Å²	91	131.9 Å²	131.9	64%	0.636	73%	0.73	S	S	*	*			trans	21.3	145.3	137.2	-47.3	0	0	0	0	121.1
762	E	21.1	Very low	21.2	Very low	164 Å²	164	135.1 Å²	135.1	77%	0.766	73%	0.73	S	S	*	*			cis	-165.2	174.8	13	-142.2	-147.7	-166.1	0	0	113.9
763	S	20.8	Very low	21.2	Very low	64 Å²	64	139 Å²	139	45%	0.448	73%	0.731	S	S	.	*			trans	-9.3	126.8	166.8	72.3	0	0	0	0	121.7
764	K	21.6	Very low	21.1	Very low	175 Å²	175	140.7 Å²	140.7	76%	0.761	74%	0.739	S	S	*	*				166.4	137.7	112.8	-86.8	157.9	-158.7	82.9	0	117.5
765	Q	20.3	Very low	21	Very low	151 Å²	151	141.6 Å²	141.6	71%	0.706	74%	0.739	S	S	*	*			trans	17.4	116.4	135.8	-67	-171.2	7.8	0	0	122.2
766	K	20.8	Very low	21.2	Very low	184 Å²	184	138.4 Å²	138.4	80%	0.8	73%	0.734	S	S	*	*				50.8	107.8	109.3	-176.7	-174	-168.4	168.3	0	118.5
767	K	22.8	Very low	21.1	Very low	169 Å²	169	143.1 Å²	143.1	74%	0.735	74%	0.738	S	S	*	*			trans	167.3	156.3	158.7	-93.6	142.9	-138.3	146.3	0	109.7
768	K	22.5	Very low	21	Very low	121 Å²	121	147.8 Å²	147.8	53%	0.526	75%	0.745	S	S	.	*			cis	-172.7	147.1	-15.5	-126.1	-173.6	-171.1	178.5	0	111.5
769	K	22.7	Very low	21.1	Very low	199 Å²	199	147.9 Å²	147.9	87%	0.865	75%	0.745	S	S	*	*	S	Bend		-169.1	135.3	123.6	-102.9	173.9	-178.4	178.2	0	106.8
770	L	21.4	Very low	21.2	Very low	151 Å²	151	152 Å²	152	79%	0.791	75%	0.749	S	S	*	*	S	Bend	cis	-113.9	166	-0.2	-84.5	96.8	0	0	0	114.6
771	T	22.1	Very low	21.4	Very low	99 Å²	99	152.2 Å²	152.2	61%	0.607	75%	0.751	S	S	*	*			trans	-48.1	142.5	176.2	36.5	0	0	0	0	116.2
772	K	20.3	Very low	21.5	Very low	180 Å²	180	153 Å²	153	78%	0.783	75%	0.752	S	S	*	*			cis	89.4	120.8	49.5	-149.2	-158.1	-169.1	-161.1	0	113.1
773	K	21.8	Very low	21.6	Very low	212 Å²	212	149.6 Å²	149.6	92%	0.922	75%	0.752	S	S	*	*			trans	-39.7	142.4	174	-82.5	-178.3	169.7	-179.2	0	115.6
774	A	20.3	Very low	21.7	Very low	100 Å²	100	150.1 Å²	150.1	83%	0.826	76%	0.76	S	S	*	*			trans	-153.2	145.8	137.5	0	0	0	0	0	111.4
775	T	19.6	Very low	21.8	Very low	135 Å²	135	148.9 Å²	148.9	83%	0.828	76%	0.762	S	S	*	*			trans	-91.3	177	161	49.4	0	0	0	0	108.8
776	P	24.2	Very low	22	Very low	109 Å²	109	146.2 Å²	146.2	71%	0.708	76%	0.76	S	S	*	*			cis	-147.5	-172.3	17.5	45.3	-24.5	0	0	0	117.8
777	R	19.2	Very low	22.2	Very low	229 Å²	229	144.1 Å²	144.1	86%	0.864	76%	0.757	S	S	*	*			trans	14.9	137.3	145.2	-66.8	175.4	168.7	175.6	-4.6	121.5
778	K	19.8	Very low	22.3	Very low	202 Å²	202	140.7 Å²	140.7	88%	0.878	75%	0.754	S	S	*	*			trans	72.7	143.9	157.2	-71.3	-174.2	176.6	-175.1	0	116.9
779	S	20.9	Very low	22.4	Very low	95 Å²	95	142 Å²	142	66%	0.664	77%	0.767	S	S	*	*			cis	-173.4	143.2	-11.9	48.2	0	0	0	0	114.1
780	K	23	Very low	22.4	Very low	193 Å²	193	140.5 Å²	140.5	84%	0.839	76%	0.763	S	S	*	*			trans	62.6	159.2	162.1	-69.3	-171.3	169.3	-172.8	0	115.5
781	Q	23.8	Very low	22.4	Very low	173 Å²	173	140.2 Å²	140.2	81%	0.808	76%	0.763	S	S	*	*			cis	-127.8	125.2	21.4	-98.6	167.8	-57	0	0	110.9
782	T	22	Very low	22.5	Very low	107 Å²	107	139 Å²	139	66%	0.656	77%	0.77	S	S	*	*				69.2	142.8	92.6	59.3	0	0	0	0	114.9
783	A	23.6	Very low	23	Very low	94 Å²	94	138.5 Å²	138.5	78%	0.777	78%	0.776	S	S	*	*			cis	-169	168.6	3.8	0	0	0	0	0	109
784	A	22.8	Very low	23.3	Very low	74 Å²	74	131.5 Å²	131.5	61%	0.612	76%	0.764	S	S	*	*			cis	-168.9	178.6	-19.8	0	0	0	0	0	108.8
785	D	23.1	Very low	24.5	Very low	150 Å²	150	132.4 Å²	132.4	80%	0.802	76%	0.761	S	S	*	*			trans	69.9	137.4	163.2	-47.5	-36.5	0	0	0	115.8
786	S	25	Very low	24.8	Very low	95 Å²	95	133 Å²	133	66%	0.664	76%	0.764	S	S	*	*				67.8	129.2	56.8	-94.3	0	0	0	0	112.1
787	D	25.8	Very low	25	Very low	139 Å²	139	131.5 Å²	131.5	74%	0.743	77%	0.769	S	S	*	*			cis	-143.8	-156.7	11.4	-81.9	-48.9	0	0	0	111.4
788	S	25.4	Very low	25.2	Very low	97 Å²	97	130.2 Å²	130.2	68%	0.678	77%	0.769	S	S	*	*			trans	75.2	122.7	151.8	57.2	0	0	0	0	120.5
789	D	23	Very low	25.4	Very low	148 Å²	148	127.3 Å²	127.3	79%	0.791	77%	0.769	S	S	*	*				39	148	109.6	-47.5	-60.3	0	0	0	122.2
790	E	22.7	Very low	25.5	Very low	168 Å²	168	128.4 Å²	128.4	79%	0.785	78%	0.776	S	S	*	*			trans	71.1	133.8	152.8	-76.4	-161.4	-159.6	0	0	123.1
791	N	22.2	Very low	25.6	Very low	145 Å²	145	124 Å²	124	78%	0.775	77%	0.77	S	S	*	*			trans	47	126.7	134.5	-63.3	-41.1	0	0	0	122.9
792	G	24.8	Very low	25.6	Very low	74 Å²	74	120.6 Å²	120.6	76%	0.763	77%	0.765	S	S	*	*			trans	127.4	83	152.2	0	0	0	0	0	115.2
793	N	29.9	Very low	25.7	Very low	169 Å²	169	120.9 Å²	120.9	90%	0.904	77%	0.771	S	S	*	*				59.4	111.8	83.3	-168.6	29.2	0	0	0	113.5
794	G	28.6	Very low	25.7	Very low	65 Å²	65	120.3 Å²	120.3	67%	0.67	77%	0.767	S	S	*	*			cis	167.6	-164.5	3.6	0	0	0	0	0	108.8
795	P	44.4	Very low	25.6	Very low	119 Å²	119	124.9 Å²	124.9	77%	0.773	78%	0.775	S	S	*	*			cis	-133.2	-156.7	-13.1	37	-15.2	0	0	0	112.8
796	V	27.7	Very low	25.6	Very low	148 Å²	148	122.6 Å²	122.6	90%	0.897	77%	0.771	S	S	*	*			trans	84.2	106.9	168.7	-165.3	0	0	0	0	117.9
797	G	26.9	Very low	25.4	Very low	77 Å²	77	124.3 Å²	124.3	79%	0.794	78%	0.783	S	S	*	*			trans	155.7	113.9	166.5	0	0	0	0	0	112.2
798	K	24.8	Very low	25.2	Very low	202 Å²	202	122.1 Å²	122.1	88%	0.878	78%	0.779	S	S	*	*			trans	-97.8	141.2	-174.4	-65	-177.9	177.7	-177.8	0	112.8
799	T	23.8	Very low	25	Very low	142 Å²	142	124.5 Å²	124.5	87%	0.871	78%	0.784	S	S	*	*				157.1	131.8	120.5	40.2	0	0	0	0	113.7
800	S	23	Very low	25	Very low	117 Å²	117	121.5 Å²	121.5	82%	0.818	78%	0.775	S	S	*	*			trans	-164.1	135.1	164.8	47.3	0	0	0	0	115.6
801	S	24.3	Very low	25.1	Very low	101 Å²	101	122 Å²	122	71%	0.706	78%	0.777	S	S	*	*			trans	18.1	127.7	147.8	62.2	0	0	0	0	126
802	S	24	Very low	25.1	Very low	101 Å²	101	119.3 Å²	119.3	71%	0.706	77%	0.77	S	S	*	*				67.2	123.9	124.1	69.9	0	0	0	0	124.7
803	S	23.5	Very low	25.1	Very low	113 Å²	113	122 Å²	122	79%	0.79	77%	0.766	S	S	*	*			trans	21.2	133.5	138.8	58.4	0	0	0	0	120.6
804	A	23.7	Very low	24.8	Very low	82 Å²	82	118.3 Å²	118.3	68%	0.678	75%	0.754	S	S	*	*			cis	-166.7	-160.8	2.3	0	0	0	0	0	108.6
805	E	22	Very low	24.6	Very low	170 Å²	170	122.6 Å²	122.6	79%	0.794	76%	0.757	S	S	*	*			cis	-156.7	177.4	13.5	-118.5	-33.4	133.3	0	0	111.4
806	S	22.7	Very low	23.6	Very low	103 Å²	103	124.3 Å²	124.3	72%	0.72	75%	0.754	S	S	*	*			trans	-13.8	124	176.3	69.1	0	0	0	0	122.8
807	S	20.9	Very low	23.4	Very low	130 Å²	130	123.9 Å²	123.9	91%	0.909	75%	0.747	S	S	*	*			trans	-156.4	175.4	137.6	60.8	0	0	0	0	110.5
808	S	21.6	Very low	23.4	Very low	94 Å²	94	124.7 Å²	124.7	66%	0.657	74%	0.74	S	S	*	*			trans	-121.1	165.3	-163	-169.4	0	0	0	0	113.9
809	D	21.4	Very low	23.3	Very low	147 Å²	147	122.5 Å²	122.5	79%	0.786	74%	0.738	S	S	*	*			trans	69.8	140.9	162.8	-57.7	-62.7	0	0	0	116.5
810	S	22.3	Very low	23.3	Very low	85 Å²	85	120.8 Å²	120.8	59%	0.594	73%	0.732	S	S	*	*			cis	-153.6	-170.7	-1.5	-78.8	0	0	0	0	110
811	E	24.1	Very low	23.1	Very low	178 Å²	178	122.2 Å²	122.2	83%	0.832	73%	0.731	S	S	*	*			trans	68.9	153.1	165.4	-43	-56.3	98	0	0	117
812	S	23.8	Very low	23	Very low	89 Å²	89	122.1 Å²	122.1	62%	0.622	73%	0.73	S	S	*	*			cis	-165.6	170.5	-33.1	83.8	0	0	0	0	106.2
813	D	24.8	Very low	23.3	Very low	130 Å²	130	123.2 Å²	123.2	70%	0.695	73%	0.734	S	S	*	*			cis	-141.3	154.2	-1.5	-96	-51	0	0	0	107.5
814	S	22.9	Very low	23.2	Very low	91 Å²	91	121.9 Å²	121.9	64%	0.636	73%	0.731	S	S	*	*				69.9	124.6	56.3	-31.9	0	0	0	0	111.7
815	E	24.3	Very low	23.8	Very low	156 Å²	156	122.7 Å²	122.7	73%	0.729	73%	0.729	S	S	*	*			cis	-150.1	178.3	-3.9	-55.3	-170	116.9	0	0	110.2
816	E	23.3	Very low	23.8	Very low	155 Å²	155	121.8 Å²	121.8	72%	0.724	73%	0.725	S	S	*	*				37.9	158.5	126.8	-68.7	170.8	-172.9	0	0	122.7
817	D	23.8	Very low	23.8	Very low	139 Å²	139	124 Å²	124	74%	0.743	72%	0.721	S	S	*	*			cis	-151.1	-176.3	0.1	-142.6	-23	0	0	0	113.7
818	S	25.8	Very low	23.8	Very low	94 Å²	94	126.6 Å²	126.6	66%	0.657	72%	0.716	S	S	*	*			trans	-75	150.5	162.6	-46.7	0	0	0	0	112.1
819	D	23.3	Very low	23.8	Very low	156 Å²	156	127.8 Å²	127.8	83%	0.834	72%	0.72	S	S	*	*				171.4	164.8	108.5	-118.8	-26.4	0	0	0	115.9
820	S	23.4	Very low	23.8	Very low	105 Å²	105	127.3 Å²	127.3	73%	0.734	72%	0.722	S	S	*	*			trans	69.8	99.6	153.7	66.4	0	0	0	0	122.5
821	D	19.9	Very low	23.8	Very low	148 Å²	148	127 Å²	127	79%	0.791	72%	0.724	S	S	*	*				61.2	119.9	114	-156.6	15	0	0	0	123.8
822	S	22	Very low	23.6	Very low	99 Å²	99	128 Å²	128	69%	0.692	73%	0.726	S	S	*	*			trans	66.6	162	148.2	-79.1	0	0	0	0	121.6
823	P	30.3	Very low	23.5	Very low	123 Å²	123	130.2 Å²	130.2	80%	0.799	74%	0.736	S	S	*	*			cis	-126.3	-173.5	-15.1	36.9	-19	0	0	0	114.3
824	A	21.3	Very low	23.3	Very low	86 Å²	86	133.4 Å²	133.4	71%	0.711	74%	0.744	S	S	*	*			trans	-77.7	-167.4	167.9	0	0	0	0	0	111.6
825	P	35.1	Very low	23.2	Very low	99 Å²	99	135.1 Å²	135.1	64%	0.643	75%	0.752	S	S	*	*			cis	-148.8	168.7	4.7	44.7	-25.1	0	0	0	119.3
826	Q	23.7	Very low	23	Very low	151 Å²	151	136 Å²	136	71%	0.706	75%	0.754	S	S	*	*			trans	64	164	140.2	-72.6	168.9	39	0	0	119.6
827	K	22	Very low	23	Very low	150 Å²	150	135.4 Å²	135.4	65%	0.652	76%	0.76	S	S	*	*			cis	-164.9	159.7	0.4	-125.1	165.1	-173.5	154.3	0	111.7
828	K	21.6	Very low	22.9	Very low	184 Å²	184	135.6 Å²	135.6	80%	0.8	76%	0.757	S	S	*	*			trans	67.8	157.8	151.1	-70.7	171.6	177.6	-177.6	0	117.8
829	T	21.1	Very low	22.8	Very low	119 Å²	119	136.6 Å²	136.6	73%	0.73	76%	0.759	S	S	*	*			cis	-134.9	150.4	-2.1	37.8	0	0	0	0	108.9
830	V	22	Very low	22.8	Very low	137 Å²	137	138.5 Å²	138.5	83%	0.83	76%	0.759	S	S	*	*				64.8	129.9	55.2	-176.4	0	0	0	0	112.3
831	A	21.1	Very low	22.8	Very low	78 Å²	78	138.3 Å²	138.3	65%	0.645	76%	0.758	S	S	*	*			cis	-140.6	167.6	13.4	0	0	0	0	0	112.6
832	K	20.8	Very low	22.9	Very low	198 Å²	198	140.4 Å²	140.4	86%	0.861	76%	0.76	S	S	*	*				44.8	143.9	97.2	-50.7	-177	177.2	178.8	0	115.7
833	T	20.5	Very low	23	Very low	136 Å²	136	144.3 Å²	144.3	83%	0.834	76%	0.764	S	S	*	*			cis	-151.1	169.4	33.9	38.7	0	0	0	0	115.3
834	K	20.6	Very low	22.7	Very low	198 Å²	198	145.1 Å²	145.1	86%	0.861	76%	0.758	S	S	*	*			trans	-91.6	170.8	167.1	-55.3	-179.6	179.6	-176.1	0	112.9
835	P	22.4	Very low	22.9	Very low	126 Å²	126	147.6 Å²	147.6	82%	0.818	76%	0.764	S	S	*	*			trans	-116.1	169.4	141.9	36.1	-28.3	0	0	0	114.1
836	K	19.2	Very low	22.3	Very low	176 Å²	176	148.4 Å²	148.4	77%	0.765	77%	0.772	S	S	*	*			trans	-102	178	168.3	-69.1	-175.7	159.6	-165.7	0	110.3	E838	K836-E838 IonicContact NZ-OE1 2.78Å
837	V	24.3	Very low	22.5	Very low	141 Å²	141	148.7 Å²	148.7	86%	0.855	78%	0.777	S	S	*	*				-157.8	172	77.5	163.1	0	0	0	0	111.1
838	E	20.7	Very low	22.8	Very low	144 Å²	144	149 Å²	149	67%	0.673	79%	0.785	S	S	*	*			trans	-86.4	176.9	-163.1	-62.5	163.1	-175.8	0	0	113.4	K836	K836-E838 IonicContact NZ-OE1 2.78Å
839	V	23.6	Very low	23	Very low	115 Å²	115	147.5 Å²	147.5	70%	0.697	79%	0.786	S	S	*	*				-171.2	131.2	59.8	165.4	0	0	0	0	113.2
840	K	23.5	Very low	23.3	Very low	196 Å²	196	148.6 Å²	148.6	85%	0.852	79%	0.787	S	S	*	*			trans	49.2	149.5	150	-67.9	171	-172.4	171.7	0	121.6
841	S	22.9	Very low	23.5	Very low	100 Å²	100	148.4 Å²	148.4	70%	0.699	78%	0.781	S	S	*	*			cis	-171.4	161.1	-3	50.3	0	0	0	0	114.6
842	K	22.6	Very low	23.6	Very low	193 Å²	193	152.6 Å²	152.6	84%	0.839	79%	0.792	S	S	*	*			trans	73.7	115.9	163.5	-70.6	178.2	-180	179.9	0	116.9
843	K	24	Very low	23.8	Very low	180 Å²	180	151 Å²	151	78%	0.783	79%	0.786	S	S	*	*				79	129.1	87.6	-110.4	-155.2	167.4	-156.8	0	112.1
844	E	24.1	Very low	24	Very low	141 Å²	141	150.1 Å²	150.1	66%	0.659	79%	0.785	S	S	*	*			cis	-142.4	146	14	-78.2	-179.1	159.2	0	0	115.3
845	V	25.1	Very low	24.4	Very low	138 Å²	138	145.7 Å²	145.7	84%	0.836	78%	0.777	S	S	*	*			trans	39	128.8	139.2	-167.5	0	0	0	0	122
846	S	23.8	Very low	24.7	Very low	116 Å²	116	143.9 Å²	143.9	81%	0.811	77%	0.772	S	S	*	*			trans	-128.4	175.8	172.8	-65.1	0	0	0	0	113
847	L	26	Very low	25.1	Very low	156 Å²	156	141.1 Å²	141.1	82%	0.817	77%	0.772	S	S	*	*			trans	-64.8	148.3	-177.6	-92.5	75.1	0	0	0	115.8
848	L	30.1	Very low	25.3	Very low	158 Å²	158	140.5 Å²	140.5	83%	0.827	77%	0.771	S	S	*	*			trans	26.6	121.9	141.3	-55.5	176.8	0	0	0	120.1
849	D	24.9	Very low	25.6	Very low	152 Å²	152	139.1 Å²	139.1	81%	0.813	78%	0.777	S	S	*	*				-148.5	-174.8	109.3	-144.7	-22.2	0	0	0	110.5
850	L	27.8	Very low	25.8	Very low	142 Å²	142	137.5 Å²	137.5	74%	0.743	78%	0.776	S	S	*	*			trans	-86.9	167.9	-154.2	-76.2	161.6	0	0	0	119.4
851	D	26.3	Very low	26	Very low	132 Å²	132	134.3 Å²	134.3	71%	0.706	78%	0.776	S	S	*	*			trans	60.9	109.9	155.7	-62.2	-30.3	0	0	0	121.6
852	D	23	Very low	26.1	Very low	166 Å²	166	139.3 Å²	139.3	89%	0.888	79%	0.785	S	S	*	*				-148.1	147.2	121.6	-155	-9.5	0	0	0	110.6
853	F	24.9	Very low	26.3	Very low	165 Å²	165	134.6 Å²	134.6	72%	0.724	78%	0.776	S	S	*	*			trans	-113.1	123.3	-171.1	-107.2	-100	0	0	0	112.1	P855	F853-P855 HydrophobicContact CD1-CG 4.06Å
854	S	23.4	Very low	26.6	Very low	117 Å²	117	130.4 Å²	130.4	82%	0.818	77%	0.77	S	S	*	*			trans	-150.1	83.5	160	45.1	0	0	0	0	112.8
855	P	29.5	Very low	26.9	Very low	106 Å²	106	129.8 Å²	129.8	69%	0.688	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-66.7	133.4	168.2	-14.7	30.4	0	0	0	110.2	F853	F853-P855 HydrophobicContact CD1-CG 4.06Å
856	A	28.6	Very low	27.1	Very low	88 Å²	88	130.7 Å²	130.7	73%	0.727	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-61.4	149.2	170.2	0	0	0	0	0	110.9
857	P	28.6	Very low	27.3	Very low	117 Å²	117	128 Å²	128	76%	0.76	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-59.3	139.2	-174.6	22.7	-34.1	0	0	0	111.9	S859	P857-S859 PolarHBondContact O-N 3.45Å
858	P	28.6	Very low	27.8	Very low	129 Å²	129	125 Å²	125	84%	0.838	74%	0.741	S	S	*	*			trans	-66.9	110.7	-176	26.8	-34.1	0	0	0	110.7	A860	P858-A860 PolarHBondContact O-N 2.92Å; P858-A860 VanDerWaalsContact O-N 3.13Å
859	S	27.3	Very low	28.1	Very low	114 Å²	114	119.7 Å²	119.7	80%	0.797	72%	0.717	S	S	*	*			trans	-62.6	116	174.6	61.3	0	0	0	0	110	P857	P857-S859 PolarHBondContact O-N 3.45Å
860	A	27.3	Very low	28.8	Very low	81 Å²	81	116.3 Å²	116.3	67%	0.669	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-54	142.3	-179.5	0	0	0	0	0	112.1	P858 K862	P858-A860 PolarHBondContact O-N 2.92Å; P858-A860 VanDerWaalsContact O-N 3.13Å; A860-K862 PolarHBondContact O-N 3.16Å; A860-K862 VanDerWaalsContact O-N 3.12Å
861	P	26.6	Very low	29.3	Very low	130 Å²	130	113 Å²	113	84%	0.844	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-63.1	116.9	178.7	26.3	-33.6	0	0	0	109.8	S863	P861-S863 PolarHBondContact O-N 3.11Å
862	K	26.6	Very low	30	Very low	204 Å²	204	110.5 Å²	110.5	89%	0.887	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-67.4	133.2	176.5	-68.4	179.4	178.7	176.5	0	109.4	A860 S864	A860-K862 PolarHBondContact O-N 3.16Å; A860-K862 VanDerWaalsContact O-N 3.12Å; K862-S864 PolarHBondContact O-N 3.26Å
863	S	26.6	Very low	30.5	Very low	94 Å²	94	107.2 Å²	107.2	66%	0.657	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-60.7	130.7	-178	44	0	0	0	0	111.9	P861 V865	P861-S863 PolarHBondContact O-N 3.11Å; S863-V865 VanDerWaalsContact C-N 3.34Å; S863-V865 PolarHBondContact O-N 3.13Å
864	S	28.6	Very low	31.1	Very low	93 Å²	93	104.1 Å²	104.1	65%	0.65	65%	0.647	S	S	*	*			trans	-74.7	86.6	171.4	55.2	0	0	0	0	109.8	K862 F866	K862-S864 PolarHBondContact O-N 3.26Å; S864-F866 WeakPolarHBondContact O-CD2 3.38Å; S864-F866 PolarHBondContact O-N 3.17Å
865	V	32.1	Very low	31.9	Very low	127 Å²	127	106.3 Å²	106.3	77%	0.77	64%	0.644	S	S	*	*			trans	-67.9	101.7	171.1	-177.9	0	0	0	0	108.6	S863 S867	S863-V865 VanDerWaalsContact C-N 3.34Å; S863-V865 PolarHBondContact O-N 3.13Å; V865-S867 PolarHBondContact O-N 3.3Å
866	F	28.6	Very low	32.2	Very low	158 Å²	158	104.4 Å²	104.4	69%	0.693	65%	0.645	S	S	*	*			trans	-65.2	127.2	170.2	-68.6	-82.4	0	0	0	109.5	S864 L870	S864-F866 WeakPolarHBondContact O-CD2 3.38Å; S864-F866 PolarHBondContact O-N 3.17Å; F866-L870 HydrophobicContact CD1-CD1 4.23Å
867	S	28.1	Very low	32.5	Very low	60 Å²	60	106.2 Å²	106.2	42%	0.42	64%	0.641	S	S	.	*			trans	-71.2	144.5	174.9	52	0	0	0	0	110.8	V865 S869 L870	V865-S867 PolarHBondContact O-N 3.3Å; S867-S869 PolarHBondContact O-N 2.7Å; S867-S869 VanDerWaalsContact O-N 3.1Å; S867-L870 PolarHBondContact O-N 2.78Å; S867-L870 VanDerWaalsContact O-N 3.08Å
868	S	35.5	Very low	32.5	Very low	92 Å²	92	106.1 Å²	106.1	64%	0.643	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-29.7	179.5	46.8	0	0	0	0	113.6	L870 L871	S868-L870 PolarHBondContact O-N 3.41Å; S868-L871 WeakPolarHBondContact O-CB 3.48Å; S868-L871 PolarHBondContact O-N 3.34Å
869	S	37.5	Very low	32.5	Very low	47 Å²	47	106.5 Å²	106.5	33%	0.329	64%	0.638	S	S	.	*	H	α-helix	trans	-54.5	-33.9	176.2	-44.2	0	0	0	0	113.8	S867 L871 S872 D873	S867-S869 PolarHBondContact O-N 2.7Å; S867-S869 VanDerWaalsContact O-N 3.1Å; S869-L871 VanDerWaalsContact C-N 3.28Å; S869-L871 PolarHBondContact O-N 3.07Å; S869-S872 PolarHBondContact O-N 3.35Å; S869-D873 PolarHBondContact O-N 3.32Å
870	L	38.4	Very low	32.6	Very low	80 Å²	80	105.8 Å²	105.8	42%	0.419	63%	0.633	S	S	.	*	H	α-helix	trans	-75.8	-15.3	-179.1	-70.2	173.1	0	0	0	113.4	F866 S867 S868 L874	F866-L870 HydrophobicContact CD1-CD1 4.23Å; S867-L870 PolarHBondContact O-N 2.78Å; S867-L870 VanDerWaalsContact O-N 3.08Å; S868-L870 PolarHBondContact O-N 3.41Å; L870-L874 WeakPolarHBondContact O-CD1 3.45Å; L870-L874 WeakPolarHBondContact O-CG 3.48Å
871	L	38.8	Very low	32.8	Very low	72 Å²	72	109.4 Å²	109.4	38%	0.377	64%	0.641	S	S	.	*	H	α-helix	trans	-76.3	-42.3	172.1	-70.5	166	0	0	0	110.2	S868 S869 D873 L874 E875	S868-L871 WeakPolarHBondContact O-CB 3.48Å; S868-L871 PolarHBondContact O-N 3.34Å; S869-L871 VanDerWaalsContact C-N 3.28Å; S869-L871 PolarHBondContact O-N 3.07Å; L871-D873 PolarHBondContact O-N 3.43Å; L871-L874 PolarHBondContact O-N 3.33Å; L871-E875 PolarHBondContact O-N 2.89Å; L871-E875 VanDerWaalsContact O-N 3.14Å
872	S	40.5	Very low	32.8	Very low	80 Å²	80	109.8 Å²	109.8	56%	0.559	64%	0.64	S	S	*	*	H	α-helix	trans	-63	-38.8	176.1	-54.8	0	0	0	0	112.8	S869 L874 E875	S869-S872 PolarHBondContact O-N 3.35Å; S872-L874 PolarHBondContact O-N 3.45Å; S872-E875 PolarHBondContact O-N 3.31Å
873	D	33.8	Very low	32.8	Very low	97 Å²	97	105.4 Å²	105.4	52%	0.519	64%	0.635	S	S	.	*	H	α-helix	trans	-62.4	-24.3	172.9	-78	-32	0	0	0	113	S869 L871	S869-D873 PolarHBondContact O-N 3.32Å; L871-D873 PolarHBondContact O-N 3.43Å
874	L	38	Very low	33	Very low	101 Å²	101	105 Å²	105	53%	0.529	63%	0.632	S	S	.	*	H	α-helix	trans	-92.2	-21.4	-179.6	-74.6	169.8	0	0	0	113.8	L870 L871 S872 G876 L877	L870-L874 WeakPolarHBondContact O-CD1 3.45Å; L870-L874 WeakPolarHBondContact O-CG 3.48Å; L871-L874 PolarHBondContact O-N 3.33Å; S872-L874 PolarHBondContact O-N 3.45Å; L874-G876 PolarHBondContact O-N 3.25Å; L874-L877 PolarHBondContact O-N 3.35Å
875	E	40.6	Very low	33.1	Very low	162 Å²	162	104.9 Å²	104.9	76%	0.757	64%	0.637	S	S	*	*	H	α-helix	trans	-65.2	-19.6	176.8	-73.4	-178.2	132.8	0	0	113	L871 S872 L877	L871-E875 PolarHBondContact O-N 2.89Å; L871-E875 VanDerWaalsContact O-N 3.14Å; S872-E875 PolarHBondContact O-N 3.31Å; E875-L877 VanDerWaalsContact C-N 3.29Å; E875-L877 PolarHBondContact O-N 2.92Å
876	G	35.4	Very low	33.3	Very low	67 Å²	67	101.4 Å²	101.4	69%	0.691	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-7.5	173.9	0	0	0	0	0	115.7	L874	L874-G876 PolarHBondContact O-N 3.25Å
877	L	34.3	Very low	33.6	Very low	126 Å²	126	100.3 Å²	100.3	66%	0.66	61%	0.61	S	S	*	*			trans	-112.8	73.9	-176.1	-66.3	177.5	0	0	0	111.9	L874 E875 L879	L874-L877 PolarHBondContact O-N 3.35Å; E875-L877 VanDerWaalsContact C-N 3.29Å; E875-L877 PolarHBondContact O-N 2.92Å; L877-L879 PolarHBondContact O-N 3.27Å
878	S	28.7	Very low	33.9	Very low	114 Å²	114	101.9 Å²	101.9	80%	0.797	62%	0.617	S	S	*	*			trans	-72.2	81.8	-177.7	63.2	0	0	0	0	113.6	S880	S878-S880 PolarHBondContact O-N 3.4Å
879	L	29.1	Very low	34.2	Very low	138 Å²	138	99.1 Å²	99.1	72%	0.723	60%	0.596	S	S	*	*			trans	-72.5	105.7	166.7	-94.4	173	0	0	0	110.8	T645 L877	T645-L879 HydrophobicContact CG2-CD1 3.95Å; T645-L879 HydrophobicContact CG2-CD2 3.65Å; T645-L879 HydrophobicContact CG2-CG 3.74Å; L877-L879 PolarHBondContact O-N 3.27Å
880	S	29.2	Very low	34.4	Very low	99 Å²	99	101.3 Å²	101.3	69%	0.692	61%	0.612	S	S	*	*			trans	-84.8	149.5	174.1	53	0	0	0	0	112.3	S878	S878-S880 PolarHBondContact O-N 3.4Å
881	N	31.8	Very low	34.7	Very low	157 Å²	157	99.3 Å²	99.3	84%	0.84	60%	0.604	S	S	*	*			trans	68.2	62.1	167.6	-59.8	-8.2	0	0	0	117.8
882	V	26.2	Very low	35.1	Very low	137 Å²	137	97.6 Å²	97.6	83%	0.83	60%	0.598	S	S	*	*	S	Bend	trans	-118.5	140.2	138.3	-179.9	0	0	0	0	108
883	S	26.2	Very low	35.3	Very low	112 Å²	112	103.3 Å²	103.3	78%	0.783	61%	0.614	S	S	*	*			trans	-55.9	140.7	-179.1	-53.4	0	0	0	0	112.5	A885	S883-A885 VanDerWaalsContact C-N 3.3Å; S883-A885 PolarHBondContact O-N 3.22Å
884	S	32	Very low	36.2	Very low	86 Å²	86	99.5 Å²	99.5	60%	0.601	60%	0.597	S	S	*	*	S	Bend	trans	-53.7	58.8	-155	-46.5	0	0	0	0	120.6	M886 R1075	S884-M886 PolarHBondContact O-N 3.43Å; S884-R1075 PolarHBondContact O-NH2 3.46Å
885	A	30.9	Very low	36.8	Very low	90 Å²	90	99.4 Å²	99.4	74%	0.744	60%	0.603	S	S	*	*			trans	-72.7	65.2	156.2	0	0	0	0	0	110.2	S883	S883-A885 VanDerWaalsContact C-N 3.3Å; S883-A885 PolarHBondContact O-N 3.22Å
886	M	34.8	Very low	38	Very low	55 Å²	55	95.4 Å²	95.4	27%	0.271	59%	0.589	S	S	.	*			trans	-62.3	146.3	-176.6	-56.7	180	80.7	0	0	111.3	S884 V888 M1015 R1075	S884-M886 PolarHBondContact O-N 3.43Å; M886-V888 PolarHBondContact O-N 3.02Å; M886-M1015 HydrophobicContact CE-CB 3.55Å; M886-R1075 PolarHBondContact SD-NH2 3.28Å
887	Q	35.4	Very low	39.8	Very low	135 Å²	135	97 Å²	97	63%	0.631	58%	0.577	S	S	*	*			trans	-57	127.2	-175.2	-72.3	164.7	-79.4	0	0	112.3	T889	Q887-T889 PolarHBondContact O-N 2.98Å
888	V	35.1	Very low	42.1	Very low	92 Å²	92	94.9 Å²	94.9	56%	0.558	57%	0.569	S	S	*	*	B	Isolated β-bridge	trans	-80.7	110.8	163.9	173.5	0	0	0	0	107.6	M886 M1011	M886-V888 PolarHBondContact O-N 3.02Å; V888-M1011 HydrophobicContact CB-SD 4.26Å; V888-M1011 HydrophobicContact CG1-CG 3.87Å; V888-M1011 HydrophobicContact CG1-SD 3.47Å; V888-M1011 WeakPolarHBondContact CG1-SD 3.39Å; V888-M1011 HydrophobicContact CG2-SD 3.71Å
889	T	40.6	Very low	44.8	Very low	35 Å²	35	93.5 Å²	93.5	22%	0.215	55%	0.547	C	S	.	.	P	Polyproline II helix	trans	-85.4	159.5	176.2	52.8	0	0	0	0	111.8	Q887 T1014	Q887-T889 PolarHBondContact O-N 2.98Å; T889-T1014 HydrophobicContact CG2-CG2 3.69Å; T889-T1014 WeakPolarHBondContact CG2-OG1 3.2Å
890	S	43.5	Very low	47.6	Very low	93 Å²	93	91.8 Å²	91.8	65%	0.65	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-58.6	149.4	172.1	44.4	0	0	0	0	112.1
891	S	44.5	Very low	50.4	Low	38 Å²	38	88.2 Å²	88.2	27%	0.266	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-67.7	135.3	-171.4	55.3	0	0	0	0	113.2	F893 R918	S891-F893 PolarHBondContact O-N 2.96Å; S891-R918 VanDerWaalsContact CB-O 3.23Å; S891-R918 WeakPolarHBondContact CB-O 3.17Å
892	S	45.5	Very low	53	Low	36 Å²	36	81.4 Å²	81.4	25%	0.252	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-62.6	118.8	167.4	52.6	0	0	0	0	110.6	G894	S892-G894 PolarHBondContact O-N 3.46Å
893	F	46.1	Very low	55.9	Low	200 Å²	200	78.2 Å²	78.2	88%	0.877	45%	0.448	S	S	*	.			trans	-74.3	86.7	-169.7	-152.1	-90.1	0	0	0	112.5	S891	S891-F893 PolarHBondContact O-N 2.96Å
894	G	52.3	Low	58.6	Low	17 Å²	17	77 Å²	77	18%	0.175	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-83.2	160.4	170.7	0	0	0	0	0	112.7	S892 V896	S892-G894 PolarHBondContact O-N 3.46Å; G894-V896 PolarHBondContact O-N 3.21Å
895	P	51.4	Low	60.8	Low	99 Å²	99	80 Å²	80	64%	0.643	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-65.1	119.5	175.1	27.4	-33.5	0	0	0	110.6	K897	P895-K897 PolarHBondContact O-N 3.23Å
896	V	64.2	Low	63.2	Low	77 Å²	77	80 Å²	80	47%	0.467	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-67.5	116.5	-176.9	177.6	0	0	0	0	110.1	G894 H915	G894-V896 PolarHBondContact O-N 3.21Å; V896-H915 HydrophobicContact CG1-CB 3.55Å; V896-H915 WeakPolarHBondContact CG1-ND1 3.36Å
897	K	74.2	Confident	65.3	Low	102 Å²	102	77.5 Å²	77.5	44%	0.443	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-82.8	122.6	173.5	-69	175.1	-178.6	166.6	0	109.7	P895 Y899 H915	P895-K897 PolarHBondContact O-N 3.23Å; K897-Y899 HydrophobicContact CB-CE2 4.08Å; K897-H915 WeakPolarHBondContact O-CB 3.33Å
898	T	82.6	Confident	67.4	Low	80 Å²	80	77.6 Å²	77.6	49%	0.491	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	127.9	175.9	-55.9	0	0	0	0	110	K913 Y914	T898-K913 HydrophobicContact CG2-CB 3.87Å; T898-Y914 WeakPolarHBondContact CA-O 3.36Å
899	Y	86.3	Confident	69.4	Low	85 Å²	85	73.7 Å²	73.7	33%	0.333	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	152.3	177.7	-59	-86	0	0	0	109.8	K897 K913 Y914 F916	K897-Y899 HydrophobicContact CB-CE2 4.08Å; Y899-K913 CarbonylContact O-C 3.57Å; Y899-K913 VanDerWaalsContact O-CA 3.26Å; Y899-K913 WeakPolarHBondContact O-CA 3.35Å; Y899-K913 WeakPolarHBondContact O-CB 3.44Å; Y899-Y914 HydrophobicContact CD2-CD2 4.48Å; Y899-Y914 HydrophobicContact CD2-CE2 4.04Å; Y899-Y914 HydrophobicContact CG-CE1 4.33Å; Y899-Y914 HydrophobicContact CG-CE2 4.3Å; Y899-Y914 PolarHBondContact N-O 3.17Å; Y899-Y914 PolarHBondContact O-N 3.36Å; Y899-F916 HydrophobicContact CD2-CE2 4.43Å; Y899-F916 HydrophobicContact CE2-CD2 4.24Å; Y899-F916 HydrophobicContact CE2-CE2 4.18Å
900	E	87.8	Confident	71.6	Confident	103 Å²	103	72 Å²	72	48%	0.481	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	137.1	173	-170.2	152.6	-135.5	0	0	110.4	H903	E900-H903 IonicContact OE1-CD2 2.84Å; E900-H903 PolarHBondContact OE1-CD2 2.84Å; E900-H903 IonicContact OE2-CD2 2.6Å
901	L	86.9	Confident	73.7	Confident	23 Å²	23	68.2 Å²	68.2	12%	0.12	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-38.4	179.9	-170	61.2	0	0	0	111.7	A912 Y914 V932 F989 L991 V1000 I1002	L901-A912 WeakPolarHBondContact CA-O 3.45Å; L901-A912 HydrophobicContact CB-CB 4.03Å; L901-A912 WeakPolarHBondContact CB-O 3.33Å; L901-A912 HydrophobicContact CD2-CB 4.34Å; L901-A912 PolarHBondContact N-O 3.06Å; L901-Y914 HydrophobicContact CB-CD1 3.9Å; L901-Y914 HydrophobicContact CB-CE1 4.41Å; L901-Y914 HydrophobicContact CD1-CD1 4.19Å; L901-Y914 HydrophobicContact CD1-CE1 4.17Å; L901-Y914 HydrophobicContact CG-CD1 4.49Å; L901-V932 HydrophobicContact CD2-CG1 4.4Å; L901-F989 HydrophobicContact CD2-CZ 4.19Å; L901-L991 HydrophobicContact CD2-CD1 4.06Å; L901-V1000 HydrophobicContact CD1-CB 3.82Å; L901-V1000 HydrophobicContact CD1-CG2 4.24Å; L901-V1000 HydrophobicContact CD2-CB 4.5Å; L901-V1000 HydrophobicContact CD2-CG2 4.22Å; L901-V1000 HydrophobicContact CG-CB 3.9Å; L901-V1000 HydrophobicContact CG-CG1 4.13Å; L901-V1000 HydrophobicContact CG-CG2 4.17Å; L901-I1002 HydrophobicContact CD1-CD1 4.29Å; L901-I1002 HydrophobicContact CD1-CG1 3.6Å; L901-I1002 HydrophobicContact CD2-CD1 4.22Å; L901-I1002 HydrophobicContact CD2-CG1 4.41Å
902	L	87.1	Confident	75.9	Confident	14 Å²	14	66.4 Å²	66.4	7%	0.073	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	118.5	177.5	-174.8	64	0	0	0	108.9	L910 S911 A912 F998 V1000	L902-L910 HydrophobicContact CD2-CD2 4.39Å; L902-L910 HydrophobicContact CD2-CG 4.4Å; L902-S911 CarbonylContact O-C 3.59Å; L902-S911 VanDerWaalsContact O-CA 3.3Å; L902-S911 WeakPolarHBondContact O-CA 3.4Å; L902-A912 HydrophobicContact CB-CB 3.86Å; L902-A912 PolarHBondContact N-O 3.22Å; L902-A912 PolarHBondContact O-N 2.95Å; L902-F998 HydrophobicContact CD1-CB 4.22Å; L902-F998 HydrophobicContact CD1-CD1 4.4Å; L902-F998 HydrophobicContact CD1-CG 4.4Å; L902-F998 HydrophobicContact CD2-CB 3.89Å; L902-F998 HydrophobicContact CD2-CD1 4.32Å; L902-F998 HydrophobicContact CD2-CD2 3.89Å; L902-F998 HydrophobicContact CD2-CG 3.76Å; L902-V1000 HydrophobicContact CB-CG1 4.44Å
903	H	87.3	Confident	78.1	Confident	71 Å²	71	69.1 Å²	69.1	33%	0.329	35%	0.349	S	S	.	.			trans	-79.1	145.7	177.5	-179.5	-113.6	0	0	0	110.5	E900 M905 T906 G907	E900-H903 IonicContact OE1-CD2 2.84Å; E900-H903 PolarHBondContact OE1-CD2 2.84Å; E900-H903 IonicContact OE2-CD2 2.6Å; H903-M905 VanDerWaalsContact C-N 3.27Å; H903-M905 PolarHBondContact O-N 2.88Å; H903-M905 VanDerWaalsContact O-N 3.14Å; H903-T906 PolarHBondContact N-OG1 2.92Å; H903-T906 PolarHBondContact O-N 3.39Å; H903-T906 PolarHBondContact O-OG1 2.88Å; H903-G907 PolarHBondContact O-N 2.79Å
904	H	81.3	Confident	80.3	Confident	85 Å²	85	60.5 Å²	60.5	39%	0.394	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-37.6	-173.3	70.4	-58	0	0	0	114.4	K908 G909	H904-K908 PolarHBondContact O-N 3.19Å; H904-G909 PolarHBondContact O-N 3.19Å
905	M	79.8	Confident	82.1	Confident	150 Å²	150	60.8 Å²	60.8	74%	0.739	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-32.9	176.2	-61.9	177.2	72.6	0	0	113.4	H903	H903-M905 VanDerWaalsContact C-N 3.27Å; H903-M905 PolarHBondContact O-N 2.88Å; H903-M905 VanDerWaalsContact O-N 3.14Å
906	T	81.1	Confident	83.8	Confident	91 Å²	91	56.6 Å²	56.6	56%	0.558	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-30.2	178.7	42.3	0	0	0	0	112.7	H903 K908 F998	H903-T906 PolarHBondContact N-OG1 2.92Å; H903-T906 PolarHBondContact O-N 3.39Å; H903-T906 PolarHBondContact O-OG1 2.88Å; T906-K908 VanDerWaalsContact C-N 3.3Å; T906-K908 PolarHBondContact O-N 3.39Å; T906-F998 WeakPolarHBondContact O-CE1 3.45Å
907	G	77.7	Confident	84.7	Confident	2 Å²	2	54 Å²	54	2%	0.021	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	16.2	176.7	0	0	0	0	0	114.8	H903 G909 L910 F998	H903-G907 PolarHBondContact O-N 2.79Å; G907-G909 PolarHBondContact O-N 3.43Å; G907-G909 VanDerWaalsContact O-N 3.12Å; G907-L910 WeakPolarHBondContact CA-O 3.35Å; G907-L910 WeakPolarHBondContact O-CB 3.4Å; G907-L910 PolarHBondContact O-N 3.16Å; G907-F998 VanDerWaalsContact O-CZ 3.32Å; G907-F998 WeakPolarHBondContact O-CZ 3.28Å
908	K	79.5	Confident	85.1	Confident	137 Å²	137	50.9 Å²	50.9	60%	0.596	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.5	37.5	-177.5	-66.7	168.3	160.2	-178.6	0	113.6	H904 T906 D996 F998	H904-K908 PolarHBondContact O-N 3.19Å; T906-K908 VanDerWaalsContact C-N 3.3Å; T906-K908 PolarHBondContact O-N 3.39Å; K908-D996 WeakPolarHBondContact CD-OD2 3.41Å; K908-D996 WeakPolarHBondContact CE-OD2 3.44Å; K908-D996 IonicContact NZ-OD1 3.04Å; K908-D996 PolarHBondContact NZ-OD1 3.35Å; K908-D996 IonicContact NZ-OD2 2.94Å; K908-D996 PolarHBondContact NZ-OD2 3.42Å; K908-F998 HydrophobicContact CB-CZ 4.4Å; K908-F998 HydrophobicContact CD-CE1 4.49Å; K908-F998 HydrophobicContact CD-CZ 4.39Å
909	G	78.3	Confident	84.8	Confident	9 Å²	9	52.5 Å²	52.5	9%	0.093	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	102.9	-20.4	-176.4	0	0	0	0	0	114.8	H904 G907 S937	H904-G909 PolarHBondContact O-N 3.19Å; G907-G909 PolarHBondContact O-N 3.43Å; G907-G909 VanDerWaalsContact O-N 3.12Å; G909-S937 WeakPolarHBondContact O-CA 3.44Å; G909-S937 PolarHBondContact O-N 3.43Å
910	L	85.6	Confident	84.3	Confident	1 Å²	1	53 Å²	53	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	131.6	161.9	-176.2	58.6	0	0	0	109.2	L902 G907 L934 L942 I945 T993 F998	L902-L910 HydrophobicContact CD2-CD2 4.39Å; L902-L910 HydrophobicContact CD2-CG 4.4Å; G907-L910 WeakPolarHBondContact CA-O 3.35Å; G907-L910 WeakPolarHBondContact O-CB 3.4Å; G907-L910 PolarHBondContact O-N 3.16Å; L910-L934 HydrophobicContact CD1-CB 4.41Å; L910-L942 HydrophobicContact CB-CD1 3.82Å; L910-L942 HydrophobicContact CD1-CD1 3.96Å; L910-L942 HydrophobicContact CG-CD1 4.41Å; L910-I945 HydrophobicContact CD1-CD1 4.09Å; L910-I945 HydrophobicContact CD2-CG2 4.19Å; L910-T993 HydrophobicContact CD2-CG2 4.14Å; L910-F998 HydrophobicContact CD2-CE2 4.49Å
911	S	89.1	Confident	83.8	Confident	12 Å²	12	48.8 Å²	48.8	8%	0.084	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	144.6	164.8	61.5	0	0	0	0	110.7	L902 L934 T935	L902-S911 CarbonylContact O-C 3.59Å; L902-S911 VanDerWaalsContact O-CA 3.3Å; L902-S911 WeakPolarHBondContact O-CA 3.4Å; S911-L934 WeakPolarHBondContact O-CA 3.41Å; S911-T935 PolarHBondContact N-O 3.13Å; S911-T935 PolarHBondContact O-N 3.16Å; S911-T935 WeakPolarHBondContact OG-CB 3.21Å; S911-T935 PolarHBondContact OG-O 3.49Å
912	A	89.9	Confident	83.2	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.5	-179.4	0	0	0	0	0	110.1	L901 L902 V932 I933 L934 L991	L901-A912 WeakPolarHBondContact CA-O 3.45Å; L901-A912 HydrophobicContact CB-CB 4.03Å; L901-A912 WeakPolarHBondContact CB-O 3.33Å; L901-A912 HydrophobicContact CD2-CB 4.34Å; L901-A912 PolarHBondContact N-O 3.06Å; L902-A912 HydrophobicContact CB-CB 3.86Å; L902-A912 PolarHBondContact N-O 3.22Å; L902-A912 PolarHBondContact O-N 2.95Å; A912-V932 HydrophobicContact CB-CG1 4.44Å; A912-I933 WeakPolarHBondContact CA-O 3.3Å; A912-L934 HydrophobicContact CB-CD2 3.7Å; A912-L991 HydrophobicContact CB-CD1 4.07Å
913	K	91.8	Very high	82.7	Confident	94 Å²	94	59.1 Å²	59.1	41%	0.409	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	151	174.1	-65.2	178.5	-178.3	175	0	108.5	T898 Y899 V932 I933	T898-K913 HydrophobicContact CG2-CB 3.87Å; Y899-K913 CarbonylContact O-C 3.57Å; Y899-K913 VanDerWaalsContact O-CA 3.26Å; Y899-K913 WeakPolarHBondContact O-CA 3.35Å; Y899-K913 WeakPolarHBondContact O-CB 3.44Å; K913-V932 CarbonylContact O-C 3.55Å; K913-V932 WeakPolarHBondContact O-CA 3.25Å; K913-I933 PolarHBondContact N-O 3.36Å; K913-I933 PolarHBondContact O-N 3.21Å
914	Y	91.4	Very high	82.3	Confident	19 Å²	19	60.3 Å²	60.3	8%	0.075	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	153.9	-179.7	74.1	-78.8	0	0	0	112.3	T898 Y899 L901 F916 V930 Q931 I1002	T898-Y914 WeakPolarHBondContact CA-O 3.36Å; Y899-Y914 HydrophobicContact CD2-CD2 4.48Å; Y899-Y914 HydrophobicContact CD2-CE2 4.04Å; Y899-Y914 HydrophobicContact CG-CE1 4.33Å; Y899-Y914 HydrophobicContact CG-CE2 4.3Å; Y899-Y914 PolarHBondContact N-O 3.17Å; Y899-Y914 PolarHBondContact O-N 3.36Å; L901-Y914 HydrophobicContact CB-CD1 3.9Å; L901-Y914 HydrophobicContact CB-CE1 4.41Å; L901-Y914 HydrophobicContact CD1-CD1 4.19Å; L901-Y914 HydrophobicContact CD1-CE1 4.17Å; L901-Y914 HydrophobicContact CG-CD1 4.49Å; Y914-F916 HydrophobicContact CD2-CE2 4.29Å; Y914-F916 HydrophobicContact CD2-CZ 4.43Å; Y914-F916 AromaticContact CE2-CE2 3.82Å; Y914-F916 HydrophobicContact CE2-CE2 3.82Å; Y914-F916 AromaticContact CE2-CZ 3.97Å; Y914-F916 HydrophobicContact CE2-CZ 3.97Å; Y914-V930 HydrophobicContact CD2-CG1 3.88Å; Y914-V930 HydrophobicContact CG-CG1 4.48Å; Y914-Q931 CarbonylContact C-O 3.57Å; Y914-Q931 VanDerWaalsContact CA-O 3.28Å; Y914-Q931 WeakPolarHBondContact CA-O 3.18Å; Y914-I1002 HydrophobicContact CD1-CG1 4.49Å; Y914-I1002 HydrophobicContact CD2-CD1 4.24Å; Y914-I1002 HydrophobicContact CD2-CG1 4.36Å; Y914-I1002 HydrophobicContact CD2-CG2 4.12Å; Y914-I1002 HydrophobicContact CE1-CG1 4.38Å; Y914-I1002 HydrophobicContact CE2-CB 4.45Å; Y914-I1002 HydrophobicContact CE2-CG1 4.29Å; Y914-I1002 HydrophobicContact CE2-CG2 3.67Å; Y914-I1002 HydrophobicContact CG-CD1 4.26Å; Y914-I1002 HydrophobicContact CG-CG1 4.44Å
915	H	90.1	Very high	82	Confident	22 Å²	22	61.3 Å²	61.3	10%	0.102	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	159	171.4	64.7	88.3	0	0	0	111.1	V896 K897 P917 Q931	V896-H915 HydrophobicContact CG1-CB 3.55Å; V896-H915 WeakPolarHBondContact CG1-ND1 3.36Å; K897-H915 WeakPolarHBondContact O-CB 3.33Å; H915-P917 VanDerWaalsContact O-CD 3.31Å; H915-P917 WeakPolarHBondContact O-CD 3.36Å; H915-Q931 VanDerWaalsContact CE1-CD 3.48Å; H915-Q931 PolarHBondContact CE1-OE1 3.19Å; H915-Q931 PolarHBondContact N-O 3.36Å; H915-Q931 PolarHBondContact O-N 3.13Å
916	F	88.8	Confident	82	Confident	12 Å²	12	55.9 Å²	55.9	5%	0.053	29%	0.292	C	S	.	.			trans	-92.8	109.9	173.3	-60	-84.7	0	0	0	108	Y899 Y914 R918 V928 V930 I1002 P1004 E1008	Y899-F916 HydrophobicContact CD2-CE2 4.43Å; Y899-F916 HydrophobicContact CE2-CD2 4.24Å; Y899-F916 HydrophobicContact CE2-CE2 4.18Å; Y914-F916 HydrophobicContact CD2-CE2 4.29Å; Y914-F916 HydrophobicContact CD2-CZ 4.43Å; Y914-F916 AromaticContact CE2-CE2 3.82Å; Y914-F916 HydrophobicContact CE2-CE2 3.82Å; Y914-F916 AromaticContact CE2-CZ 3.97Å; Y914-F916 HydrophobicContact CE2-CZ 3.97Å; F916-R918 PolarHBondContact O-N 2.99Å; F916-V928 HydrophobicContact CD1-CG1 3.86Å; F916-V928 HydrophobicContact CE1-CG1 4.16Å; F916-V930 HydrophobicContact CD1-CG2 3.92Å; F916-V930 HydrophobicContact CE1-CG1 4.45Å; F916-V930 HydrophobicContact CE1-CG2 3.65Å; F916-I1002 HydrophobicContact CZ-CG2 4.27Å; F916-P1004 HydrophobicContact CE1-CB 4.45Å; F916-P1004 HydrophobicContact CZ-CB 4.24Å; F916-E1008 HydrophobicContact CB-CB 4.44Å; F916-E1008 HydrophobicContact CB-CG 4.22Å; F916-E1008 HydrophobicContact CD1-CB 4.17Å; F916-E1008 HydrophobicContact CD2-CB 4.34Å; F916-E1008 HydrophobicContact CD2-CG 3.82Å; F916-E1008 HydrophobicContact CE2-CG 4.33Å; F916-E1008 HydrophobicContact CG-CB 4.05Å; F916-E1008 HydrophobicContact CG-CG 3.93Å
917	P	83.3	Confident	82.2	Confident	22 Å²	22	52.2 Å²	52.2	14%	0.143	27%	0.268	C	S	.	.			trans	-73	-5.3	178.6	30	-36.6	0	0	0	113.6	H915 Q919 A929 Q931	H915-P917 VanDerWaalsContact O-CD 3.31Å; H915-P917 WeakPolarHBondContact O-CD 3.36Å; P917-Q919 HydrophobicContact CB-CG 4.49Å; P917-Q919 PolarHBondContact O-N 3.48Å; P917-Q919 VanDerWaalsContact O-N 3.09Å; P917-A929 WeakPolarHBondContact CD-O 3.46Å; P917-A929 HydrophobicContact CG-CB 4.18Å; P917-Q931 HydrophobicContact CG-CB 4.31Å
918	R	81.1	Confident	82.7	Confident	36 Å²	36	52.6 Å²	52.6	14%	0.136	27%	0.271	C	S	.	.			trans	52.4	26.3	-176.2	-64.9	-178.9	179.7	175.8	6.2	114.7	S891 F916 E1008 L1054 S1055 N1058	S891-R918 VanDerWaalsContact CB-O 3.23Å; S891-R918 WeakPolarHBondContact CB-O 3.17Å; F916-R918 PolarHBondContact O-N 2.99Å; R918-E1008 VanDerWaalsContact CG-OE2 3.28Å; R918-E1008 WeakPolarHBondContact CG-OE2 3.31Å; R918-E1008 IonicContact CZ-OE1 2.71Å; R918-E1008 IonicContact CZ-OE2 3.88Å; R918-E1008 IonicContact NE-OE1 2.87Å; R918-E1008 PolarHBondContact NE-OE1 2.98Å; R918-E1008 IonicContact NE-OE2 2.68Å; R918-E1008 PolarHBondContact NE-OE2 2.87Å; R918-E1008 IonicContact NH2-OE1 3.19Å; R918-E1008 PolarHBondContact NH2-OE1 3.49Å; R918-E1008 IonicContact NH2-OE2 2.71Å; R918-L1054 PolarHBondContact NH1-O 3.01Å; R918-S1055 PolarHBondContact NH2-O 3.49Å; R918-N1058 HydrophobicContact CG-CB 4.32Å
919	Q	77.6	Confident	83.1	Confident	115 Å²	115	46.9 Å²	46.9	54%	0.537	25%	0.249	S	C	.	.	S	Bend	trans	-96	151.2	173.2	-69.9	172.4	26.2	0	0	110	P917 C921 A929	P917-Q919 HydrophobicContact CB-CG 4.49Å; P917-Q919 PolarHBondContact O-N 3.48Å; P917-Q919 VanDerWaalsContact O-N 3.09Å; Q919-C921 PolarHBondContact O-N 2.95Å; Q919-A929 WeakPolarHBondContact O-CB 3.47Å
920	P	75.7	Confident	83.6	Confident	96 Å²	96	46.5 Å²	46.5	62%	0.623	25%	0.245	S	C	*	.	B	Isolated β-bridge	trans	-59.4	135.1	172.1	26.5	-34.5	0	0	0	110.1	L922	P920-L922 PolarHBondContact O-N 3.45Å
921	C	77.2	Confident	83.7	Confident	14 Å²	14	49.1 Å²	49.1	10%	0.095	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-68.5	129.9	-178.3	-176.4	0	0	0	0	111.2	Q919 Y923 Q924 M927 A929	Q919-C921 PolarHBondContact O-N 2.95Å; C921-Y923 PolarHBondContact O-N 3.08Å; C921-Q924 WeakPolarHBondContact CB-O 3.48Å; C921-M927 HydrophobicContact CB-CB 4.09Å; C921-M927 WeakPolarHBondContact CB-O 3.15Å; C921-A929 HydrophobicContact CB-CB 4.06Å
922	L	74.8	Confident	83.8	Confident	162 Å²	162	48.6 Å²	48.6	85%	0.848	25%	0.253	S	S	*	.	S	Bend	trans	-67.5	-19.4	-177	-62.5	175.5	0	0	0	113.4	P920	P920-L922 PolarHBondContact O-N 3.45Å
923	Y	76.6	Confident	83.9	Confident	91 Å²	91	51 Å²	51	36%	0.357	27%	0.266	S	S	.	.	S	Bend	trans	-89.2	-49.4	-176	-56	-65.7	0	0	0	112.5	C921 H958 S975	C921-Y923 PolarHBondContact O-N 3.08Å; Y923-H958 AromaticContact CD1-CD2 3.89Å; Y923-H958 AromaticContact CD1-CE1 3.36Å; Y923-H958 WeakPolarHBondContact CD1-CE1 3.28Å; Y923-H958 AromaticContact CD1-ND1 3.77Å; Y923-H958 AromaticContact CD1-NE2 3.43Å; Y923-H958 WeakPolarHBondContact CD1-NE2 3.45Å; Y923-H958 HydrophobicContact CD2-CB 4.31Å; Y923-H958 AromaticContact CD2-CG 3.88Å; Y923-H958 AromaticContact CD2-ND1 3.77Å; Y923-H958 AromaticContact CE1-CE1 3.37Å; Y923-H958 WeakPolarHBondContact CE1-CE1 3.22Å; Y923-H958 AromaticContact CE1-ND1 3.81Å; Y923-H958 AromaticContact CE1-NE2 3.91Å; Y923-H958 AromaticContact CE2-ND1 3.81Å; Y923-H958 HydrophobicContact CG-CB 4.47Å; Y923-H958 AromaticContact CG-CD2 3.75Å; Y923-H958 AromaticContact CG-CE1 3.8Å; Y923-H958 AromaticContact CG-CG 3.73Å; Y923-H958 AromaticContact CG-ND1 3.75Å; Y923-H958 AromaticContact CG-NE2 3.8Å; Y923-H958 AromaticContact CZ-CE1 3.82Å; Y923-H958 AromaticContact CZ-ND1 3.82Å; Y923-S975 PolarHBondContact OH-O 3.28Å
924	Q	77.9	Confident	83.8	Confident	96 Å²	96	46.6 Å²	46.6	45%	0.449	25%	0.246	S	C	.	.			trans	-150.5	138.9	177.9	-65.1	-172.9	-7.6	0	0	110.1	C921 S926 M927	C921-Q924 WeakPolarHBondContact CB-O 3.48Å; Q924-S926 PolarHBondContact O-N 2.84Å; Q924-M927 HydrophobicContact CB-CB 4.49Å; Q924-M927 HydrophobicContact CB-CG 4.09Å; Q924-M927 HydrophobicContact CB-SD 4.14Å; Q924-M927 HydrophobicContact CG-SD 4.37Å; Q924-M927 PolarHBondContact O-N 2.85Å; Q924-M927 VanDerWaalsContact O-N 3.13Å
925	P	75.7	Confident	83.7	Confident	106 Å²	106	47.3 Å²	47.3	69%	0.688	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.2	-178.1	28.9	-35.7	0	0	0	113.9	M927	P925-M927 VanDerWaalsContact C-N 3.34Å
926	S	79.6	Confident	83.7	Confident	37 Å²	37	46.2 Å²	46.2	26%	0.259	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-3.3	174.3	51.2	0	0	0	0	114.1	Q924	Q924-S926 PolarHBondContact O-N 2.84Å
927	M	85.8	Confident	83.4	Confident	13 Å²	13	48.7 Å²	48.7	6%	0.064	27%	0.267	C	S	.	.	S	Bend	trans	-98.8	140	176.6	-73	-180	171.6	0	0	111.1	C921 Q924 P925 N956 H958 D979	C921-M927 HydrophobicContact CB-CB 4.09Å; C921-M927 WeakPolarHBondContact CB-O 3.15Å; Q924-M927 HydrophobicContact CB-CB 4.49Å; Q924-M927 HydrophobicContact CB-CG 4.09Å; Q924-M927 HydrophobicContact CB-SD 4.14Å; Q924-M927 HydrophobicContact CG-SD 4.37Å; Q924-M927 PolarHBondContact O-N 2.85Å; Q924-M927 VanDerWaalsContact O-N 3.13Å; P925-M927 VanDerWaalsContact C-N 3.34Å; M927-N956 HydrophobicContact CE-CB 4.42Å; M927-H958 HydrophobicContact CE-CB 4.36Å; M927-H958 HydrophobicContact SD-CB 3.9Å; M927-D979 HydrophobicContact CE-CB 4.44Å; M927-D979 HydrophobicContact CG-CB 3.9Å
928	V	86.6	Confident	83.3	Confident	11 Å²	11	49 Å²	49	7%	0.067	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127.8	166.5	179.5	0	0	0	0	108.4	F916 V930 I978 F980 L1009 V1077	F916-V928 HydrophobicContact CD1-CG1 3.86Å; F916-V928 HydrophobicContact CE1-CG1 4.16Å; V928-V930 HydrophobicContact CG1-CG2 4.48Å; V928-I978 PolarHBondContact N-O 3.36Å; V928-I978 PolarHBondContact O-N 2.94Å; V928-F980 HydrophobicContact CB-CD2 4.01Å; V928-F980 HydrophobicContact CB-CE2 4.08Å; V928-F980 HydrophobicContact CG1-CE2 4.45Å; V928-F980 HydrophobicContact CG2-CD2 3.92Å; V928-F980 HydrophobicContact CG2-CE2 4.44Å; V928-L1009 HydrophobicContact CG2-CD2 3.97Å; V928-V1077 HydrophobicContact CG2-CB 4.16Å; V928-V1077 HydrophobicContact CG2-CG1 4.05Å; V928-V1077 HydrophobicContact CG2-CG2 4.29Å
929	A	87.6	Confident	83.3	Confident	17 Å²	17	54.5 Å²	54.5	14%	0.14	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	130.6	172.4	0	0	0	0	0	109.9	P917 Q919 C921	P917-A929 WeakPolarHBondContact CD-O 3.46Å; P917-A929 HydrophobicContact CG-CB 4.18Å; Q919-A929 WeakPolarHBondContact O-CB 3.47Å; C921-A929 HydrophobicContact CB-CB 4.06Å
930	V	89.3	Confident	83.4	Confident	1 Å²	1	56 Å²	56	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.7	172.6	-168.9	0	0	0	0	108.9	Y914 F916 V928 M976 I978 I1002	Y914-V930 HydrophobicContact CD2-CG1 3.88Å; Y914-V930 HydrophobicContact CG-CG1 4.48Å; F916-V930 HydrophobicContact CD1-CG2 3.92Å; F916-V930 HydrophobicContact CE1-CG1 4.45Å; F916-V930 HydrophobicContact CE1-CG2 3.65Å; V928-V930 HydrophobicContact CG1-CG2 4.48Å; V930-M976 HydrophobicContact CB-CG 4Å; V930-M976 HydrophobicContact CB-SD 4.3Å; V930-M976 PolarHBondContact N-O 3.05Å; V930-M976 VanDerWaalsContact O-CG 3.25Å; V930-M976 WeakPolarHBondContact O-CG 3.36Å; V930-M976 PolarHBondContact O-N 3.17Å; V930-I978 HydrophobicContact CG2-CD1 4.08Å; V930-I978 HydrophobicContact CG2-CG1 4.27Å; V930-I1002 HydrophobicContact CG1-CD1 4.19Å
931	Q	89	Confident	83.7	Confident	55 Å²	55	53.6 Å²	53.6	26%	0.257	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	121.1	179.8	-176.1	167	-1.4	0	0	108.8	Y914 H915 P917 S973	Y914-Q931 CarbonylContact C-O 3.57Å; Y914-Q931 VanDerWaalsContact CA-O 3.28Å; Y914-Q931 WeakPolarHBondContact CA-O 3.18Å; H915-Q931 VanDerWaalsContact CE1-CD 3.48Å; H915-Q931 PolarHBondContact CE1-OE1 3.19Å; H915-Q931 PolarHBondContact N-O 3.36Å; H915-Q931 PolarHBondContact O-N 3.13Å; P917-Q931 HydrophobicContact CG-CB 4.31Å; Q931-S973 VanDerWaalsContact CG-OG 3.25Å; Q931-S973 WeakPolarHBondContact CG-OG 3.49Å; Q931-S973 PolarHBondContact NE2-OG 2.86Å
932	V	90.6	Very high	84	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.8	178.3	-174.7	0	0	0	0	108.3	L901 A912 K913 L934 S973 V974 M976	L901-V932 HydrophobicContact CD2-CG1 4.4Å; A912-V932 HydrophobicContact CB-CG1 4.44Å; K913-V932 CarbonylContact O-C 3.55Å; K913-V932 WeakPolarHBondContact O-CA 3.25Å; V932-L934 HydrophobicContact CG1-CD2 3.87Å; V932-L934 HydrophobicContact CG1-CG 4.23Å; V932-S973 CarbonylContact O-C 3.32Å; V932-S973 VanDerWaalsContact O-CA 3.27Å; V932-S973 WeakPolarHBondContact O-CA 3.43Å; V932-S973 PolarHBondContact O-OG 3.36Å; V932-S973 VanDerWaalsContact O-OG 3.08Å; V932-V974 HydrophobicContact CB-CG2 3.91Å; V932-V974 PolarHBondContact N-O 2.9Å; V932-V974 PolarHBondContact O-N 3.46Å; V932-M976 HydrophobicContact CG2-CE 4.24Å; V932-M976 HydrophobicContact CG2-CG 4.26Å; V932-M976 HydrophobicContact CG2-SD 4.08Å
933	I	90.7	Very high	84.4	Confident	52 Å²	52	49 Å²	49	27%	0.267	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.1	174.6	-57.6	172.3	0	0	0	106	A912 K913 V972	A912-I933 WeakPolarHBondContact CA-O 3.3Å; K913-I933 PolarHBondContact N-O 3.36Å; K913-I933 PolarHBondContact O-N 3.21Å; I933-V972 WeakPolarHBondContact CA-O 3.41Å
934	L	90.9	Very high	84.7	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	123.1	178.4	-59	171.6	0	0	0	107.8	L910 S911 A912 V932 I945 F960 L966 S971 V972 V974	L910-L934 HydrophobicContact CD1-CB 4.41Å; S911-L934 WeakPolarHBondContact O-CA 3.41Å; A912-L934 HydrophobicContact CB-CD2 3.7Å; V932-L934 HydrophobicContact CG1-CD2 3.87Å; V932-L934 HydrophobicContact CG1-CG 4.23Å; L934-I945 HydrophobicContact CD1-CG2 4.11Å; L934-F960 HydrophobicContact CD1-CE2 4.23Å; L934-F960 HydrophobicContact CD1-CZ 4.09Å; L934-L966 HydrophobicContact CB-CD2 4.35Å; L934-S971 CarbonylContact O-C 3.57Å; L934-S971 VanDerWaalsContact O-CA 3.31Å; L934-S971 WeakPolarHBondContact O-CA 3.43Å; L934-V972 HydrophobicContact CB-CG1 3.88Å; L934-V972 HydrophobicContact CD1-CG1 4.37Å; L934-V972 PolarHBondContact N-O 3.42Å; L934-V972 PolarHBondContact O-N 2.8Å; L934-V974 HydrophobicContact CD1-CG2 4.21Å
935	T	88.4	Confident	85	Confident	34 Å²	34	45 Å²	45	21%	0.209	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	122	-177.7	-61.6	0	0	0	0	109.4	S911 A970 S971	S911-T935 PolarHBondContact N-O 3.13Å; S911-T935 PolarHBondContact O-N 3.16Å; S911-T935 WeakPolarHBondContact OG-CB 3.21Å; S911-T935 PolarHBondContact OG-O 3.49Å; T935-A970 WeakPolarHBondContact CA-O 3.47Å; T935-S971 WeakPolarHBondContact CB-OG 3.39Å; T935-S971 VanDerWaalsContact CG2-OG 3.28Å; T935-S971 WeakPolarHBondContact CG2-OG 3.42Å; T935-S971 WeakPolarHBondContact OG1-CB 3.18Å; T935-S971 PolarHBondContact OG1-OG 3.39Å
936	N	90.1	Very high	85.4	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	122.7	174.2	-175.8	3.2	0	0	0	109.7	S938 H940 L942 L966 E967 G969 A970	N936-S938 PolarHBondContact OD1-N 3.41Å; N936-S938 PolarHBondContact OD1-OG 3.14Å; N936-H940 PolarHBondContact ND2-O 3.03Å; N936-L942 HydrophobicContact CB-CD1 4.15Å; N936-L966 HydrophobicContact CB-CD2 3.88Å; N936-L966 HydrophobicContact CB-CG 3.88Å; N936-L966 PolarHBondContact ND2-O 3.01Å; N936-E967 WeakPolarHBondContact CB-O 3.46Å; N936-E967 PolarHBondContact ND2-O 3.18Å; N936-G969 VanDerWaalsContact O-CA 3.22Å; N936-G969 WeakPolarHBondContact O-CA 3.33Å; N936-G969 PolarHBondContact O-N 3.45Å; N936-A970 PolarHBondContact N-O 2.87Å
937	S	84.1	Confident	85.6	Confident	64 Å²	64	42.2 Å²	42.2	45%	0.448	23%	0.226	S	C	.	.			trans	-120.6	23.4	178.3	-54.4	0	0	0	0	111.9	G909	G909-S937 WeakPolarHBondContact O-CA 3.44Å; G909-S937 PolarHBondContact O-N 3.43Å
938	S	80.6	Confident	85	Confident	29 Å²	29	42.4 Å²	42.4	20%	0.203	23%	0.231	C	C	.	.	S	Bend	trans	-105.8	163.3	171.3	73.1	0	0	0	0	111.7	N936 H940 P968	N936-S938 PolarHBondContact OD1-N 3.41Å; N936-S938 PolarHBondContact OD1-OG 3.14Å; S938-H940 PolarHBondContact O-N 2.87Å; S938-H940 PolarHBondContact OG-N 3.35Å; S938-H940 PolarHBondContact OG-O 3.04Å; S938-H940 VanDerWaalsContact OG-O 3.07Å; S938-P968 WeakPolarHBondContact O-CB 3.34Å
939	D	80.2	Confident	83.7	Confident	151 Å²	151	48.7 Å²	48.7	81%	0.807	26%	0.264	S	S	*	.	S	Bend	trans	-77	6.4	177	-56.5	-56	0	0	0	113.7
940	H	81.1	Confident	82.5	Confident	146 Å²	146	53.5 Å²	53.5	68%	0.676	28%	0.278	S	S	*	.	S	Bend	trans	-130.9	152.9	-174.3	-62.1	-14.4	0	0	0	111.4	N936 S938 L942	N936-H940 PolarHBondContact ND2-O 3.03Å; S938-H940 PolarHBondContact O-N 2.87Å; S938-H940 PolarHBondContact OG-N 3.35Å; S938-H940 PolarHBondContact OG-O 3.04Å; S938-H940 VanDerWaalsContact OG-O 3.07Å; H940-L942 PolarHBondContact O-N 2.85Å
941	S	81.9	Confident	80.9	Confident	45 Å²	45	56.2 Å²	56.2	32%	0.315	30%	0.298	S	S	.	.			trans	-75.7	122.6	176.9	59.9	0	0	0	0	110.8
942	L	82	Confident	78.7	Confident	30 Å²	30	60.6 Å²	60.6	16%	0.157	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	135.9	175.1	-65.1	173.1	0	0	0	110	L910 N936 H940 I945 R965 L966	L910-L942 HydrophobicContact CB-CD1 3.82Å; L910-L942 HydrophobicContact CD1-CD1 3.96Å; L910-L942 HydrophobicContact CG-CD1 4.41Å; N936-L942 HydrophobicContact CB-CD1 4.15Å; H940-L942 PolarHBondContact O-N 2.85Å; L942-I945 HydrophobicContact CB-CD1 4.21Å; L942-R965 CarbonylContact O-C 3.52Å; L942-R965 WeakPolarHBondContact O-CA 3.22Å; L942-L966 PolarHBondContact N-O 2.82Å; L942-L966 PolarHBondContact O-N 3.16Å
943	E	83.3	Confident	77	Confident	51 Å²	51	64.4 Å²	64.4	24%	0.238	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	153.8	-178.3	-64.2	-167	146.6	0	0	112.6	I945 E964 R965 K994	E943-I945 PolarHBondContact O-N 2.84Å; E943-E964 WeakPolarHBondContact CA-O 3.44Å; E943-R965 IonicContact OE1-CZ 2.81Å; E943-R965 IonicContact OE1-NE 2.67Å; E943-R965 PolarHBondContact OE1-NE 3.29Å; E943-R965 IonicContact OE1-NH2 3.99Å; E943-R965 PolarHBondContact OE1-NH2 2.67Å; E943-K994 HydrophobicContact CB-CB 4.44Å; E943-K994 HydrophobicContact CB-CD 4.03Å; E943-K994 PolarHBondContact O-N 3.07Å; E943-K994 VanDerWaalsContact O-N 3.16Å; E943-K994 IonicContact OE2-NZ 3.82Å; E943-K994 PolarHBondContact OE2-NZ 3.27Å
944	E	82.8	Confident	75.5	Confident	103 Å²	103	63.4 Å²	63.4	48%	0.481	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52.6	47.8	171.7	-60.4	-179.1	162.9	0	0	114.4	H946 V963 E964 K994	E944-H946 PolarHBondContact O-N 3Å; E944-H946 PolarHBondContact O-ND1 2.73Å; E944-V963 CarbonylContact C-O 3.26Å; E944-V963 WeakPolarHBondContact CA-O 3.49Å; E944-V963 PolarHBondContact N-O 3.24Å; E944-E964 PolarHBondContact N-O 3.37Å; E944-K994 HydrophobicContact CB-CB 4.35Å
945	I	84.1	Confident	74.5	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	115.6	179.1	-40.4	178	0	0	0	109.9	L910 L934 L942 E943 V963 L966 C992 T993	L910-I945 HydrophobicContact CD1-CD1 4.09Å; L910-I945 HydrophobicContact CD2-CG2 4.19Å; L934-I945 HydrophobicContact CD1-CG2 4.11Å; L942-I945 HydrophobicContact CB-CD1 4.21Å; E943-I945 PolarHBondContact O-N 2.84Å; I945-V963 HydrophobicContact CB-CB 4.16Å; I945-V963 PolarHBondContact N-O 2.8Å; I945-V963 PolarHBondContact O-N 3.12Å; I945-L966 HydrophobicContact CD1-CB 4.02Å; I945-L966 HydrophobicContact CD1-CD2 3.92Å; I945-C992 CarbonylContact C-O 3.5Å; I945-C992 WeakPolarHBondContact CA-O 3.41Å; I945-T993 HydrophobicContact CG1-CG2 4.46Å
946	H	84.1	Confident	73.9	Confident	63 Å²	63	67.9 Å²	67.9	29%	0.292	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	180	-174	68.3	-82.8	0	0	0	112.4	E944 T962 C992	E944-H946 PolarHBondContact O-N 3Å; E944-H946 PolarHBondContact O-ND1 2.73Å; H946-T962 HydrophobicContact CB-CG2 3.77Å; H946-C992 VanDerWaalsContact CE1-CB 3.43Å; H946-C992 WeakPolarHBondContact CE1-CB 3.32Å; H946-C992 PolarHBondContact N-O 3.08Å; H946-C992 PolarHBondContact O-N 3.23Å
947	I	84.1	Confident	73.5	Confident	21 Å²	21	68.4 Å²	68.4	11%	0.108	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	121.7	173	-64.8	170.1	0	0	0	108.4	C959 F960 M976 F989 Q990 L991	I947-C959 HydrophobicContact CB-CB 4.41Å; I947-C959 HydrophobicContact CD1-CB 4Å; I947-F960 HydrophobicContact CD1-CD1 3.7Å; I947-F960 HydrophobicContact CD1-CE1 3.59Å; I947-F960 HydrophobicContact CD1-CZ 4.46Å; I947-F960 HydrophobicContact CG1-CD1 4.28Å; I947-F960 HydrophobicContact CG1-CE1 3.73Å; I947-F960 HydrophobicContact CG1-CZ 4.16Å; I947-M976 HydrophobicContact CD1-CE 3.5Å; I947-F989 HydrophobicContact CD1-CD2 4.41Å; I947-F989 HydrophobicContact CD1-CE2 4.44Å; I947-F989 HydrophobicContact CG1-CD2 4.25Å; I947-F989 HydrophobicContact CG1-CE2 4.46Å; I947-F989 HydrophobicContact CG2-CB 4.15Å; I947-F989 HydrophobicContact CG2-CD2 4.04Å; I947-F989 HydrophobicContact CG2-CG 4.44Å; I947-Q990 CarbonylContact C-O 3.49Å; I947-Q990 VanDerWaalsContact CA-O 3.27Å; I947-Q990 WeakPolarHBondContact CA-O 3.36Å; I947-L991 HydrophobicContact CG1-CD2 4.3Å
948	G	73.8	Confident	73.4	Confident	16 Å²	16	68.7 Å²	68.7	17%	0.165	39%	0.388	C	S	.	.			trans	-83.4	-159.2	-177.5	0	0	0	0	0	114.6	Q990 C992	G948-Q990 PolarHBondContact N-O 2.72Å; G948-C992 VanDerWaalsContact CA-SG 3.59Å
949	D	60	Low	73.4	Confident	144 Å²	144	69 Å²	69	77%	0.77	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-63.3	147.1	-172	-91.1	-40.8	0	0	0	113.8
950	R	62.3	Low	73.5	Confident	117 Å²	117	62.4 Å²	62.4	44%	0.442	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-98.3	125.2	-171.9	-60.5	176.6	-176.6	-146	-7.7	109.9	V957 C959	R950-V957 VanDerWaalsContact CZ-O 3.28Å; R950-V957 PolarHBondContact NH1-O 3.24Å; R950-V957 PolarHBondContact NH2-O 3.46Å; R950-C959 PolarHBondContact NH2-SG 3.49Å
951	S	54.1	Low	73.4	Confident	59 Å²	59	62 Å²	62	41%	0.413	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-59.5	128.6	171.4	56.9	0	0	0	0	110	G953 S954	S951-G953 PolarHBondContact O-N 3.22Å; S951-S954 PolarHBondContact O-N 3.2Å; S951-S954 PolarHBondContact O-OG 3.1Å
952	P	44.3	Very low	73.4	Confident	146 Å²	146	64.2 Å²	64.2	95%	0.948	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	102.3	-177.9	25.1	-33.7	0	0	0	110.5
953	G	53.2	Low	73.5	Confident	81 Å²	81	63.7 Å²	63.7	84%	0.835	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	126.8	-5.8	-170.2	0	0	0	0	0	115	S951	S951-G953 PolarHBondContact O-N 3.22Å
954	S	60.1	Low	73.4	Confident	32 Å²	32	68.9 Å²	68.9	22%	0.224	39%	0.39	C	S	.	.			trans	-69	144.9	170.5	59.8	0	0	0	0	111.9	S951	S951-S954 PolarHBondContact O-N 3.2Å; S951-S954 PolarHBondContact O-OG 3.1Å
955	L	69.1	Low	73.5	Confident	25 Å²	25	70.2 Å²	70.2	13%	0.131	39%	0.391	C	S	.	.			trans	-54.6	162	174.3	-69	165.4	0	0	0	113.7	V957 F980 Q985 A987	L955-V957 PolarHBondContact O-N 2.81Å; L955-F980 HydrophobicContact CD1-CD1 3.53Å; L955-F980 HydrophobicContact CD1-CE1 4.12Å; L955-F980 HydrophobicContact CD1-CG 4.41Å; L955-Q985 HydrophobicContact CD1-CB 4.35Å; L955-A987 HydrophobicContact CB-CB 4.47Å; L955-A987 HydrophobicContact CD1-CB 4.18Å
956	N	76.6	Confident	73.5	Confident	103 Å²	103	70.6 Å²	70.6	55%	0.551	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	91.7	-178.7	-82.2	-34.7	0	0	0	111.6	M927 D979	M927-N956 HydrophobicContact CE-CB 4.42Å; N956-D979 HydrophobicContact CB-CB 4.12Å; N956-D979 PolarHBondContact O-N 3.11Å
957	V	82.1	Confident	73.6	Confident	10 Å²	10	72.2 Å²	72.2	6%	0.061	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	129.2	172.8	-178.7	0	0	0	0	110.7	R950 L955 G977 I978 A987	R950-V957 VanDerWaalsContact CZ-O 3.28Å; R950-V957 PolarHBondContact NH1-O 3.24Å; R950-V957 PolarHBondContact NH2-O 3.46Å; L955-V957 PolarHBondContact O-N 2.81Å; V957-G977 CarbonylContact C-O 3.52Å; V957-G977 WeakPolarHBondContact CA-O 3.48Å; V957-I978 HydrophobicContact CG1-CG1 4.41Å; V957-I978 HydrophobicContact CG2-CG1 4.21Å; V957-I978 HydrophobicContact CG2-CG2 4.23Å; V957-A987 HydrophobicContact CG2-CB 4.41Å
958	H	80.8	Confident	73.6	Confident	71 Å²	71	74.2 Å²	74.2	33%	0.329	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	114.2	161.4	-171.3	-62.7	0	0	0	109	Y923 M927 M976 G977	Y923-H958 AromaticContact CD1-CD2 3.89Å; Y923-H958 AromaticContact CD1-CE1 3.36Å; Y923-H958 WeakPolarHBondContact CD1-CE1 3.28Å; Y923-H958 AromaticContact CD1-ND1 3.77Å; Y923-H958 AromaticContact CD1-NE2 3.43Å; Y923-H958 WeakPolarHBondContact CD1-NE2 3.45Å; Y923-H958 HydrophobicContact CD2-CB 4.31Å; Y923-H958 AromaticContact CD2-CG 3.88Å; Y923-H958 AromaticContact CD2-ND1 3.77Å; Y923-H958 AromaticContact CE1-CE1 3.37Å; Y923-H958 WeakPolarHBondContact CE1-CE1 3.22Å; Y923-H958 AromaticContact CE1-ND1 3.81Å; Y923-H958 AromaticContact CE1-NE2 3.91Å; Y923-H958 AromaticContact CE2-ND1 3.81Å; Y923-H958 HydrophobicContact CG-CB 4.47Å; Y923-H958 AromaticContact CG-CD2 3.75Å; Y923-H958 AromaticContact CG-CE1 3.8Å; Y923-H958 AromaticContact CG-CG 3.73Å; Y923-H958 AromaticContact CG-ND1 3.75Å; Y923-H958 AromaticContact CG-NE2 3.8Å; Y923-H958 AromaticContact CZ-CE1 3.82Å; Y923-H958 AromaticContact CZ-ND1 3.82Å; M927-H958 HydrophobicContact CE-CB 4.36Å; M927-H958 HydrophobicContact SD-CB 3.9Å; H958-M976 WeakPolarHBondContact O-CB 3.43Å; H958-G977 PolarHBondContact N-O 2.78Å; H958-G977 PolarHBondContact O-N 2.92Å
959	C	81.4	Confident	73.9	Confident	36 Å²	36	76.4 Å²	76.4	24%	0.243	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-66.8	158.7	-178.3	-59.1	0	0	0	0	112.3	I947 R950	I947-C959 HydrophobicContact CB-CB 4.41Å; I947-C959 HydrophobicContact CD1-CB 4Å; R950-C959 PolarHBondContact NH2-SG 3.49Å
960	F	81.6	Confident	75	Confident	12 Å²	12	71.2 Å²	71.2	5%	0.053	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-87	160.7	165.7	60	-95.6	0	0	0	110.7	L934 I947 V963 V974 S975 M976 L991	L934-F960 HydrophobicContact CD1-CE2 4.23Å; L934-F960 HydrophobicContact CD1-CZ 4.09Å; I947-F960 HydrophobicContact CD1-CD1 3.7Å; I947-F960 HydrophobicContact CD1-CE1 3.59Å; I947-F960 HydrophobicContact CD1-CZ 4.46Å; I947-F960 HydrophobicContact CG1-CD1 4.28Å; I947-F960 HydrophobicContact CG1-CE1 3.73Å; I947-F960 HydrophobicContact CG1-CZ 4.16Å; F960-V963 HydrophobicContact CE2-CG2 4.37Å; F960-V974 HydrophobicContact CB-CB 3.86Å; F960-V974 HydrophobicContact CB-CG2 4.21Å; F960-V974 HydrophobicContact CD1-CB 4.23Å; F960-V974 HydrophobicContact CD1-CG2 3.63Å; F960-V974 HydrophobicContact CD2-CB 3.77Å; F960-V974 HydrophobicContact CD2-CG1 3.85Å; F960-V974 HydrophobicContact CD2-CG2 3.74Å; F960-V974 HydrophobicContact CE1-CG2 3.84Å; F960-V974 HydrophobicContact CE2-CB 4.4Å; F960-V974 HydrophobicContact CE2-CG1 4.3Å; F960-V974 HydrophobicContact CE2-CG2 3.98Å; F960-V974 HydrophobicContact CG-CB 3.7Å; F960-V974 HydrophobicContact CG-CG1 4.3Å; F960-V974 HydrophobicContact CG-CG2 3.6Å; F960-V974 HydrophobicContact CZ-CG2 4.03Å; F960-S975 WeakPolarHBondContact CB-O 3.41Å; F960-M976 HydrophobicContact CD1-CE 4.02Å; F960-M976 HydrophobicContact CE1-CE 4.14Å; F960-L991 HydrophobicContact CE1-CD2 4.14Å; F960-L991 HydrophobicContact CZ-CD2 3.97Å
961	N	80.4	Confident	76.2	Confident	137 Å²	137	69.3 Å²	69.3	73%	0.733	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-65.2	138.8	177.5	-66.9	15.7	0	0	0	111.1	V963	N961-V963 PolarHBondContact O-N 2.71Å
962	T	81.9	Confident	77.9	Confident	91 Å²	91	68.5 Å²	68.5	56%	0.558	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-51.7	125	179.2	54.3	0	0	0	0	112.2	H946 E964	H946-T962 HydrophobicContact CB-CG2 3.77Å; T962-E964 PolarHBondContact O-N 2.65Å
963	V	83.9	Confident	80	Confident	19 Å²	19	64.2 Å²	64.2	12%	0.115	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	104.3	175	-178.8	0	0	0	0	108.1	E944 I945 F960 N961 R965 V972 V974	E944-V963 CarbonylContact C-O 3.26Å; E944-V963 WeakPolarHBondContact CA-O 3.49Å; E944-V963 PolarHBondContact N-O 3.24Å; I945-V963 HydrophobicContact CB-CB 4.16Å; I945-V963 PolarHBondContact N-O 2.8Å; I945-V963 PolarHBondContact O-N 3.12Å; F960-V963 HydrophobicContact CE2-CG2 4.37Å; N961-V963 PolarHBondContact O-N 2.71Å; V963-R965 PolarHBondContact O-N 3.44Å; V963-V972 HydrophobicContact CG1-CG1 4.27Å; V963-V972 HydrophobicContact CG2-CG1 4.28Å; V963-V974 HydrophobicContact CG2-CG1 3.98Å
964	E	80.8	Confident	81.8	Confident	160 Å²	160	61.1 Å²	61.1	75%	0.748	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.6	-46	-174.7	-63.7	172.9	178.5	0	0	112.4	E943 E944 T962	E943-E964 WeakPolarHBondContact CA-O 3.44Å; E944-E964 PolarHBondContact N-O 3.37Å; T962-E964 PolarHBondContact O-N 2.65Å
965	R	84.1	Confident	83	Confident	132 Å²	132	62.3 Å²	62.3	50%	0.498	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	144.2	176.2	-172.9	175.2	-72.2	-166.5	-3.1	112.6	L942 E943 V963 E967	L942-R965 CarbonylContact O-C 3.52Å; L942-R965 WeakPolarHBondContact O-CA 3.22Å; E943-R965 IonicContact OE1-CZ 2.81Å; E943-R965 IonicContact OE1-NE 2.67Å; E943-R965 PolarHBondContact OE1-NE 3.29Å; E943-R965 IonicContact OE1-NH2 3.99Å; E943-R965 PolarHBondContact OE1-NH2 2.67Å; V963-R965 PolarHBondContact O-N 3.44Å; R965-E967 WeakPolarHBondContact CD-OE1 3.26Å
966	L	84.8	Confident	83.9	Confident	8 Å²	8	61.2 Å²	61.2	4%	0.042	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	109.7	172.3	-172.6	63.7	0	0	0	110.6	L934 N936 L942 I945 A970 V972	L934-L966 HydrophobicContact CB-CD2 4.35Å; N936-L966 HydrophobicContact CB-CD2 3.88Å; N936-L966 HydrophobicContact CB-CG 3.88Å; N936-L966 PolarHBondContact ND2-O 3.01Å; L942-L966 PolarHBondContact N-O 2.82Å; L942-L966 PolarHBondContact O-N 3.16Å; I945-L966 HydrophobicContact CD1-CB 4.02Å; I945-L966 HydrophobicContact CD1-CD2 3.92Å; L966-A970 HydrophobicContact CD1-CB 3.81Å; L966-A970 HydrophobicContact CG-CB 4.48Å; L966-V972 HydrophobicContact CD1-CB 4.03Å; L966-V972 HydrophobicContact CD1-CG1 3.84Å; L966-V972 HydrophobicContact CD2-CG1 4.22Å
967	E	85.9	Confident	84.5	Confident	96 Å²	96	56.3 Å²	56.3	45%	0.449	33%	0.327	S	S	.	.			trans	-67.4	157	-177.1	-62.6	-60.2	160	0	0	113.5	N936 R965 G969 A970	N936-E967 WeakPolarHBondContact CB-O 3.46Å; N936-E967 PolarHBondContact ND2-O 3.18Å; R965-E967 WeakPolarHBondContact CD-OE1 3.26Å; E967-G969 PolarHBondContact O-N 2.95Å; E967-A970 HydrophobicContact CB-CB 4.22Å; E967-A970 WeakPolarHBondContact O-CB 3.2Å; E967-A970 PolarHBondContact O-N 3.34Å
968	P	83.5	Confident	84.7	Confident	64 Å²	64	55.9 Å²	55.9	42%	0.416	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	130.1	174.1	-31.1	38.3	0	0	0	113.5	S938 A970	S938-P968 WeakPolarHBondContact O-CB 3.34Å; P968-A970 PolarHBondContact O-N 3.11Å; P968-A970 VanDerWaalsContact O-N 3.15Å
969	G	80.4	Confident	85	Confident	61 Å²	61	53.6 Å²	53.6	63%	0.629	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.6	-7.4	-177.8	0	0	0	0	0	115.4	N936 E967	N936-G969 VanDerWaalsContact O-CA 3.22Å; N936-G969 WeakPolarHBondContact O-CA 3.33Å; N936-G969 PolarHBondContact O-N 3.45Å; E967-G969 PolarHBondContact O-N 2.95Å
970	A	84.4	Confident	85.1	Confident	35 Å²	35	51.9 Å²	51.9	29%	0.289	30%	0.302	S	S	.	.			trans	-74.2	149.8	179.2	0	0	0	0	0	111.8	T935 N936 L966 E967 P968	T935-A970 WeakPolarHBondContact CA-O 3.47Å; N936-A970 PolarHBondContact N-O 2.87Å; L966-A970 HydrophobicContact CD1-CB 3.81Å; L966-A970 HydrophobicContact CG-CB 4.48Å; E967-A970 HydrophobicContact CB-CB 4.22Å; E967-A970 WeakPolarHBondContact O-CB 3.2Å; E967-A970 PolarHBondContact O-N 3.34Å; P968-A970 PolarHBondContact O-N 3.11Å; P968-A970 VanDerWaalsContact O-N 3.15Å
971	S	87.8	Confident	85.1	Confident	77 Å²	77	54.8 Å²	54.8	54%	0.538	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.6	173.2	-60.3	0	0	0	0	110.2	L934 T935	L934-S971 CarbonylContact O-C 3.57Å; L934-S971 VanDerWaalsContact O-CA 3.31Å; L934-S971 WeakPolarHBondContact O-CA 3.43Å; T935-S971 WeakPolarHBondContact CB-OG 3.39Å; T935-S971 VanDerWaalsContact CG2-OG 3.28Å; T935-S971 WeakPolarHBondContact CG2-OG 3.42Å; T935-S971 WeakPolarHBondContact OG1-CB 3.18Å; T935-S971 PolarHBondContact OG1-OG 3.39Å
972	V	89.2	Confident	85	Confident	43 Å²	43	48.7 Å²	48.7	26%	0.261	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	145.1	173.6	65.1	0	0	0	0	109.3	I933 L934 V963 L966 V974	I933-V972 WeakPolarHBondContact CA-O 3.41Å; L934-V972 HydrophobicContact CB-CG1 3.88Å; L934-V972 HydrophobicContact CD1-CG1 4.37Å; L934-V972 PolarHBondContact N-O 3.42Å; L934-V972 PolarHBondContact O-N 2.8Å; V963-V972 HydrophobicContact CG1-CG1 4.27Å; V963-V972 HydrophobicContact CG2-CG1 4.28Å; L966-V972 HydrophobicContact CD1-CB 4.03Å; L966-V972 HydrophobicContact CD1-CG1 3.84Å; L966-V972 HydrophobicContact CD2-CG1 4.22Å; V972-V974 HydrophobicContact CG2-CG1 4.37Å
973	S	88.8	Confident	85	Confident	55 Å²	55	46.1 Å²	46.1	39%	0.385	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.3	173.1	-169.8	0	0	0	0	110.8	Q931 V932	Q931-S973 VanDerWaalsContact CG-OG 3.25Å; Q931-S973 WeakPolarHBondContact CG-OG 3.49Å; Q931-S973 PolarHBondContact NE2-OG 2.86Å; V932-S973 CarbonylContact O-C 3.32Å; V932-S973 VanDerWaalsContact O-CA 3.27Å; V932-S973 WeakPolarHBondContact O-CA 3.43Å; V932-S973 PolarHBondContact O-OG 3.36Å; V932-S973 VanDerWaalsContact O-OG 3.08Å
974	V	89.4	Confident	84.9	Confident	16 Å²	16	46.9 Å²	46.9	10%	0.097	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147	-175	-62.3	0	0	0	0	109.5	V932 L934 F960 V963 V972	V932-V974 HydrophobicContact CB-CG2 3.91Å; V932-V974 PolarHBondContact N-O 2.9Å; V932-V974 PolarHBondContact O-N 3.46Å; L934-V974 HydrophobicContact CD1-CG2 4.21Å; F960-V974 HydrophobicContact CB-CB 3.86Å; F960-V974 HydrophobicContact CB-CG2 4.21Å; F960-V974 HydrophobicContact CD1-CB 4.23Å; F960-V974 HydrophobicContact CD1-CG2 3.63Å; F960-V974 HydrophobicContact CD2-CB 3.77Å; F960-V974 HydrophobicContact CD2-CG1 3.85Å; F960-V974 HydrophobicContact CD2-CG2 3.74Å; F960-V974 HydrophobicContact CE1-CG2 3.84Å; F960-V974 HydrophobicContact CE2-CB 4.4Å; F960-V974 HydrophobicContact CE2-CG1 4.3Å; F960-V974 HydrophobicContact CE2-CG2 3.98Å; F960-V974 HydrophobicContact CG-CB 3.7Å; F960-V974 HydrophobicContact CG-CG1 4.3Å; F960-V974 HydrophobicContact CG-CG2 3.6Å; F960-V974 HydrophobicContact CZ-CG2 4.03Å; V963-V974 HydrophobicContact CG2-CG1 3.98Å; V972-V974 HydrophobicContact CG2-CG1 4.37Å
975	S	86.8	Confident	85.1	Confident	58 Å²	58	45 Å²	45	41%	0.406	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	133.4	-179.8	-63.5	0	0	0	0	110.5	Y923 F960	Y923-S975 PolarHBondContact OH-O 3.28Å; F960-S975 WeakPolarHBondContact CB-O 3.41Å
976	M	87.8	Confident	85.1	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	157.4	174.5	50.8	160.8	53	0	0	110.3	V930 V932 I947 H958 F960 I978 F989 I1002	V930-M976 HydrophobicContact CB-CG 4Å; V930-M976 HydrophobicContact CB-SD 4.3Å; V930-M976 PolarHBondContact N-O 3.05Å; V930-M976 VanDerWaalsContact O-CG 3.25Å; V930-M976 WeakPolarHBondContact O-CG 3.36Å; V930-M976 PolarHBondContact O-N 3.17Å; V932-M976 HydrophobicContact CG2-CE 4.24Å; V932-M976 HydrophobicContact CG2-CG 4.26Å; V932-M976 HydrophobicContact CG2-SD 4.08Å; I947-M976 HydrophobicContact CD1-CE 3.5Å; H958-M976 WeakPolarHBondContact O-CB 3.43Å; F960-M976 HydrophobicContact CD1-CE 4.02Å; F960-M976 HydrophobicContact CE1-CE 4.14Å; M976-I978 HydrophobicContact SD-CD1 3.95Å; M976-I978 HydrophobicContact SD-CG1 4.23Å; M976-F989 HydrophobicContact CE-CE1 4.4Å; M976-F989 HydrophobicContact CE-CE2 3.98Å; M976-F989 HydrophobicContact CE-CZ 3.75Å; M976-F989 HydrophobicContact SD-CZ 4.32Å; M976-I1002 HydrophobicContact SD-CD1 4.04Å
977	G	88.3	Confident	85.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.3	169.7	0	0	0	0	0	110.2	V957 H958	V957-G977 CarbonylContact C-O 3.52Å; V957-G977 WeakPolarHBondContact CA-O 3.48Å; H958-G977 PolarHBondContact N-O 2.78Å; H958-G977 PolarHBondContact O-N 2.92Å
978	I	87.8	Confident	85.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	119	171.4	-51.1	-178.6	0	0	0	108.5	V928 V930 V957 M976 F980 A987 I1002	V928-I978 PolarHBondContact N-O 3.36Å; V928-I978 PolarHBondContact O-N 2.94Å; V930-I978 HydrophobicContact CG2-CD1 4.08Å; V930-I978 HydrophobicContact CG2-CG1 4.27Å; V957-I978 HydrophobicContact CG1-CG1 4.41Å; V957-I978 HydrophobicContact CG2-CG1 4.21Å; V957-I978 HydrophobicContact CG2-CG2 4.23Å; M976-I978 HydrophobicContact SD-CD1 3.95Å; M976-I978 HydrophobicContact SD-CG1 4.23Å; I978-F980 HydrophobicContact CB-CD2 4.17Å; I978-F980 HydrophobicContact CB-CE1 4.5Å; I978-F980 HydrophobicContact CB-CE2 3.63Å; I978-F980 HydrophobicContact CB-CZ 3.82Å; I978-F980 HydrophobicContact CD1-CE2 4.42Å; I978-F980 HydrophobicContact CD1-CZ 3.9Å; I978-F980 HydrophobicContact CG1-CZ 4.44Å; I978-F980 HydrophobicContact CG2-CD1 4.02Å; I978-F980 HydrophobicContact CG2-CD2 3.95Å; I978-F980 HydrophobicContact CG2-CE1 3.69Å; I978-F980 HydrophobicContact CG2-CE2 3.65Å; I978-F980 HydrophobicContact CG2-CG 4.14Å; I978-F980 HydrophobicContact CG2-CZ 3.5Å; I978-F980 VanDerWaalsContact CG2-CZ 3.5Å; I978-A987 HydrophobicContact CD1-CB 4.05Å; I978-A987 HydrophobicContact CG2-CB 3.81Å; I978-I1002 HydrophobicContact CD1-CB 4.33Å; I978-I1002 HydrophobicContact CD1-CD1 4.29Å; I978-I1002 HydrophobicContact CD1-CG2 4.2Å
979	D	86.6	Confident	85.3	Confident	23 Å²	23	36.9 Å²	36.9	12%	0.123	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	111.1	166.1	176.3	18.9	0	0	0	108.7	M927 N956 S981 S1078	M927-D979 HydrophobicContact CE-CB 4.44Å; M927-D979 HydrophobicContact CG-CB 3.9Å; N956-D979 HydrophobicContact CB-CB 4.12Å; N956-D979 PolarHBondContact O-N 3.11Å; D979-S981 VanDerWaalsContact C-N 3.35Å; D979-S981 PolarHBondContact OD1-N 3.34Å; D979-S1078 WeakPolarHBondContact OD1-CB 3.18Å; D979-S1078 PolarHBondContact OD1-OG 3.41Å
980	F	82.9	Confident	85.5	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	23%	0.225	C	C	.	.			trans	-88.4	-0.7	178.3	-70.3	-78.6	0	0	0	113	V928 L955 I978 D982 S983 A987 I1002 P1004 L1009	V928-F980 HydrophobicContact CB-CD2 4.01Å; V928-F980 HydrophobicContact CB-CE2 4.08Å; V928-F980 HydrophobicContact CG1-CE2 4.45Å; V928-F980 HydrophobicContact CG2-CD2 3.92Å; V928-F980 HydrophobicContact CG2-CE2 4.44Å; L955-F980 HydrophobicContact CD1-CD1 3.53Å; L955-F980 HydrophobicContact CD1-CE1 4.12Å; L955-F980 HydrophobicContact CD1-CG 4.41Å; I978-F980 HydrophobicContact CB-CD2 4.17Å; I978-F980 HydrophobicContact CB-CE1 4.5Å; I978-F980 HydrophobicContact CB-CE2 3.63Å; I978-F980 HydrophobicContact CB-CZ 3.82Å; I978-F980 HydrophobicContact CD1-CE2 4.42Å; I978-F980 HydrophobicContact CD1-CZ 3.9Å; I978-F980 HydrophobicContact CG1-CZ 4.44Å; I978-F980 HydrophobicContact CG2-CD1 4.02Å; I978-F980 HydrophobicContact CG2-CD2 3.95Å; I978-F980 HydrophobicContact CG2-CE1 3.69Å; I978-F980 HydrophobicContact CG2-CE2 3.65Å; I978-F980 HydrophobicContact CG2-CG 4.14Å; I978-F980 HydrophobicContact CG2-CZ 3.5Å; I978-F980 VanDerWaalsContact CG2-CZ 3.5Å; F980-D982 PolarHBondContact O-N 3.47Å; F980-S983 WeakPolarHBondContact O-CA 3.48Å; F980-S983 VanDerWaalsContact O-CB 3.23Å; F980-S983 WeakPolarHBondContact O-CB 3.44Å; F980-S983 PolarHBondContact O-N 2.93Å; F980-A987 HydrophobicContact CE1-CB 3.89Å; F980-A987 HydrophobicContact CZ-CB 4.45Å; F980-I1002 HydrophobicContact CZ-CG2 4.2Å; F980-P1004 HydrophobicContact CD1-CG 3.61Å; F980-P1004 HydrophobicContact CD2-CB 4.38Å; F980-P1004 HydrophobicContact CD2-CG 4.14Å; F980-P1004 HydrophobicContact CE1-CB 4.39Å; F980-P1004 VanDerWaalsContact CE1-CD 3.48Å; F980-P1004 HydrophobicContact CE1-CG 3.69Å; F980-P1004 HydrophobicContact CE2-CB 4.15Å; F980-P1004 HydrophobicContact CE2-CG 4.17Å; F980-P1004 HydrophobicContact CG-CG 3.86Å; F980-P1004 HydrophobicContact CZ-CB 4.16Å; F980-P1004 HydrophobicContact CZ-CG 3.96Å; F980-L1009 HydrophobicContact CB-CD2 3.78Å; F980-L1009 HydrophobicContact CD2-CD2 3.73Å; F980-L1009 HydrophobicContact CG-CD2 3.93Å
981	S	81.4	Confident	85.6	Confident	73 Å²	73	34.8 Å²	34.8	51%	0.51	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	34.6	-175.8	-59.3	0	0	0	0	113.5	D979 S983 S1078	D979-S981 VanDerWaalsContact C-N 3.35Å; D979-S981 PolarHBondContact OD1-N 3.34Å; S981-S983 PolarHBondContact O-N 3.22Å; S981-S1078 WeakPolarHBondContact CA-OG 3.28Å; S981-S1078 PolarHBondContact N-OG 2.92Å
982	D	79	Confident	85.4	Confident	10 Å²	10	31.2 Å²	31.2	5%	0.053	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	30.5	-169.4	-55.3	-32.4	0	0	0	115.1	F980 T1076 V1077 S1078 S1079 K1103 M1106	F980-D982 PolarHBondContact O-N 3.47Å; D982-T1076 VanDerWaalsContact CG-CB 3.42Å; D982-T1076 VanDerWaalsContact OD1-CB 3.32Å; D982-T1076 WeakPolarHBondContact OD1-CB 3.39Å; D982-T1076 VanDerWaalsContact OD2-CB 3.31Å; D982-T1076 WeakPolarHBondContact OD2-CB 3.29Å; D982-T1076 PolarHBondContact OD2-OG1 2.72Å; D982-V1077 PolarHBondContact OD1-N 3.43Å; D982-S1078 PolarHBondContact N-OG 3.27Å; D982-S1078 WeakPolarHBondContact OD1-CB 3.39Å; D982-S1078 PolarHBondContact OD1-N 2.76Å; D982-S1079 VanDerWaalsContact OD2-CB 3.29Å; D982-S1079 WeakPolarHBondContact OD2-CB 3.44Å; D982-S1079 PolarHBondContact OD2-N 3.33Å; D982-S1079 PolarHBondContact OD2-OG 2.86Å; D982-K1103 HydrophobicContact CB-CD 4.19Å; D982-K1103 VanDerWaalsContact CB-NZ 3.34Å; D982-K1103 IonicContact OD2-NZ 3.6Å; D982-K1103 PolarHBondContact OD2-NZ 3.41Å; D982-M1106 HydrophobicContact CB-CE 4.3Å; D982-M1106 HydrophobicContact CB-SD 4Å
983	S	82.3	Confident	85.2	Confident	37 Å²	37	30 Å²	30	26%	0.259	18%	0.179	S	C	.	.			trans	-110.6	148.3	178.4	-171.3	0	0	0	0	111.5	F980 S981 Q985	F980-S983 WeakPolarHBondContact O-CA 3.48Å; F980-S983 VanDerWaalsContact O-CB 3.23Å; F980-S983 WeakPolarHBondContact O-CB 3.44Å; F980-S983 PolarHBondContact O-N 2.93Å; S981-S983 PolarHBondContact O-N 3.22Å; S983-Q985 PolarHBondContact O-N 2.81Å; S983-Q985 WeakPolarHBondContact OG-CG 3.38Å
984	T	81.2	Confident	84.8	Confident	35 Å²	35	32.6 Å²	32.6	22%	0.215	18%	0.184	C	C	.	.			trans	-89.4	25.5	174.9	62.9	0	0	0	0	112.9	Q1003 V1006 L1009 M1109	T984-Q1003 PolarHBondContact O-NE2 3.39Å; T984-V1006 HydrophobicContact CG2-CG2 3.51Å; T984-L1009 HydrophobicContact CG2-CD1 4.38Å; T984-M1109 HydrophobicContact CG2-CE 3.89Å; T984-M1109 HydrophobicContact CG2-SD 4.17Å
985	Q	83.9	Confident	84.2	Confident	121 Å²	121	40.1 Å²	40.1	57%	0.565	22%	0.218	S	C	*	.			trans	-70.6	145.1	173.5	-76.6	173.2	4	0	0	110.4	L955 S983	L955-Q985 HydrophobicContact CD1-CB 4.35Å; S983-Q985 PolarHBondContact O-N 2.81Å; S983-Q985 WeakPolarHBondContact OG-CG 3.38Å
986	A	84.3	Confident	84	Confident	36 Å²	36	39.5 Å²	39.5	30%	0.298	21%	0.21	S	C	.	.			trans	-76.2	129.9	176.5	0	0	0	0	0	110.7	N988 I1002 Q1003	A986-N988 PolarHBondContact O-N 3.21Å; A986-I1002 CarbonylContact C-O 3.55Å; A986-I1002 WeakPolarHBondContact CA-O 3.35Å; A986-Q1003 HydrophobicContact CB-CB 4.2Å
987	A	84.6	Confident	83.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	103.9	170	0	0	0	0	0	108.9	L955 V957 I978 F980 S1001 I1002	L955-A987 HydrophobicContact CB-CB 4.47Å; L955-A987 HydrophobicContact CD1-CB 4.18Å; V957-A987 HydrophobicContact CG2-CB 4.41Å; I978-A987 HydrophobicContact CD1-CB 4.05Å; I978-A987 HydrophobicContact CG2-CB 3.81Å; F980-A987 HydrophobicContact CE1-CB 3.89Å; F980-A987 HydrophobicContact CZ-CB 4.45Å; A987-S1001 WeakPolarHBondContact O-CA 3.45Å; A987-I1002 PolarHBondContact N-O 3.11Å; A987-I1002 PolarHBondContact O-N 3.41Å
988	N	86.5	Confident	83.7	Confident	80 Å²	80	46.8 Å²	46.8	43%	0.428	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	131	178.9	-58.6	-25.6	0	0	0	110.2	A986 V1000 S1001	A986-N988 PolarHBondContact O-N 3.21Å; N988-V1000 WeakPolarHBondContact CA-O 3.48Å; N988-S1001 WeakPolarHBondContact OD1-CB 3.29Å
989	F	86.9	Confident	83.6	Confident	12 Å²	12	51.3 Å²	51.3	5%	0.053	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	169.1	176.2	58.9	-87.1	0	0	0	110.6	L901 I947 M976 L991 V1000 I1002	L901-F989 HydrophobicContact CD2-CZ 4.19Å; I947-F989 HydrophobicContact CD1-CD2 4.41Å; I947-F989 HydrophobicContact CD1-CE2 4.44Å; I947-F989 HydrophobicContact CG1-CD2 4.25Å; I947-F989 HydrophobicContact CG1-CE2 4.46Å; I947-F989 HydrophobicContact CG2-CB 4.15Å; I947-F989 HydrophobicContact CG2-CD2 4.04Å; I947-F989 HydrophobicContact CG2-CG 4.44Å; M976-F989 HydrophobicContact CE-CE1 4.4Å; M976-F989 HydrophobicContact CE-CE2 3.98Å; M976-F989 HydrophobicContact CE-CZ 3.75Å; M976-F989 HydrophobicContact SD-CZ 4.32Å; F989-L991 HydrophobicContact CE2-CD2 4.25Å; F989-L991 HydrophobicContact CE2-CG 4.07Å; F989-V1000 HydrophobicContact CD2-CG2 3.75Å; F989-V1000 HydrophobicContact CE1-CG2 4.37Å; F989-V1000 HydrophobicContact CE2-CG2 3.48Å; F989-V1000 VanDerWaalsContact CE2-CG2 3.48Å; F989-V1000 HydrophobicContact CG-CG2 4.32Å; F989-V1000 HydrophobicContact CZ-CG2 3.81Å; F989-V1000 PolarHBondContact N-O 3.06Å; F989-V1000 WeakPolarHBondContact O-CG2 3.14Å; F989-V1000 PolarHBondContact O-N 3.08Å; F989-I1002 HydrophobicContact CE1-CB 4.45Å; F989-I1002 HydrophobicContact CE1-CD1 3.8Å; F989-I1002 HydrophobicContact CE1-CG1 3.93Å; F989-I1002 HydrophobicContact CZ-CD1 3.76Å; F989-I1002 HydrophobicContact CZ-CG1 4.18Å
990	Q	85.9	Confident	83.6	Confident	51 Å²	51	50.8 Å²	50.8	24%	0.238	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	130.9	176.3	-64.8	-179	-15.1	0	0	110.2	I947 G948 F998	I947-Q990 CarbonylContact C-O 3.49Å; I947-Q990 VanDerWaalsContact CA-O 3.27Å; I947-Q990 WeakPolarHBondContact CA-O 3.36Å; G948-Q990 PolarHBondContact N-O 2.72Å; Q990-F998 CarbonylContact C-O 3.5Å; Q990-F998 WeakPolarHBondContact CA-O 3.4Å
991	L	86.3	Confident	83.8	Confident	1 Å²	1	54 Å²	54	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	117.8	162.6	-77.7	170.2	0	0	0	107.8	L901 A912 I947 F960 F989 F998 V1000	L901-L991 HydrophobicContact CD2-CD1 4.06Å; A912-L991 HydrophobicContact CB-CD1 4.07Å; I947-L991 HydrophobicContact CG1-CD2 4.3Å; F960-L991 HydrophobicContact CE1-CD2 4.14Å; F960-L991 HydrophobicContact CZ-CD2 3.97Å; F989-L991 HydrophobicContact CE2-CD2 4.25Å; F989-L991 HydrophobicContact CE2-CG 4.07Å; L991-F998 PolarHBondContact N-O 3.39Å; L991-F998 PolarHBondContact O-N 2.89Å; L991-V1000 HydrophobicContact CD1-CG1 4.32Å; L991-V1000 HydrophobicContact CD1-CG2 4.01Å; L991-V1000 HydrophobicContact CG-CG2 3.98Å
992	C	84.5	Confident	84.1	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.02	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	138.5	-179.2	-60.5	0	0	0	0	109.9	I945 H946 G948 D996 Q997	I945-C992 CarbonylContact C-O 3.5Å; I945-C992 WeakPolarHBondContact CA-O 3.41Å; H946-C992 VanDerWaalsContact CE1-CB 3.43Å; H946-C992 WeakPolarHBondContact CE1-CB 3.32Å; H946-C992 PolarHBondContact N-O 3.08Å; H946-C992 PolarHBondContact O-N 3.23Å; G948-C992 VanDerWaalsContact CA-SG 3.59Å; C992-D996 WeakPolarHBondContact CA-O 3.44Å; C992-Q997 HydrophobicContact CB-CG 4.45Å
993	T	83.9	Confident	84.5	Confident	16 Å²	16	55.4 Å²	55.4	10%	0.098	29%	0.294	C	S	.	.			trans	-99	-178.1	156.5	68.3	0	0	0	0	108.4	L910 I945 E995 D996 F998	L910-T993 HydrophobicContact CD2-CG2 4.14Å; I945-T993 HydrophobicContact CG1-CG2 4.46Å; T993-E995 PolarHBondContact O-N 3.43Å; T993-E995 PolarHBondContact OG1-N 3.09Å; T993-D996 PolarHBondContact N-O 2.93Å; T993-D996 PolarHBondContact OG1-N 3.43Å; T993-D996 PolarHBondContact OG1-O 3.21Å; T993-F998 HydrophobicContact CG2-CE2 4.37Å
994	K	80.3	Confident	84.7	Confident	111 Å²	111	54 Å²	54	48%	0.483	28%	0.284	S	S	.	.	S	Bend	trans	-54.3	-25.6	170.1	-164.9	178	-164.9	-179.7	0	115.2	E943 E944	E943-K994 HydrophobicContact CB-CB 4.44Å; E943-K994 HydrophobicContact CB-CD 4.03Å; E943-K994 PolarHBondContact O-N 3.07Å; E943-K994 VanDerWaalsContact O-N 3.16Å; E943-K994 IonicContact OE2-NZ 3.82Å; E943-K994 PolarHBondContact OE2-NZ 3.27Å; E944-K994 HydrophobicContact CB-CB 4.35Å
995	E	77.9	Confident	84.9	Confident	173 Å²	173	54.1 Å²	54.1	81%	0.808	29%	0.288	S	S	*	.	S	Bend	trans	-124.9	-21.7	-170.2	-63.9	-177.5	-174.3	0	0	114.4	T993	T993-E995 PolarHBondContact O-N 3.43Å; T993-E995 PolarHBondContact OG1-N 3.09Å
996	D	81.1	Confident	85.1	Confident	45 Å²	45	48.5 Å²	48.5	24%	0.241	26%	0.262	C	S	.	.			trans	-136.6	152.7	-171.9	-95.2	-64	0	0	0	113.2	K908 C992 T993 F998	K908-D996 WeakPolarHBondContact CD-OD2 3.41Å; K908-D996 WeakPolarHBondContact CE-OD2 3.44Å; K908-D996 IonicContact NZ-OD1 3.04Å; K908-D996 PolarHBondContact NZ-OD1 3.35Å; K908-D996 IonicContact NZ-OD2 2.94Å; K908-D996 PolarHBondContact NZ-OD2 3.42Å; C992-D996 WeakPolarHBondContact CA-O 3.44Å; T993-D996 PolarHBondContact N-O 2.93Å; T993-D996 PolarHBondContact OG1-N 3.43Å; T993-D996 PolarHBondContact OG1-O 3.21Å; D996-F998 HydrophobicContact CB-CE1 4.33Å; D996-F998 HydrophobicContact CB-CE2 3.84Å; D996-F998 HydrophobicContact CB-CZ 3.61Å
997	Q	85	Confident	85.1	Confident	133 Å²	133	46.9 Å²	46.9	62%	0.621	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-127.3	123.5	-179.8	-57.1	-173.6	-14.5	0	0	111.1	C992	C992-Q997 HydrophobicContact CB-CG 4.45Å
998	F	86.1	Confident	85.3	Confident	22 Å²	22	47.8 Å²	47.8	10%	0.096	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	111.5	-176.6	-53.2	-72.4	0	0	0	110.4	L902 T906 G907 K908 L910 Q990 L991 T993 D996 V1000	L902-F998 HydrophobicContact CD1-CB 4.22Å; L902-F998 HydrophobicContact CD1-CD1 4.4Å; L902-F998 HydrophobicContact CD1-CG 4.4Å; L902-F998 HydrophobicContact CD2-CB 3.89Å; L902-F998 HydrophobicContact CD2-CD1 4.32Å; L902-F998 HydrophobicContact CD2-CD2 3.89Å; L902-F998 HydrophobicContact CD2-CG 3.76Å; T906-F998 WeakPolarHBondContact O-CE1 3.45Å; G907-F998 VanDerWaalsContact O-CZ 3.32Å; G907-F998 WeakPolarHBondContact O-CZ 3.28Å; K908-F998 HydrophobicContact CB-CZ 4.4Å; K908-F998 HydrophobicContact CD-CE1 4.49Å; K908-F998 HydrophobicContact CD-CZ 4.39Å; L910-F998 HydrophobicContact CD2-CE2 4.49Å; Q990-F998 CarbonylContact C-O 3.5Å; Q990-F998 WeakPolarHBondContact CA-O 3.4Å; L991-F998 PolarHBondContact N-O 3.39Å; L991-F998 PolarHBondContact O-N 2.89Å; T993-F998 HydrophobicContact CG2-CE2 4.37Å; D996-F998 HydrophobicContact CB-CE1 4.33Å; D996-F998 HydrophobicContact CB-CE2 3.84Å; D996-F998 HydrophobicContact CB-CZ 3.61Å; F998-V1000 PolarHBondContact O-N 2.89Å
999	S	84.4	Confident	85.4	Confident	95 Å²	95	44 Å²	44	66%	0.664	23%	0.233	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	125.5	174.7	-65.2	0	0	0	0	110.5
1000	V	86.8	Confident	85.4	Confident	12 Å²	12	43.6 Å²	43.6	7%	0.073	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	158.4	-176	-64.9	0	0	0	0	111.6	L901 L902 N988 F989 L991 F998	L901-V1000 HydrophobicContact CD1-CB 3.82Å; L901-V1000 HydrophobicContact CD1-CG2 4.24Å; L901-V1000 HydrophobicContact CD2-CB 4.5Å; L901-V1000 HydrophobicContact CD2-CG2 4.22Å; L901-V1000 HydrophobicContact CG-CB 3.9Å; L901-V1000 HydrophobicContact CG-CG1 4.13Å; L901-V1000 HydrophobicContact CG-CG2 4.17Å; L902-V1000 HydrophobicContact CB-CG1 4.44Å; N988-V1000 WeakPolarHBondContact CA-O 3.48Å; F989-V1000 HydrophobicContact CD2-CG2 3.75Å; F989-V1000 HydrophobicContact CE1-CG2 4.37Å; F989-V1000 HydrophobicContact CE2-CG2 3.48Å; F989-V1000 VanDerWaalsContact CE2-CG2 3.48Å; F989-V1000 HydrophobicContact CG-CG2 4.32Å; F989-V1000 HydrophobicContact CZ-CG2 3.81Å; F989-V1000 PolarHBondContact N-O 3.06Å; F989-V1000 WeakPolarHBondContact O-CG2 3.14Å; F989-V1000 PolarHBondContact O-N 3.08Å; L991-V1000 HydrophobicContact CD1-CG1 4.32Å; L991-V1000 HydrophobicContact CD1-CG2 4.01Å; L991-V1000 HydrophobicContact CG-CG2 3.98Å; F998-V1000 PolarHBondContact O-N 2.89Å
1001	S	87.2	Confident	85.4	Confident	67 Å²	67	43 Å²	43	47%	0.469	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	124.9	-175.3	60.9	0	0	0	0	112	A987 N988	A987-S1001 WeakPolarHBondContact O-CA 3.45Å; N988-S1001 WeakPolarHBondContact OD1-CB 3.29Å
1002	I	88.3	Confident	85.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122	174.2	-68.1	-179.1	0	0	0	109.3	L901 Y914 F916 V930 M976 I978 F980 A986 A987 F989	L901-I1002 HydrophobicContact CD1-CD1 4.29Å; L901-I1002 HydrophobicContact CD1-CG1 3.6Å; L901-I1002 HydrophobicContact CD2-CD1 4.22Å; L901-I1002 HydrophobicContact CD2-CG1 4.41Å; Y914-I1002 HydrophobicContact CD1-CG1 4.49Å; Y914-I1002 HydrophobicContact CD2-CD1 4.24Å; Y914-I1002 HydrophobicContact CD2-CG1 4.36Å; Y914-I1002 HydrophobicContact CD2-CG2 4.12Å; Y914-I1002 HydrophobicContact CE1-CG1 4.38Å; Y914-I1002 HydrophobicContact CE2-CB 4.45Å; Y914-I1002 HydrophobicContact CE2-CG1 4.29Å; Y914-I1002 HydrophobicContact CE2-CG2 3.67Å; Y914-I1002 HydrophobicContact CG-CD1 4.26Å; Y914-I1002 HydrophobicContact CG-CG1 4.44Å; F916-I1002 HydrophobicContact CZ-CG2 4.27Å; V930-I1002 HydrophobicContact CG1-CD1 4.19Å; M976-I1002 HydrophobicContact SD-CD1 4.04Å; I978-I1002 HydrophobicContact CD1-CB 4.33Å; I978-I1002 HydrophobicContact CD1-CD1 4.29Å; I978-I1002 HydrophobicContact CD1-CG2 4.2Å; F980-I1002 HydrophobicContact CZ-CG2 4.2Å; A986-I1002 CarbonylContact C-O 3.55Å; A986-I1002 WeakPolarHBondContact CA-O 3.35Å; A987-I1002 PolarHBondContact N-O 3.11Å; A987-I1002 PolarHBondContact O-N 3.41Å; F989-I1002 HydrophobicContact CE1-CB 4.45Å; F989-I1002 HydrophobicContact CE1-CD1 3.8Å; F989-I1002 HydrophobicContact CE1-CG1 3.93Å; F989-I1002 HydrophobicContact CZ-CD1 3.76Å; F989-I1002 HydrophobicContact CZ-CG1 4.18Å
1003	Q	86.6	Confident	85.4	Confident	114 Å²	114	43.3 Å²	43.3	53%	0.533	23%	0.231	S	C	.	.			trans	-114.6	128.1	174.7	-168.6	176.8	21.1	0	0	110.3	T984 A986	T984-Q1003 PolarHBondContact O-NE2 3.39Å; A986-Q1003 HydrophobicContact CB-CB 4.2Å
1004	P	86.6	Confident	85.2	Confident	7 Å²	7	45.1 Å²	45.1	5%	0.045	24%	0.242	C	C	.	.			trans	-86.1	144.5	179.5	35.4	-34.3	0	0	0	111.2	F916 F980 L1009	F916-P1004 HydrophobicContact CE1-CB 4.45Å; F916-P1004 HydrophobicContact CZ-CB 4.24Å; F980-P1004 HydrophobicContact CD1-CG 3.61Å; F980-P1004 HydrophobicContact CD2-CB 4.38Å; F980-P1004 HydrophobicContact CD2-CG 4.14Å; F980-P1004 HydrophobicContact CE1-CB 4.39Å; F980-P1004 VanDerWaalsContact CE1-CD 3.48Å; F980-P1004 HydrophobicContact CE1-CG 3.69Å; F980-P1004 HydrophobicContact CE2-CB 4.15Å; F980-P1004 HydrophobicContact CE2-CG 4.17Å; F980-P1004 HydrophobicContact CG-CG 3.86Å; F980-P1004 HydrophobicContact CZ-CB 4.16Å; F980-P1004 HydrophobicContact CZ-CG 3.96Å; P1004-L1009 HydrophobicContact CB-CD2 3.73Å; P1004-L1009 HydrophobicContact CB-CG 4.14Å; P1004-L1009 HydrophobicContact CG-CD1 4.25Å; P1004-L1009 HydrophobicContact CG-CD2 3.79Å; P1004-L1009 HydrophobicContact CG-CG 4.22Å
1005	A	86	Confident	85	Confident	38 Å²	38	40.7 Å²	40.7	31%	0.314	22%	0.223	S	C	.	.			trans	-76.4	148.5	160.3	0	0	0	0	0	109.4	G1007 E1008	A1005-G1007 PolarHBondContact O-N 3.21Å; A1005-G1007 VanDerWaalsContact O-N 3.13Å; A1005-E1008 HydrophobicContact CB-CG 4.38Å; A1005-E1008 PolarHBondContact O-N 3.28Å
1006	V	87	Confident	85.3	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.012	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-58	-34	-175.8	178.1	0	0	0	0	112.2	T984 E1008 L1009 M1106 M1109 L1110	T984-V1006 HydrophobicContact CG2-CG2 3.51Å; V1006-E1008 PolarHBondContact O-N 3.38Å; V1006-L1009 WeakPolarHBondContact O-CB 3.36Å; V1006-L1009 PolarHBondContact O-N 3.07Å; V1006-L1009 VanDerWaalsContact O-N 3.12Å; V1006-M1106 HydrophobicContact CG1-CB 3.95Å; V1006-M1106 HydrophobicContact CG1-CE 3.97Å; V1006-M1106 HydrophobicContact CG1-CG 4.43Å; V1006-M1109 HydrophobicContact CG2-CB 3.77Å; V1006-M1109 HydrophobicContact CG2-CE 4.41Å; V1006-M1109 HydrophobicContact CG2-SD 4.43Å; V1006-L1110 HydrophobicContact CB-CB 4.49Å; V1006-L1110 HydrophobicContact CG1-CB 4.02Å
1007	G	85.4	Confident	85.4	Confident	2 Å²	2	39.9 Å²	39.9	2%	0.021	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-66.1	-17.9	177.1	0	0	0	0	0	115.5	A1005 V1056 N1058	A1005-G1007 PolarHBondContact O-N 3.21Å; A1005-G1007 VanDerWaalsContact O-N 3.13Å; G1007-V1056 WeakPolarHBondContact CA-O 3.24Å; G1007-N1058 WeakPolarHBondContact O-CB 3.31Å; G1007-N1058 PolarHBondContact O-N 2.75Å
1008	E	87.7	Confident	85.2	Confident	20 Å²	20	37.9 Å²	37.9	9%	0.093	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-90	-14.4	174.1	-52.4	-60.6	161.2	0	0	112.4	F916 R918 A1005 V1006 L1010	F916-E1008 HydrophobicContact CB-CB 4.44Å; F916-E1008 HydrophobicContact CB-CG 4.22Å; F916-E1008 HydrophobicContact CD1-CB 4.17Å; F916-E1008 HydrophobicContact CD2-CB 4.34Å; F916-E1008 HydrophobicContact CD2-CG 3.82Å; F916-E1008 HydrophobicContact CE2-CG 4.33Å; F916-E1008 HydrophobicContact CG-CB 4.05Å; F916-E1008 HydrophobicContact CG-CG 3.93Å; R918-E1008 VanDerWaalsContact CG-OE2 3.28Å; R918-E1008 WeakPolarHBondContact CG-OE2 3.31Å; R918-E1008 IonicContact CZ-OE1 2.71Å; R918-E1008 IonicContact CZ-OE2 3.88Å; R918-E1008 IonicContact NE-OE1 2.87Å; R918-E1008 PolarHBondContact NE-OE1 2.98Å; R918-E1008 IonicContact NE-OE2 2.68Å; R918-E1008 PolarHBondContact NE-OE2 2.87Å; R918-E1008 IonicContact NH2-OE1 3.19Å; R918-E1008 PolarHBondContact NH2-OE1 3.49Å; R918-E1008 IonicContact NH2-OE2 2.71Å; A1005-E1008 HydrophobicContact CB-CG 4.38Å; A1005-E1008 PolarHBondContact O-N 3.28Å; V1006-E1008 PolarHBondContact O-N 3.38Å; E1008-L1010 PolarHBondContact O-N 3.17Å
1009	L	88.6	Confident	85.1	Confident	1 Å²	1	40 Å²	40	1%	0.005	23%	0.227	C	C	.	.	S	Bend	trans	-82.1	8	172	-58.4	-177.8	0	0	0	112.7	V928 F980 T984 P1004 V1006 T1076 V1077 M1106	V928-L1009 HydrophobicContact CG2-CD2 3.97Å; F980-L1009 HydrophobicContact CB-CD2 3.78Å; F980-L1009 HydrophobicContact CD2-CD2 3.73Å; F980-L1009 HydrophobicContact CG-CD2 3.93Å; T984-L1009 HydrophobicContact CG2-CD1 4.38Å; P1004-L1009 HydrophobicContact CB-CD2 3.73Å; P1004-L1009 HydrophobicContact CB-CG 4.14Å; P1004-L1009 HydrophobicContact CG-CD1 4.25Å; P1004-L1009 HydrophobicContact CG-CD2 3.79Å; P1004-L1009 HydrophobicContact CG-CG 4.22Å; V1006-L1009 WeakPolarHBondContact O-CB 3.36Å; V1006-L1009 PolarHBondContact O-N 3.07Å; V1006-L1009 VanDerWaalsContact O-N 3.12Å; L1009-T1076 WeakPolarHBondContact O-CA 3.44Å; L1009-V1077 PolarHBondContact O-N 3.5Å; L1009-M1106 HydrophobicContact CB-CE 4.15Å; L1009-M1106 HydrophobicContact CD1-CE 4.26Å
1010	L	88.8	Confident	85.2	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	153.5	-177.9	-57.7	-177.7	0	0	0	111.9	E1008 A1057 N1058 V1059 R1075 T1076 V1083 L1110	E1008-L1010 PolarHBondContact O-N 3.17Å; L1010-A1057 HydrophobicContact CD1-CB 4.45Å; L1010-N1058 WeakPolarHBondContact O-CB 3.45Å; L1010-N1058 PolarHBondContact O-ND2 3.35Å; L1010-V1059 HydrophobicContact CD1-CG1 3.81Å; L1010-R1075 CarbonylContact C-O 3.58Å; L1010-R1075 WeakPolarHBondContact CA-O 3.4Å; L1010-T1076 HydrophobicContact CD2-CG2 4.07Å; L1010-V1083 HydrophobicContact CD1-CG1 4.41Å; L1010-V1083 HydrophobicContact CD2-CB 4.31Å; L1010-V1083 HydrophobicContact CD2-CG2 3.8Å; L1010-L1110 HydrophobicContact CD1-CD2 4.02Å
1011	M	85.5	Confident	85	Confident	39 Å²	39	36.5 Å²	36.5	19%	0.192	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.9	172.7	-169.7	178	-65.9	0	0	108.5	V888 S1013 N1058 G1074 R1075 V1077	V888-M1011 HydrophobicContact CB-SD 4.26Å; V888-M1011 HydrophobicContact CG1-CG 3.87Å; V888-M1011 HydrophobicContact CG1-SD 3.47Å; V888-M1011 WeakPolarHBondContact CG1-SD 3.39Å; V888-M1011 HydrophobicContact CG2-SD 3.71Å; M1011-S1013 PolarHBondContact O-N 3.46Å; M1011-N1058 CarbonylContact C-O 3.48Å; M1011-G1074 CarbonylContact O-C 3.51Å; M1011-G1074 WeakPolarHBondContact O-CA 3.34Å; M1011-R1075 PolarHBondContact N-O 3.49Å; M1011-R1075 PolarHBondContact O-N 3.08Å; M1011-V1077 HydrophobicContact CB-CG2 4.34Å; M1011-V1077 HydrophobicContact CE-CG2 4.31Å
1012	P	87	Confident	85	Confident	7 Å²	7	36.1 Å²	36.1	5%	0.045	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	135.6	-178	27.6	-35.9	0	0	0	110.9
1013	S	82.9	Confident	84.8	Confident	3 Å²	3	38.7 Å²	38.7	2%	0.021	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-124.4	111.7	177.6	-173.3	0	0	0	0	108.7	M1011 A1073 R1075	M1011-S1013 PolarHBondContact O-N 3.46Å; S1013-A1073 PolarHBondContact N-O 2.78Å; S1013-A1073 WeakPolarHBondContact O-CB 3.29Å; S1013-R1075 PolarHBondContact OG-NE 3.29Å
1014	T	79.1	Confident	84.7	Confident	54 Å²	54	35.1 Å²	35.1	33%	0.331	20%	0.195	S	C	.	.			trans	-79.1	131.5	173.4	45.1	0	0	0	0	110.8	T889	T889-T1014 HydrophobicContact CG2-CG2 3.69Å; T889-T1014 WeakPolarHBondContact CG2-OG1 3.2Å
1015	M	77.9	Confident	84.7	Confident	18 Å²	18	42.3 Å²	42.3	9%	0.089	23%	0.225	C	C	.	.			trans	-148.7	159.2	176.4	68.3	-166.7	-44.6	0	0	110	M886 D1019 F1020 E1023 V1062 A1073 L1084	M886-M1015 HydrophobicContact CE-CB 3.55Å; M1015-D1019 HydrophobicContact CB-CB 4.46Å; M1015-D1019 HydrophobicContact CE-CB 4.03Å; M1015-F1020 HydrophobicContact CE-CB 4.39Å; M1015-F1020 HydrophobicContact CG-CB 4.19Å; M1015-F1020 HydrophobicContact CG-CD2 4.38Å; M1015-F1020 HydrophobicContact SD-CB 4.05Å; M1015-F1020 HydrophobicContact SD-CD2 3.86Å; M1015-F1020 HydrophobicContact SD-CG 4.38Å; M1015-E1023 HydrophobicContact CE-CB 4.47Å; M1015-E1023 HydrophobicContact CE-CG 4Å; M1015-V1062 HydrophobicContact CG-CG2 3.85Å; M1015-A1073 HydrophobicContact CG-CB 4.09Å; M1015-A1073 HydrophobicContact SD-CB 3.56Å; M1015-A1073 VanDerWaalsContact SD-CB 3.56Å; M1015-L1084 HydrophobicContact SD-CD2 3.78Å
1016	K	83.8	Confident	84.6	Confident	154 Å²	154	46.8 Å²	46.8	67%	0.67	24%	0.238	S	C	*	.			trans	-85.1	158.2	178.9	-56	-177.7	178.2	-178	0	110.5	P1018 D1019 F1020	K1016-P1018 HydrophobicContact CB-CG 4.28Å; K1016-D1019 WeakPolarHBondContact CB-OD2 3.39Å; K1016-D1019 PolarHBondContact N-OD2 2.98Å; K1016-D1019 WeakPolarHBondContact O-CB 3.3Å; K1016-D1019 PolarHBondContact O-N 3.5Å; K1016-D1019 VanDerWaalsContact O-N 3.12Å; K1016-F1020 PolarHBondContact O-N 3.44Å
1017	E	81.9	Confident	84.3	Confident	48 Å²	48	47.2 Å²	47.2	22%	0.224	24%	0.24	C	C	.	.	H	α-helix	trans	-49.4	-46.9	177.2	174.4	157.3	-179.9	0	0	114.9	D1019 F1020 C1021 S1064 R1071	E1017-D1019 VanDerWaalsContact C-N 3.35Å; E1017-D1019 PolarHBondContact O-N 2.86Å; E1017-F1020 PolarHBondContact O-N 3.06Å; E1017-C1021 PolarHBondContact O-N 2.66Å; E1017-C1021 PolarHBondContact O-SG 2.76Å; E1017-S1064 WeakPolarHBondContact OE2-CA 3.32Å; E1017-R1071 VanDerWaalsContact CD-CZ 3.48Å; E1017-R1071 IonicContact OE1-CZ 2.59Å; E1017-R1071 IonicContact OE1-NH1 2.79Å; E1017-R1071 PolarHBondContact OE1-NH1 2.89Å; E1017-R1071 IonicContact OE1-NH2 3.52Å; E1017-R1071 PolarHBondContact OE1-NH2 2.98Å; E1017-R1071 IonicContact OE2-CZ 2.7Å; E1017-R1071 IonicContact OE2-NH1 3.4Å; E1017-R1071 PolarHBondContact OE2-NH1 2.89Å
1018	P	82.1	Confident	84.1	Confident	91 Å²	91	52.4 Å²	52.4	59%	0.591	27%	0.265	S	S	*	.	H	α-helix	trans	-63.9	-37.6	177.7	24	-34.9	0	0	0	113	K1016 C1021 S1022	K1016-P1018 HydrophobicContact CB-CG 4.28Å; P1018-C1021 PolarHBondContact O-N 3.14Å; P1018-S1022 WeakPolarHBondContact O-CB 3.47Å; P1018-S1022 PolarHBondContact O-N 2.91Å
1019	D	82.9	Confident	83.8	Confident	67 Å²	67	54 Å²	54	36%	0.358	29%	0.287	S	S	.	.	H	α-helix	trans	-66.1	-44.7	178.4	-50.3	-37.8	0	0	0	110.3	M1015 K1016 E1017 C1021 S1022 E1023	M1015-D1019 HydrophobicContact CB-CB 4.46Å; M1015-D1019 HydrophobicContact CE-CB 4.03Å; K1016-D1019 WeakPolarHBondContact CB-OD2 3.39Å; K1016-D1019 PolarHBondContact N-OD2 2.98Å; K1016-D1019 WeakPolarHBondContact O-CB 3.3Å; K1016-D1019 PolarHBondContact O-N 3.5Å; K1016-D1019 VanDerWaalsContact O-N 3.12Å; E1017-D1019 VanDerWaalsContact C-N 3.35Å; E1017-D1019 PolarHBondContact O-N 2.86Å; D1019-C1021 VanDerWaalsContact C-N 3.32Å; D1019-C1021 PolarHBondContact O-N 2.97Å; D1019-S1022 WeakPolarHBondContact O-CB 3.42Å; D1019-S1022 PolarHBondContact O-N 3.43Å; D1019-S1022 VanDerWaalsContact O-N 3.09Å; D1019-E1023 PolarHBondContact O-N 2.68Å
1020	F	86.4	Confident	83.3	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-56.4	-47.8	175.1	-175.4	-76.7	0	0	0	110.8	M1015 K1016 E1017 S1022 E1023 Q1024 V1062 R1071 A1073 L1084 T1086	M1015-F1020 HydrophobicContact CE-CB 4.39Å; M1015-F1020 HydrophobicContact CG-CB 4.19Å; M1015-F1020 HydrophobicContact CG-CD2 4.38Å; M1015-F1020 HydrophobicContact SD-CB 4.05Å; M1015-F1020 HydrophobicContact SD-CD2 3.86Å; M1015-F1020 HydrophobicContact SD-CG 4.38Å; K1016-F1020 PolarHBondContact O-N 3.44Å; E1017-F1020 PolarHBondContact O-N 3.06Å; F1020-S1022 PolarHBondContact O-N 2.87Å; F1020-E1023 PolarHBondContact O-N 3.02Å; F1020-Q1024 HydrophobicContact CD1-CB 4.49Å; F1020-Q1024 WeakPolarHBondContact O-CB 3.42Å; F1020-Q1024 PolarHBondContact O-N 3.17Å; F1020-V1062 HydrophobicContact CD2-CG2 4.1Å; F1020-R1071 HydrophobicContact CD1-CG 4.18Å; F1020-R1071 HydrophobicContact CD2-CB 4.2Å; F1020-R1071 HydrophobicContact CE1-CB 4.2Å; F1020-R1071 HydrophobicContact CE1-CG 3.77Å; F1020-R1071 HydrophobicContact CE2-CB 3.8Å; F1020-R1071 HydrophobicContact CE2-CG 4.3Å; F1020-R1071 HydrophobicContact CZ-CB 3.79Å; F1020-R1071 HydrophobicContact CZ-CG 3.83Å; F1020-A1073 HydrophobicContact CD2-CB 4.38Å; F1020-A1073 HydrophobicContact CE2-CB 4.46Å; F1020-L1084 HydrophobicContact CD2-CD1 4.49Å; F1020-L1084 HydrophobicContact CD2-CD2 3.87Å; F1020-L1084 HydrophobicContact CE2-CB 3.89Å; F1020-L1084 HydrophobicContact CE2-CD1 4.45Å; F1020-L1084 HydrophobicContact CE2-CD2 3.79Å; F1020-L1084 HydrophobicContact CE2-CG 4.25Å; F1020-L1084 HydrophobicContact CZ-CB 3.88Å; F1020-T1086 WeakPolarHBondContact CZ-OG1 3.43Å
1021	C	83.8	Confident	83	Confident	33 Å²	33	64.7 Å²	64.7	22%	0.223	34%	0.34	C	S	.	.	H	α-helix	trans	-68.8	-23.1	179.4	-62.3	0	0	0	0	113	E1017 P1018 D1019 K1025 R1071	E1017-C1021 PolarHBondContact O-N 2.66Å; E1017-C1021 PolarHBondContact O-SG 2.76Å; P1018-C1021 PolarHBondContact O-N 3.14Å; D1019-C1021 VanDerWaalsContact C-N 3.32Å; D1019-C1021 PolarHBondContact O-N 2.97Å; C1021-K1025 WeakPolarHBondContact O-CD 3.2Å; C1021-K1025 VanDerWaalsContact O-CG 3.24Å; C1021-K1025 WeakPolarHBondContact O-CG 3.46Å; C1021-K1025 PolarHBondContact O-N 3.17Å; C1021-R1071 PolarHBondContact SG-NH2 2.94Å
1022	S	85.9	Confident	83.1	Confident	58 Å²	58	66.1 Å²	66.1	41%	0.406	35%	0.347	S	S	.	.	H	α-helix	trans	-75.5	-50.6	173.7	-170.6	0	0	0	0	111.4	P1018 D1019 F1020 K1025	P1018-S1022 WeakPolarHBondContact O-CB 3.47Å; P1018-S1022 PolarHBondContact O-N 2.91Å; D1019-S1022 WeakPolarHBondContact O-CB 3.42Å; D1019-S1022 PolarHBondContact O-N 3.43Å; D1019-S1022 VanDerWaalsContact O-N 3.09Å; F1020-S1022 PolarHBondContact O-N 2.87Å; S1022-K1025 PolarHBondContact O-N 3.08Å
1023	E	84.6	Confident	83.1	Confident	54 Å²	54	67.7 Å²	67.7	25%	0.252	36%	0.356	S	S	.	.	H	α-helix	trans	-67.8	-37.8	178.3	-59.7	-49.2	135.3	0	0	112.1	M1015 D1019 F1020 K1025 K1026 L1027 L1082 L1084	M1015-E1023 HydrophobicContact CE-CB 4.47Å; M1015-E1023 HydrophobicContact CE-CG 4Å; D1019-E1023 PolarHBondContact O-N 2.68Å; F1020-E1023 PolarHBondContact O-N 3.02Å; E1023-K1025 VanDerWaalsContact C-N 3.29Å; E1023-K1025 PolarHBondContact O-N 3.18Å; E1023-K1026 WeakPolarHBondContact O-CB 3.39Å; E1023-K1026 PolarHBondContact O-N 3.33Å; E1023-K1026 IonicContact OE1-NZ 3.16Å; E1023-K1026 PolarHBondContact OE1-NZ 3.45Å; E1023-K1026 WeakPolarHBondContact OE2-CD 3.4Å; E1023-K1026 WeakPolarHBondContact OE2-CE 3.38Å; E1023-K1026 IonicContact OE2-NZ 2.7Å; E1023-K1026 PolarHBondContact OE2-NZ 2.99Å; E1023-L1027 PolarHBondContact O-N 2.95Å; E1023-L1082 HydrophobicContact CB-CD2 3.67Å; E1023-L1082 HydrophobicContact CG-CD2 3.99Å; E1023-L1084 HydrophobicContact CB-CD1 4.11Å
1024	Q	85.1	Confident	83.4	Confident	40 Å²	40	70 Å²	70	19%	0.187	37%	0.372	C	S	.	.	H	α-helix	trans	-58.4	-40.4	175.1	-176.3	166.9	45.3	0	0	112	F1020 K1026 L1027 M1028 L1084 T1086 N1100	F1020-Q1024 HydrophobicContact CD1-CB 4.49Å; F1020-Q1024 WeakPolarHBondContact O-CB 3.42Å; F1020-Q1024 PolarHBondContact O-N 3.17Å; Q1024-K1026 VanDerWaalsContact C-N 3.25Å; Q1024-K1026 PolarHBondContact O-N 2.93Å; Q1024-L1027 CarbonylContact O-C 3.53Å; Q1024-L1027 PolarHBondContact O-N 2.83Å; Q1024-M1028 VanDerWaalsContact O-CG 3.22Å; Q1024-M1028 WeakPolarHBondContact O-CG 3.25Å; Q1024-M1028 PolarHBondContact O-N 3Å; Q1024-L1084 HydrophobicContact CB-CD1 3.98Å; Q1024-T1086 PolarHBondContact NE2-OG1 3.25Å; Q1024-N1100 PolarHBondContact NE2-OD1 2.72Å
1025	K	85.8	Confident	83.7	Confident	157 Å²	157	68.5 Å²	68.5	68%	0.683	37%	0.366	S	S	*	.	H	α-helix	trans	-63.5	-27.1	175.9	-76.8	170.1	-174.9	175.6	0	113.6	C1021 S1022 E1023	C1021-K1025 WeakPolarHBondContact O-CD 3.2Å; C1021-K1025 VanDerWaalsContact O-CG 3.24Å; C1021-K1025 WeakPolarHBondContact O-CG 3.46Å; C1021-K1025 PolarHBondContact O-N 3.17Å; S1022-K1025 PolarHBondContact O-N 3.08Å; E1023-K1025 VanDerWaalsContact C-N 3.29Å; E1023-K1025 PolarHBondContact O-N 3.18Å
1026	K	84.8	Confident	83.9	Confident	132 Å²	132	71.6 Å²	71.6	57%	0.574	39%	0.386	S	S	*	.	H	α-helix	trans	-77.8	-26.1	173.9	-55.4	177.7	-157.3	165.3	0	112.3	E1023 Q1024	E1023-K1026 WeakPolarHBondContact O-CB 3.39Å; E1023-K1026 PolarHBondContact O-N 3.33Å; E1023-K1026 IonicContact OE1-NZ 3.16Å; E1023-K1026 PolarHBondContact OE1-NZ 3.45Å; E1023-K1026 WeakPolarHBondContact OE2-CD 3.4Å; E1023-K1026 WeakPolarHBondContact OE2-CE 3.38Å; E1023-K1026 IonicContact OE2-NZ 2.7Å; E1023-K1026 PolarHBondContact OE2-NZ 2.99Å; Q1024-K1026 VanDerWaalsContact C-N 3.25Å; Q1024-K1026 PolarHBondContact O-N 2.93Å
1027	L	81.3	Confident	83.8	Confident	11 Å²	11	64.4 Å²	64.4	6%	0.058	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	26.1	-174.4	-62.2	175	0	0	0	113.3	E1023 Q1024 N1031 L1082 N1100 E1102	E1023-L1027 PolarHBondContact O-N 2.95Å; Q1024-L1027 CarbonylContact O-C 3.53Å; Q1024-L1027 PolarHBondContact O-N 2.83Å; L1027-N1031 HydrophobicContact CB-CB 4.45Å; L1027-N1031 HydrophobicContact CD2-CB 4.48Å; L1027-N1031 CarbonylContact O-C 3.53Å; L1027-L1082 HydrophobicContact CD1-CB 4.43Å; L1027-L1082 HydrophobicContact CD1-CD2 4.26Å; L1027-N1100 HydrophobicContact CB-CB 3.93Å; L1027-N1100 PolarHBondContact O-ND2 3.16Å; L1027-E1102 HydrophobicContact CD2-CG 3.79Å
1028	M	80.4	Confident	83.7	Confident	111 Å²	111	66.7 Å²	66.7	55%	0.547	37%	0.372	S	S	.	.			trans	-82.5	165.8	174.4	-60.1	-166.8	73.3	0	0	112.4	Q1024 M1030	Q1024-M1028 VanDerWaalsContact O-CG 3.22Å; Q1024-M1028 WeakPolarHBondContact O-CG 3.25Å; Q1024-M1028 PolarHBondContact O-N 3Å; M1028-M1030 PolarHBondContact O-N 2.88Å
1029	G	80.8	Confident	83.1	Confident	55 Å²	55	62.8 Å²	62.8	57%	0.567	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	80.6	-117.9	174.2	0	0	0	0	0	112.3	N1031 E1032	G1029-N1031 PolarHBondContact O-N 3Å; G1029-E1032 WeakPolarHBondContact O-CB 3.31Å; G1029-E1032 PolarHBondContact O-N 2.95Å; G1029-E1032 VanDerWaalsContact O-N 3.14Å
1030	M	77.9	Confident	82.3	Confident	179 Å²	179	61 Å²	61	88%	0.882	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-64.3	-19.6	-177.1	-77.8	-175.6	161.9	0	0	114.3	M1028 T1104	M1028-M1030 PolarHBondContact O-N 2.88Å; M1030-T1104 VanDerWaalsContact O-CG2 3.28Å; M1030-T1104 WeakPolarHBondContact O-CG2 3.39Å
1031	N	83.8	Confident	81	Confident	47 Å²	47	67 Å²	67	25%	0.251	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-96.4	8.1	179.3	-67.6	-3	0	0	0	112.9	L1027 G1029 N1100 T1101	L1027-N1031 HydrophobicContact CB-CB 4.45Å; L1027-N1031 HydrophobicContact CD2-CB 4.48Å; L1027-N1031 CarbonylContact O-C 3.53Å; G1029-N1031 PolarHBondContact O-N 3Å; N1031-N1100 CarbonylContact O-C 3.24Å; N1031-N1100 WeakPolarHBondContact O-CA 3.23Å; N1031-T1101 WeakPolarHBondContact CB-O 3.43Å; N1031-T1101 PolarHBondContact O-N 3.37Å
1032	E	87.6	Confident	79.6	Confident	69 Å²	69	68.1 Å²	68.1	32%	0.322	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	136.9	179.8	-172.6	178.8	154.6	0	0	110.6	G1029 S1034 T1098 N1100	G1029-E1032 WeakPolarHBondContact O-CB 3.31Å; G1029-E1032 PolarHBondContact O-N 2.95Å; G1029-E1032 VanDerWaalsContact O-N 3.14Å; E1032-S1034 PolarHBondContact OE1-OG 3.49Å; E1032-T1098 HydrophobicContact CG-CG2 3.92Å; E1032-N1100 WeakPolarHBondContact CG-ND2 3.29Å
1033	T	86.9	Confident	78.3	Confident	40 Å²	40	65.6 Å²	65.6	25%	0.245	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	118.3	172.1	-45.2	0	0	0	0	109.9	I1099 L1111	T1033-I1099 PolarHBondContact N-O 3.28Å; T1033-I1099 PolarHBondContact O-N 2.92Å; T1033-L1111 HydrophobicContact CG2-CD2 3.65Å
1034	S	87.8	Confident	77.2	Confident	51 Å²	51	67.3 Å²	67.3	36%	0.357	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	138.9	-168.6	-64.4	0	0	0	0	111.3	E1032 L1097 T1098	E1032-S1034 PolarHBondContact OE1-OG 3.49Å; S1034-L1097 CarbonylContact C-O 3.59Å; S1034-L1097 WeakPolarHBondContact CA-O 3.5Å; S1034-T1098 WeakPolarHBondContact CB-OG1 3.4Å; S1034-T1098 WeakPolarHBondContact OG-CB 3.46Å; S1034-T1098 VanDerWaalsContact OG-CG2 3.28Å; S1034-T1098 WeakPolarHBondContact OG-CG2 3.47Å; S1034-T1098 PolarHBondContact OG-OG1 3.14Å
1035	A	85.4	Confident	76.3	Confident	24 Å²	24	67.8 Å²	67.8	20%	0.198	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	138.4	174	0	0	0	0	0	112.3	L1097 L1111	A1035-L1097 PolarHBondContact N-O 3.17Å; A1035-L1097 PolarHBondContact O-N 2.68Å; A1035-L1111 HydrophobicContact CB-CD1 4.22Å; A1035-L1111 HydrophobicContact CB-CD2 3.83Å; A1035-L1111 HydrophobicContact CB-CG 4.16Å
1036	T	83.4	Confident	75.5	Confident	82 Å²	82	64.5 Å²	64.5	50%	0.503	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	138.8	167.8	-44.4	0	0	0	0	110.3	A1095 K1115	T1036-A1095 WeakPolarHBondContact CA-O 3.3Å; T1036-K1115 PolarHBondContact O-NZ 3.45Å
1037	I	82.1	Confident	74.9	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.015	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	143.2	176.6	65.1	175.8	0	0	0	109.8	M1039 L1087 T1094 A1095 L1097 K1115 L1118	I1037-M1039 HydrophobicContact CD1-CE 4.39Å; I1037-M1039 HydrophobicContact CD1-SD 4.18Å; I1037-M1039 HydrophobicContact CG1-CG 4.47Å; I1037-L1087 HydrophobicContact CD1-CD1 4.47Å; I1037-T1094 WeakPolarHBondContact O-CA 3.38Å; I1037-A1095 HydrophobicContact CD1-CB 4.22Å; I1037-A1095 HydrophobicContact CG1-CB 3.83Å; I1037-A1095 PolarHBondContact N-O 3.2Å; I1037-A1095 PolarHBondContact O-N 3.09Å; I1037-L1097 HydrophobicContact CD1-CB 4.44Å; I1037-K1115 HydrophobicContact CG2-CB 3.93Å; I1037-K1115 HydrophobicContact CG2-CD 3.79Å; I1037-K1115 HydrophobicContact CG2-CG 3.63Å; I1037-L1118 HydrophobicContact CD1-CB 3.89Å; I1037-L1118 HydrophobicContact CD1-CD1 3.61Å; I1037-L1118 HydrophobicContact CD1-CG 4.37Å
1038	T	78.5	Confident	74.5	Confident	97 Å²	97	66.9 Å²	66.9	60%	0.595	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	123.7	167.6	-48.9	0	0	0	0	107.5
1039	M	70	Confident	74.4	Confident	9 Å²	9	61.6 Å²	61.6	4%	0.044	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-89.8	130.9	-176.1	-66.7	-100.9	49.2	0	0	109.8	I1037 N1043 S1093 A1095 L1118	I1037-M1039 HydrophobicContact CD1-CE 4.39Å; I1037-M1039 HydrophobicContact CD1-SD 4.18Å; I1037-M1039 HydrophobicContact CG1-CG 4.47Å; M1039-N1043 HydrophobicContact CE-CB 3.64Å; M1039-S1093 WeakPolarHBondContact CB-O 3.38Å; M1039-S1093 PolarHBondContact N-O 3.27Å; M1039-A1095 HydrophobicContact CG-CB 3.95Å; M1039-A1095 HydrophobicContact SD-CB 4.2Å; M1039-L1118 HydrophobicContact CE-CB 3.64Å; M1039-L1118 HydrophobicContact CE-CD2 3.98Å; M1039-L1118 HydrophobicContact CE-CG 4.34Å; M1039-L1118 WeakPolarHBondContact CE-O 3.48Å
1040	A	65.1	Low	74.3	Confident	30 Å²	30	60.2 Å²	60.2	25%	0.248	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-63.6	146.3	166.7	0	0	0	0	0	110.4	A1042 N1043 A1121	A1040-A1042 PolarHBondContact O-N 3.48Å; A1040-A1042 VanDerWaalsContact O-N 3.15Å; A1040-N1043 WeakPolarHBondContact O-CB 3.47Å; A1040-N1043 PolarHBondContact O-N 3.04Å; A1040-A1121 WeakPolarHBondContact CB-O 3.35Å
1041	T	59.3	Low	74.4	Confident	126 Å²	126	57.7 Å²	57.7	77%	0.773	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-60.7	-29.7	-171.2	46.8	0	0	0	0	113.6	N1043 T1044	T1041-N1043 VanDerWaalsContact C-N 3.27Å; T1041-N1043 PolarHBondContact O-N 3.02Å; T1041-T1044 PolarHBondContact O-N 3.23Å; T1041-T1044 PolarHBondContact O-OG1 3.36Å
1042	A	54.8	Low	74.2	Confident	56 Å²	56	57.9 Å²	57.9	46%	0.463	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-66.5	-24	174.3	0	0	0	0	0	114	A1040 T1044 N1048	A1040-A1042 PolarHBondContact O-N 3.48Å; A1040-A1042 VanDerWaalsContact O-N 3.15Å; A1042-T1044 VanDerWaalsContact C-N 3.35Å; A1042-T1044 PolarHBondContact O-N 2.68Å; A1042-N1048 PolarHBondContact O-ND2 2.84Å
1043	N	58.8	Low	74	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.021	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-88.6	8.6	-178	-76.8	-21.3	0	0	0	113.7	M1039 A1040 T1041 S1045 I1049 L1118	M1039-N1043 HydrophobicContact CE-CB 3.64Å; A1040-N1043 WeakPolarHBondContact O-CB 3.47Å; A1040-N1043 PolarHBondContact O-N 3.04Å; T1041-N1043 VanDerWaalsContact C-N 3.27Å; T1041-N1043 PolarHBondContact O-N 3.02Å; N1043-S1045 VanDerWaalsContact C-N 3.29Å; N1043-S1045 PolarHBondContact O-N 3.1Å; N1043-I1049 WeakPolarHBondContact O-CD1 3.26Å; N1043-I1049 WeakPolarHBondContact O-CG1 3.21Å; N1043-L1118 PolarHBondContact ND2-O 2.62Å
1044	T	60.8	Low	73.8	Confident	90 Å²	90	54 Å²	54	55%	0.552	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-72.1	-15.1	-176.5	-40.2	0	0	0	0	114.2	T1041 A1042	T1041-T1044 PolarHBondContact O-N 3.23Å; T1041-T1044 PolarHBondContact O-OG1 3.36Å; A1042-T1044 VanDerWaalsContact C-N 3.35Å; A1042-T1044 PolarHBondContact O-N 2.68Å
1045	S	67.9	Low	73.5	Confident	51 Å²	51	52.2 Å²	52.2	36%	0.357	30%	0.3	S	S	.	.	S	Bend	trans	-90.9	144	-174.1	81.1	0	0	0	0	113.9	N1043 Q1047 N1048 I1049	N1043-S1045 VanDerWaalsContact C-N 3.29Å; N1043-S1045 PolarHBondContact O-N 3.1Å; S1045-Q1047 PolarHBondContact O-N 2.74Å; S1045-Q1047 VanDerWaalsContact O-N 3.11Å; S1045-N1048 PolarHBondContact O-N 3.24Å; S1045-N1048 WeakPolarHBondContact OG-CB 3.36Å; S1045-N1048 PolarHBondContact OG-N 3.09Å; S1045-N1048 PolarHBondContact OG-ND2 3.03Å; S1045-I1049 PolarHBondContact O-N 3.34Å; S1045-I1049 VanDerWaalsContact O-N 3.13Å
1046	K	68.8	Low	73.4	Confident	87 Å²	87	52 Å²	52	38%	0.378	30%	0.296	S	S	.	.	H	α-helix	trans	-54.3	-35	-178.4	-164.6	165.9	-176.8	166.4	0	112.6	S1050 S1064 Q1066	K1046-S1050 PolarHBondContact O-N 3.19Å; K1046-S1050 PolarHBondContact O-OG 3.4Å; K1046-S1064 PolarHBondContact NZ-O 3.24Å; K1046-Q1066 PolarHBondContact NZ-O 3.24Å
1047	Q	71.3	Confident	73.5	Confident	137 Å²	137	48.1 Å²	48.1	64%	0.64	27%	0.273	S	S	*	.	H	α-helix	trans	-79.6	-26.6	177.7	-64.8	-174.8	-0.4	0	0	114.7	S1045 S1050 K1051	S1045-Q1047 PolarHBondContact O-N 2.74Å; S1045-Q1047 VanDerWaalsContact O-N 3.11Å; Q1047-S1050 PolarHBondContact O-OG 2.94Å; Q1047-K1051 WeakPolarHBondContact O-CB 3.27Å; Q1047-K1051 WeakPolarHBondContact O-CD 3.42Å; Q1047-K1051 WeakPolarHBondContact O-CG 3.26Å; Q1047-K1051 PolarHBondContact O-N 2.92Å
1048	N	73.9	Confident	73.8	Confident	57 Å²	57	48.5 Å²	48.5	31%	0.305	27%	0.274	S	S	.	.	H	α-helix	trans	-79.9	-40.9	178.5	-72.5	-3.2	0	0	0	110.7	A1042 S1045 S1050 K1051 Q1052	A1042-N1048 PolarHBondContact O-ND2 2.84Å; S1045-N1048 PolarHBondContact O-N 3.24Å; S1045-N1048 WeakPolarHBondContact OG-CB 3.36Å; S1045-N1048 PolarHBondContact OG-N 3.09Å; S1045-N1048 PolarHBondContact OG-ND2 3.03Å; N1048-S1050 PolarHBondContact O-N 3.1Å; N1048-K1051 PolarHBondContact O-N 3.41Å; N1048-Q1052 WeakPolarHBondContact O-CG 3.27Å; N1048-Q1052 PolarHBondContact O-N 3.2Å
1049	I	78.2	Confident	74.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58.2	-48.3	174.1	-60.5	171.4	0	0	0	110.2	N1043 S1045 K1051 Q1052 V1053 L1087 L1089	N1043-I1049 WeakPolarHBondContact O-CD1 3.26Å; N1043-I1049 WeakPolarHBondContact O-CG1 3.21Å; S1045-I1049 PolarHBondContact O-N 3.34Å; S1045-I1049 VanDerWaalsContact O-N 3.13Å; I1049-K1051 PolarHBondContact O-N 3.25Å; I1049-Q1052 PolarHBondContact O-N 3.27Å; I1049-V1053 HydrophobicContact CG2-CG2 4.28Å; I1049-V1053 WeakPolarHBondContact O-CG2 3.47Å; I1049-V1053 PolarHBondContact O-N 3.43Å; I1049-L1087 HydrophobicContact CD1-CD2 4.28Å; I1049-L1087 HydrophobicContact CG2-CD1 3.83Å; I1049-L1087 HydrophobicContact CG2-CD2 4.35Å; I1049-L1089 HydrophobicContact CD1-CD1 4.03Å; I1049-L1089 HydrophobicContact CD1-CD2 4.09Å; I1049-L1089 HydrophobicContact CD1-CG 4.41Å
1050	S	78.6	Confident	74.9	Confident	26 Å²	26	43.8 Å²	43.8	18%	0.182	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-44.6	177.7	65.4	0	0	0	0	112.2	K1046 Q1047 N1048 Q1052 V1053 L1054	K1046-S1050 PolarHBondContact O-N 3.19Å; K1046-S1050 PolarHBondContact O-OG 3.4Å; Q1047-S1050 PolarHBondContact O-OG 2.94Å; N1048-S1050 PolarHBondContact O-N 3.1Å; S1050-Q1052 VanDerWaalsContact C-N 3.33Å; S1050-Q1052 PolarHBondContact O-N 3.04Å; S1050-V1053 PolarHBondContact O-N 2.95Å; S1050-L1054 VanDerWaalsContact O-CB 3.22Å; S1050-L1054 WeakPolarHBondContact O-CB 3.33Å; S1050-L1054 WeakPolarHBondContact O-CD1 3.45Å; S1050-L1054 WeakPolarHBondContact O-CG 3.25Å; S1050-L1054 PolarHBondContact O-N 3.38Å
1051	K	79.4	Confident	75.8	Confident	125 Å²	125	46 Å²	46	54%	0.543	26%	0.258	S	S	.	.	H	α-helix	trans	-57.4	-41.9	173.5	-74.4	167.2	-169.9	168.9	0	112.9	Q1047 N1048 I1049 S1055	Q1047-K1051 WeakPolarHBondContact O-CB 3.27Å; Q1047-K1051 WeakPolarHBondContact O-CD 3.42Å; Q1047-K1051 WeakPolarHBondContact O-CG 3.26Å; Q1047-K1051 PolarHBondContact O-N 2.92Å; N1048-K1051 PolarHBondContact O-N 3.41Å; I1049-K1051 PolarHBondContact O-N 3.25Å; K1051-S1055 WeakPolarHBondContact O-CB 3.5Å; K1051-S1055 PolarHBondContact O-N 3.38Å
1052	Q	78.9	Confident	77	Confident	51 Å²	51	40.2 Å²	40.2	24%	0.238	22%	0.222	C	C	.	.	H	α-helix	trans	-68.5	-49.6	179.6	-70.3	-66.9	6.8	0	0	111.9	N1048 I1049 S1050 L1054 S1055 V1056 L1118	N1048-Q1052 WeakPolarHBondContact O-CG 3.27Å; N1048-Q1052 PolarHBondContact O-N 3.2Å; I1049-Q1052 PolarHBondContact O-N 3.27Å; S1050-Q1052 VanDerWaalsContact C-N 3.33Å; S1050-Q1052 PolarHBondContact O-N 3.04Å; Q1052-L1054 VanDerWaalsContact C-N 3.33Å; Q1052-L1054 PolarHBondContact O-N 2.94Å; Q1052-S1055 WeakPolarHBondContact O-CB 3.43Å; Q1052-S1055 PolarHBondContact O-N 2.74Å; Q1052-S1055 PolarHBondContact O-OG 3.47Å; Q1052-V1056 PolarHBondContact O-N 2.75Å; Q1052-L1118 HydrophobicContact CB-CD2 4.01Å
1053	V	84.1	Confident	77.8	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-57.9	-46.4	176.7	173.3	0	0	0	0	110.5	I1049 S1050 S1055 V1056 A1057 V1059 F1072 L1114 L1118	I1049-V1053 HydrophobicContact CG2-CG2 4.28Å; I1049-V1053 WeakPolarHBondContact O-CG2 3.47Å; I1049-V1053 PolarHBondContact O-N 3.43Å; S1050-V1053 PolarHBondContact O-N 2.95Å; V1053-S1055 PolarHBondContact O-N 3.34Å; V1053-V1056 PolarHBondContact O-N 3.13Å; V1053-V1056 VanDerWaalsContact O-N 3.1Å; V1053-A1057 PolarHBondContact O-N 3.37Å; V1053-V1059 HydrophobicContact CG1-CG2 4.03Å; V1053-F1072 HydrophobicContact CB-CE1 4.05Å; V1053-F1072 HydrophobicContact CB-CE2 4.33Å; V1053-F1072 HydrophobicContact CB-CZ 3.93Å; V1053-F1072 HydrophobicContact CG1-CD1 3.9Å; V1053-F1072 HydrophobicContact CG1-CD2 4.07Å; V1053-F1072 HydrophobicContact CG1-CE1 3.89Å; V1053-F1072 HydrophobicContact CG1-CE2 4.08Å; V1053-F1072 HydrophobicContact CG1-CG 4Å; V1053-F1072 HydrophobicContact CG1-CZ 3.99Å; V1053-F1072 HydrophobicContact CG2-CE2 4.06Å; V1053-F1072 HydrophobicContact CG2-CZ 3.97Å; V1053-L1114 HydrophobicContact CB-CD2 4.39Å; V1053-L1114 HydrophobicContact CG1-CD2 4.16Å; V1053-L1114 HydrophobicContact CG2-CD2 4.28Å; V1053-L1118 HydrophobicContact CG2-CD2 4.44Å
1054	L	83.5	Confident	78.2	Confident	26 Å²	26	43 Å²	43	14%	0.136	24%	0.239	C	C	.	.	H	α-helix	trans	-69.4	-17	177.4	-62.1	173.9	0	0	0	113.5	R918 S1050 Q1052 V1059 V1061	R918-L1054 PolarHBondContact NH1-O 3.01Å; S1050-L1054 VanDerWaalsContact O-CB 3.22Å; S1050-L1054 WeakPolarHBondContact O-CB 3.33Å; S1050-L1054 WeakPolarHBondContact O-CD1 3.45Å; S1050-L1054 WeakPolarHBondContact O-CG 3.25Å; S1050-L1054 PolarHBondContact O-N 3.38Å; Q1052-L1054 VanDerWaalsContact C-N 3.33Å; Q1052-L1054 PolarHBondContact O-N 2.94Å; L1054-V1059 HydrophobicContact CD2-CG2 4.07Å; L1054-V1059 WeakPolarHBondContact CD2-O 2.74Å; L1054-V1061 HydrophobicContact CD1-CG2 3.89Å; L1054-V1061 HydrophobicContact CD2-CG2 4.22Å; L1054-V1061 HydrophobicContact CG-CG2 4.42Å
1055	S	81.1	Confident	78.1	Confident	15 Å²	15	46.1 Å²	46.1	11%	0.105	25%	0.252	C	S	.	.	H	α-helix	trans	-76.1	-30.3	170.1	85.4	0	0	0	0	112.3	R918 K1051 Q1052 V1053	R918-S1055 PolarHBondContact NH2-O 3.49Å; K1051-S1055 WeakPolarHBondContact O-CB 3.5Å; K1051-S1055 PolarHBondContact O-N 3.38Å; Q1052-S1055 WeakPolarHBondContact O-CB 3.43Å; Q1052-S1055 PolarHBondContact O-N 2.74Å; Q1052-S1055 PolarHBondContact O-OG 3.47Å; V1053-S1055 PolarHBondContact O-N 3.34Å
1056	V	83.2	Confident	78	Confident	19 Å²	19	49.2 Å²	49.2	12%	0.115	26%	0.261	C	S	.	.	H	α-helix	trans	-89.9	-39.5	-178.2	178	0	0	0	0	112	G1007 Q1052 V1053 D1113 L1114 A1117	G1007-V1056 WeakPolarHBondContact CA-O 3.24Å; Q1052-V1056 PolarHBondContact O-N 2.75Å; V1053-V1056 PolarHBondContact O-N 3.13Å; V1053-V1056 VanDerWaalsContact O-N 3.1Å; V1056-D1113 HydrophobicContact CG1-CB 4.3Å; V1056-L1114 HydrophobicContact CB-CD2 3.8Å; V1056-L1114 HydrophobicContact CG1-CD2 3.83Å; V1056-L1114 HydrophobicContact CG1-CG 4.19Å; V1056-L1114 HydrophobicContact CG2-CD2 4.33Å; V1056-A1117 HydrophobicContact CG2-CB 3.39Å
1057	A	85.9	Confident	77.7	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.008	27%	0.274	C	S	.	.			trans	-134.6	139.3	-169.9	0	0	0	0	0	113	L1010 V1053 V1059 L1110	L1010-A1057 HydrophobicContact CD1-CB 4.45Å; V1053-A1057 PolarHBondContact O-N 3.37Å; A1057-V1059 VanDerWaalsContact C-N 3.31Å; A1057-V1059 HydrophobicContact CB-CG1 4.17Å; A1057-V1059 HydrophobicContact CB-CG2 4.3Å; A1057-V1059 PolarHBondContact O-N 2.84Å; A1057-L1110 HydrophobicContact CB-CD1 4.06Å
1058	N	87.9	Confident	77.7	Confident	10 Å²	10	49.5 Å²	49.5	5%	0.053	27%	0.271	C	S	.	.			trans	-84	70.9	178.2	-168.2	35.4	0	0	0	111	R918 G1007 L1010 M1011	R918-N1058 HydrophobicContact CG-CB 4.32Å; G1007-N1058 WeakPolarHBondContact O-CB 3.31Å; G1007-N1058 PolarHBondContact O-N 2.75Å; L1010-N1058 WeakPolarHBondContact O-CB 3.45Å; L1010-N1058 PolarHBondContact O-ND2 3.35Å; M1011-N1058 CarbonylContact C-O 3.48Å
1059	V	87.3	Confident	78.1	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	26%	0.264	C	S	.	.			trans	-118.9	149.4	-175.1	-67.6	0	0	0	0	112	L1010 V1053 L1054 A1057 F1072	L1010-V1059 HydrophobicContact CD1-CG1 3.81Å; V1053-V1059 HydrophobicContact CG1-CG2 4.03Å; L1054-V1059 HydrophobicContact CD2-CG2 4.07Å; L1054-V1059 WeakPolarHBondContact CD2-O 2.74Å; A1057-V1059 VanDerWaalsContact C-N 3.31Å; A1057-V1059 HydrophobicContact CB-CG1 4.17Å; A1057-V1059 HydrophobicContact CB-CG2 4.3Å; A1057-V1059 PolarHBondContact O-N 2.84Å; V1059-F1072 HydrophobicContact CB-CB 4.11Å; V1059-F1072 HydrophobicContact CG2-CB 3.7Å; V1059-F1072 HydrophobicContact CG2-CD1 4.11Å; V1059-F1072 HydrophobicContact CG2-CG 4.2Å
1060	G	84.8	Confident	78.3	Confident	7 Å²	7	48.6 Å²	48.6	7%	0.072	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	140.3	173.3	0	0	0	0	0	111	F1072 A1073	G1060-F1072 CarbonylContact O-C 3.6Å; G1060-F1072 WeakPolarHBondContact O-CA 3.44Å; G1060-A1073 PolarHBondContact N-O 3.02Å; G1060-A1073 PolarHBondContact O-N 3.41Å
1061	V	84.6	Confident	78.8	Confident	75 Å²	75	48 Å²	48	46%	0.455	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	129.7	173.3	-172.7	0	0	0	0	109.1	L1054 F1072	L1054-V1061 HydrophobicContact CD1-CG2 3.89Å; L1054-V1061 HydrophobicContact CD2-CG2 4.22Å; L1054-V1061 HydrophobicContact CG-CG2 4.42Å; V1061-F1072 HydrophobicContact CB-CD1 4.44Å; V1061-F1072 HydrophobicContact CG1-CE1 4.4Å; V1061-F1072 HydrophobicContact CG2-CD1 3.99Å; V1061-F1072 HydrophobicContact CG2-CE1 3.97Å
1062	V	82.8	Confident	79.3	Confident	5 Å²	5	42.1 Å²	42.1	3%	0.03	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	111	174.9	174.6	0	0	0	0	109	M1015 F1020 S1064 R1071 A1073	M1015-V1062 HydrophobicContact CG-CG2 3.85Å; F1020-V1062 HydrophobicContact CD2-CG2 4.1Å; V1062-S1064 PolarHBondContact O-N 3.07Å; V1062-S1064 VanDerWaalsContact O-N 3.16Å; V1062-S1064 PolarHBondContact O-OG 3.26Å; V1062-R1071 HydrophobicContact CB-CB 3.89Å; V1062-R1071 HydrophobicContact CG1-CB 4.32Å; V1062-R1071 PolarHBondContact N-O 3.09Å; V1062-A1073 HydrophobicContact CG2-CB 4.09Å
1063	S	72.1	Confident	79.9	Confident	109 Å²	109	39.7 Å²	39.7	76%	0.762	22%	0.222	S	C	*	.			trans	-50.3	121.5	173.2	-63.9	0	0	0	0	110.1
1064	S	66.7	Low	80.2	Confident	10 Å²	10	39.6 Å²	39.6	7%	0.07	22%	0.222	C	C	.	.			trans	-134.9	127.2	-177.7	-58.4	0	0	0	0	108.5	E1017 K1046 V1062 Q1066 R1071	E1017-S1064 WeakPolarHBondContact OE2-CA 3.32Å; K1046-S1064 PolarHBondContact NZ-O 3.24Å; V1062-S1064 PolarHBondContact O-N 3.07Å; V1062-S1064 VanDerWaalsContact O-N 3.16Å; V1062-S1064 PolarHBondContact O-OG 3.26Å; S1064-Q1066 VanDerWaalsContact C-N 3.3Å; S1064-Q1066 PolarHBondContact O-N 3.24Å; S1064-R1071 VanDerWaalsContact CB-NH1 3.32Å; S1064-R1071 PolarHBondContact OG-NH1 3.35Å
1065	D	59.7	Low	80.4	Confident	155 Å²	155	41.4 Å²	41.4	83%	0.829	23%	0.227	S	C	*	.	S	Bend	trans	-73.5	-23.6	-173.1	-63.7	-32.6	0	0	0	112.7
1066	Q	65.4	Low	80.8	Confident	116 Å²	116	40.9 Å²	40.9	54%	0.542	22%	0.223	S	C	.	.			trans	-73.8	131.6	175.5	-59.8	-175	4.3	0	0	110.7	K1046 S1064 L1069	K1046-Q1066 PolarHBondContact NZ-O 3.24Å; S1064-Q1066 VanDerWaalsContact C-N 3.3Å; S1064-Q1066 PolarHBondContact O-N 3.24Å; Q1066-L1069 HydrophobicContact CB-CB 4.37Å
1067	N	61.7	Low	80.8	Confident	121 Å²	121	40.9 Å²	40.9	65%	0.647	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-25.5	-178.8	-83.3	-30.7	0	0	0	114
1068	N	72.5	Confident	80.7	Confident	110 Å²	110	42.4 Å²	42.4	59%	0.588	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-8.2	-175.9	-61.8	6.3	0	0	0	113.4	L1089	N1068-L1089 PolarHBondContact O-N 2.81Å
1069	L	81.4	Confident	80.4	Confident	28 Å²	28	45.2 Å²	45.2	15%	0.147	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	128.5	-173.2	-166.8	67	0	0	0	110.4	Q1066 T1086 E1088	Q1066-L1069 HydrophobicContact CB-CB 4.37Å; L1069-T1086 HydrophobicContact CD1-CG2 3.59Å; L1069-T1086 HydrophobicContact CG-CG2 4.35Å; L1069-E1088 HydrophobicContact CD1-CB 3.93Å; L1069-E1088 HydrophobicContact CD1-CG 4.5Å
1070	Q	83.5	Confident	80.2	Confident	9 Å²	9	47 Å²	47	4%	0.042	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	140.6	171.9	-62.4	-171.2	32.6	0	0	110.5	F1072 T1086 L1087	Q1070-F1072 HydrophobicContact CB-CE2 3.85Å; Q1070-F1072 HydrophobicContact CB-CZ 4.24Å; Q1070-T1086 WeakPolarHBondContact O-CA 3.33Å; Q1070-L1087 PolarHBondContact N-O 3.31Å; Q1070-L1087 PolarHBondContact O-N 2.92Å
1071	R	88.6	Confident	80.3	Confident	15 Å²	15	47.1 Å²	47.1	6%	0.057	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	134.7	-177.6	-66.9	179.1	-176.8	111.8	-19	109.3	E1017 F1020 C1021 V1062 S1064 V1085	E1017-R1071 VanDerWaalsContact CD-CZ 3.48Å; E1017-R1071 IonicContact OE1-CZ 2.59Å; E1017-R1071 IonicContact OE1-NH1 2.79Å; E1017-R1071 PolarHBondContact OE1-NH1 2.89Å; E1017-R1071 IonicContact OE1-NH2 3.52Å; E1017-R1071 PolarHBondContact OE1-NH2 2.98Å; E1017-R1071 IonicContact OE2-CZ 2.7Å; E1017-R1071 IonicContact OE2-NH1 3.4Å; E1017-R1071 PolarHBondContact OE2-NH1 2.89Å; F1020-R1071 HydrophobicContact CD1-CG 4.18Å; F1020-R1071 HydrophobicContact CD2-CB 4.2Å; F1020-R1071 HydrophobicContact CE1-CB 4.2Å; F1020-R1071 HydrophobicContact CE1-CG 3.77Å; F1020-R1071 HydrophobicContact CE2-CB 3.8Å; F1020-R1071 HydrophobicContact CE2-CG 4.3Å; F1020-R1071 HydrophobicContact CZ-CB 3.79Å; F1020-R1071 HydrophobicContact CZ-CG 3.83Å; C1021-R1071 PolarHBondContact SG-NH2 2.94Å; V1062-R1071 HydrophobicContact CB-CB 3.89Å; V1062-R1071 HydrophobicContact CG1-CB 4.32Å; V1062-R1071 PolarHBondContact N-O 3.09Å; S1064-R1071 VanDerWaalsContact CB-NH1 3.32Å; S1064-R1071 PolarHBondContact OG-NH1 3.35Å; R1071-V1085 CarbonylContact C-O 3.58Å; R1071-V1085 WeakPolarHBondContact CA-O 3.39Å
1072	F	90.3	Very high	80.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	141.5	175.6	-48.4	-101.5	0	0	0	109.5	V1053 V1059 G1060 V1061 Q1070 V1085	V1053-F1072 HydrophobicContact CB-CE1 4.05Å; V1053-F1072 HydrophobicContact CB-CE2 4.33Å; V1053-F1072 HydrophobicContact CB-CZ 3.93Å; V1053-F1072 HydrophobicContact CG1-CD1 3.9Å; V1053-F1072 HydrophobicContact CG1-CD2 4.07Å; V1053-F1072 HydrophobicContact CG1-CE1 3.89Å; V1053-F1072 HydrophobicContact CG1-CE2 4.08Å; V1053-F1072 HydrophobicContact CG1-CG 4Å; V1053-F1072 HydrophobicContact CG1-CZ 3.99Å; V1053-F1072 HydrophobicContact CG2-CE2 4.06Å; V1053-F1072 HydrophobicContact CG2-CZ 3.97Å; V1059-F1072 HydrophobicContact CB-CB 4.11Å; V1059-F1072 HydrophobicContact CG2-CB 3.7Å; V1059-F1072 HydrophobicContact CG2-CD1 4.11Å; V1059-F1072 HydrophobicContact CG2-CG 4.2Å; G1060-F1072 CarbonylContact O-C 3.6Å; G1060-F1072 WeakPolarHBondContact O-CA 3.44Å; V1061-F1072 HydrophobicContact CB-CD1 4.44Å; V1061-F1072 HydrophobicContact CG1-CE1 4.4Å; V1061-F1072 HydrophobicContact CG2-CD1 3.99Å; V1061-F1072 HydrophobicContact CG2-CE1 3.97Å; Q1070-F1072 HydrophobicContact CB-CE2 3.85Å; Q1070-F1072 HydrophobicContact CB-CZ 4.24Å; F1072-V1085 HydrophobicContact CB-CB 4.28Å; F1072-V1085 HydrophobicContact CD2-CB 4.49Å; F1072-V1085 PolarHBondContact N-O 3.27Å; F1072-V1085 PolarHBondContact O-N 3.05Å
1073	A	90.6	Very high	80.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	135.3	-177.2	0	0	0	0	0	111.5	S1013 M1015 F1020 G1060 V1062 L1084	S1013-A1073 PolarHBondContact N-O 2.78Å; S1013-A1073 WeakPolarHBondContact O-CB 3.29Å; M1015-A1073 HydrophobicContact CG-CB 4.09Å; M1015-A1073 HydrophobicContact SD-CB 3.56Å; M1015-A1073 VanDerWaalsContact SD-CB 3.56Å; F1020-A1073 HydrophobicContact CD2-CB 4.38Å; F1020-A1073 HydrophobicContact CE2-CB 4.46Å; G1060-A1073 PolarHBondContact N-O 3.02Å; G1060-A1073 PolarHBondContact O-N 3.41Å; V1062-A1073 HydrophobicContact CG2-CB 4.09Å; A1073-L1084 HydrophobicContact CB-CD2 3.76Å
1074	G	90.5	Very high	81.8	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	170.7	174.9	0	0	0	0	0	111.7	M1011 V1083	M1011-G1074 CarbonylContact O-C 3.51Å; M1011-G1074 WeakPolarHBondContact O-CA 3.34Å; G1074-V1083 PolarHBondContact N-O 2.68Å; G1074-V1083 PolarHBondContact O-N 3.32Å
1075	R	88.6	Confident	82.9	Confident	64 Å²	64	39.2 Å²	39.2	24%	0.242	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	146.7	171.6	-66.3	178.4	-175.5	-147	-3.9	109.5	S884 M886 L1010 M1011 S1013 A1081 L1082	S884-R1075 PolarHBondContact O-NH2 3.46Å; M886-R1075 PolarHBondContact SD-NH2 3.28Å; L1010-R1075 CarbonylContact C-O 3.58Å; L1010-R1075 WeakPolarHBondContact CA-O 3.4Å; M1011-R1075 PolarHBondContact N-O 3.49Å; M1011-R1075 PolarHBondContact O-N 3.08Å; S1013-R1075 PolarHBondContact OG-NE 3.29Å; R1075-A1081 CarbonylContact C-O 3.49Å; R1075-A1081 VanDerWaalsContact CA-O 3.26Å; R1075-A1081 WeakPolarHBondContact CA-O 3.39Å; R1075-L1082 HydrophobicContact CG-CD1 4.09Å
1076	T	88.4	Confident	84.3	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.018	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	141.5	174.9	68.5	0	0	0	0	110.8	D982 L1009 L1010 S1079 G1080 A1081 V1083 M1106	D982-T1076 VanDerWaalsContact CG-CB 3.42Å; D982-T1076 VanDerWaalsContact OD1-CB 3.32Å; D982-T1076 WeakPolarHBondContact OD1-CB 3.39Å; D982-T1076 VanDerWaalsContact OD2-CB 3.31Å; D982-T1076 WeakPolarHBondContact OD2-CB 3.29Å; D982-T1076 PolarHBondContact OD2-OG1 2.72Å; L1009-T1076 WeakPolarHBondContact O-CA 3.44Å; L1010-T1076 HydrophobicContact CD2-CG2 4.07Å; T1076-S1079 PolarHBondContact OG1-OG 2.72Å; T1076-G1080 WeakPolarHBondContact O-CA 3.3Å; T1076-G1080 PolarHBondContact O-N 3.36Å; T1076-G1080 PolarHBondContact OG1-N 2.95Å; T1076-A1081 HydrophobicContact CG2-CB 4.27Å; T1076-A1081 PolarHBondContact N-O 2.95Å; T1076-A1081 PolarHBondContact OG1-N 3.08Å; T1076-A1081 VanDerWaalsContact OG1-N 3.09Å; T1076-V1083 HydrophobicContact CG2-CG2 3.96Å; T1076-M1106 HydrophobicContact CG2-CE 3.8Å; T1076-M1106 HydrophobicContact CG2-SD 4.05Å
1077	V	84.6	Confident	85.3	Confident	19 Å²	19	27 Å²	27	12%	0.115	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-40.7	-170.9	173.1	0	0	0	0	112.6	V928 D982 L1009 M1011	V928-V1077 HydrophobicContact CG2-CB 4.16Å; V928-V1077 HydrophobicContact CG2-CG1 4.05Å; V928-V1077 HydrophobicContact CG2-CG2 4.29Å; D982-V1077 PolarHBondContact OD1-N 3.43Å; L1009-V1077 PolarHBondContact O-N 3.5Å; M1011-V1077 HydrophobicContact CB-CG2 4.34Å; M1011-V1077 HydrophobicContact CE-CG2 4.31Å
1078	S	82.4	Confident	86.4	Confident	33 Å²	33	24.8 Å²	24.8	23%	0.231	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-43.1	-174.5	-52.6	0	0	0	0	112.9	D979 S981 D982	D979-S1078 WeakPolarHBondContact OD1-CB 3.18Å; D979-S1078 PolarHBondContact OD1-OG 3.41Å; S981-S1078 WeakPolarHBondContact CA-OG 3.28Å; S981-S1078 PolarHBondContact N-OG 2.92Å; D982-S1078 PolarHBondContact N-OG 3.27Å; D982-S1078 WeakPolarHBondContact OD1-CB 3.39Å; D982-S1078 PolarHBondContact OD1-N 2.76Å
1079	S	82.1	Confident	86.8	Confident	69 Å²	69	21.5 Å²	21.5	48%	0.483	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-0.7	-177.6	88.5	0	0	0	0	116	D982 T1076 A1081 K1103	D982-S1079 VanDerWaalsContact OD2-CB 3.29Å; D982-S1079 WeakPolarHBondContact OD2-CB 3.44Å; D982-S1079 PolarHBondContact OD2-N 3.33Å; D982-S1079 PolarHBondContact OD2-OG 2.86Å; T1076-S1079 PolarHBondContact OG1-OG 2.72Å; S1079-A1081 PolarHBondContact O-N 2.88Å; S1079-A1081 VanDerWaalsContact O-N 3.16Å; S1079-K1103 WeakPolarHBondContact OG-CE 3.04Å; S1079-K1103 PolarHBondContact OG-NZ 3.3Å
1080	G	83.9	Confident	86.7	Confident	38 Å²	38	26.4 Å²	26.4	39%	0.392	14%	0.142	S	C	.	.			trans	67	11.1	179.7	0	0	0	0	0	115.5	T1076	T1076-G1080 WeakPolarHBondContact O-CA 3.3Å; T1076-G1080 PolarHBondContact O-N 3.36Å; T1076-G1080 PolarHBondContact OG1-N 2.95Å
1081	A	86.8	Confident	85.6	Confident	10 Å²	10	34.5 Å²	34.5	8%	0.083	18%	0.18	C	C	.	.			trans	-67.4	140.6	-174	0	0	0	0	0	110.9	R1075 T1076 S1079	R1075-A1081 CarbonylContact C-O 3.49Å; R1075-A1081 VanDerWaalsContact CA-O 3.26Å; R1075-A1081 WeakPolarHBondContact CA-O 3.39Å; T1076-A1081 HydrophobicContact CG2-CB 4.27Å; T1076-A1081 PolarHBondContact N-O 2.95Å; T1076-A1081 PolarHBondContact OG1-N 3.08Å; T1076-A1081 VanDerWaalsContact OG1-N 3.09Å; S1079-A1081 PolarHBondContact O-N 2.88Å; S1079-A1081 VanDerWaalsContact O-N 3.16Å
1082	L	88.3	Confident	84.2	Confident	29 Å²	29	38.8 Å²	38.8	15%	0.152	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	139	-174.3	-163.9	68.2	0	0	0	111.5	E1023 L1027 R1075 L1084 T1101	E1023-L1082 HydrophobicContact CB-CD2 3.67Å; E1023-L1082 HydrophobicContact CG-CD2 3.99Å; L1027-L1082 HydrophobicContact CD1-CB 4.43Å; L1027-L1082 HydrophobicContact CD1-CD2 4.26Å; R1075-L1082 HydrophobicContact CG-CD1 4.09Å; L1082-L1084 HydrophobicContact CD1-CD2 4.15Å; L1082-L1084 HydrophobicContact CD2-CD1 4.08Å; L1082-L1084 HydrophobicContact CD2-CD2 3.87Å; L1082-L1084 HydrophobicContact CD2-CG 3.98Å; L1082-L1084 HydrophobicContact CG-CD2 3.83Å; L1082-L1084 HydrophobicContact CG-CG 4.06Å; L1082-T1101 VanDerWaalsContact O-CB 3.26Å; L1082-T1101 WeakPolarHBondContact O-CB 3.41Å; L1082-T1101 PolarHBondContact O-OG1 3.25Å
1083	V	90.6	Very high	83.1	Confident	3 Å²	3	41.7 Å²	41.7	2%	0.018	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	111.2	173.3	-177.1	0	0	0	0	108.1	L1010 G1074 T1076 V1085 I1099 L1110	L1010-V1083 HydrophobicContact CD1-CG1 4.41Å; L1010-V1083 HydrophobicContact CD2-CB 4.31Å; L1010-V1083 HydrophobicContact CD2-CG2 3.8Å; G1074-V1083 PolarHBondContact N-O 2.68Å; G1074-V1083 PolarHBondContact O-N 3.32Å; T1076-V1083 HydrophobicContact CG2-CG2 3.96Å; V1083-V1085 HydrophobicContact CG1-CG2 4.46Å; V1083-I1099 HydrophobicContact CG1-CG2 4.2Å; V1083-L1110 HydrophobicContact CG1-CD2 3.93Å
1084	L	90.8	Very high	82.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	131.9	177.1	-55.2	-179	0	0	0	109.2	M1015 F1020 E1023 Q1024 A1073 L1082 I1099 N1100	M1015-L1084 HydrophobicContact SD-CD2 3.78Å; F1020-L1084 HydrophobicContact CD2-CD1 4.49Å; F1020-L1084 HydrophobicContact CD2-CD2 3.87Å; F1020-L1084 HydrophobicContact CE2-CB 3.89Å; F1020-L1084 HydrophobicContact CE2-CD1 4.45Å; F1020-L1084 HydrophobicContact CE2-CD2 3.79Å; F1020-L1084 HydrophobicContact CE2-CG 4.25Å; F1020-L1084 HydrophobicContact CZ-CB 3.88Å; E1023-L1084 HydrophobicContact CB-CD1 4.11Å; Q1024-L1084 HydrophobicContact CB-CD1 3.98Å; A1073-L1084 HydrophobicContact CB-CD2 3.76Å; L1082-L1084 HydrophobicContact CD1-CD2 4.15Å; L1082-L1084 HydrophobicContact CD2-CD1 4.08Å; L1082-L1084 HydrophobicContact CD2-CD2 3.87Å; L1082-L1084 HydrophobicContact CD2-CG 3.98Å; L1082-L1084 HydrophobicContact CG-CD2 3.83Å; L1082-L1084 HydrophobicContact CG-CG 4.06Å; L1084-I1099 CarbonylContact O-C 3.55Å; L1084-I1099 WeakPolarHBondContact O-CA 3.38Å; L1084-N1100 HydrophobicContact CB-CB 4.33Å; L1084-N1100 PolarHBondContact N-O 2.85Å; L1084-N1100 PolarHBondContact O-N 2.77Å
1085	V	90.3	Very high	82	Confident	2 Å²	2	43.8 Å²	43.8	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.5	177.8	-174.9	0	0	0	0	108.5	R1071 F1072 V1083 L1097 T1098 I1099 L1110 L1114	R1071-V1085 CarbonylContact C-O 3.58Å; R1071-V1085 WeakPolarHBondContact CA-O 3.39Å; F1072-V1085 HydrophobicContact CB-CB 4.28Å; F1072-V1085 HydrophobicContact CD2-CB 4.49Å; F1072-V1085 PolarHBondContact N-O 3.27Å; F1072-V1085 PolarHBondContact O-N 3.05Å; V1083-V1085 HydrophobicContact CG1-CG2 4.46Å; V1085-L1097 HydrophobicContact CG1-CD1 3.61Å; V1085-T1098 WeakPolarHBondContact CA-O 3.32Å; V1085-I1099 HydrophobicContact CG1-CG1 4.3Å; V1085-I1099 HydrophobicContact CG2-CG1 4.29Å; V1085-L1110 HydrophobicContact CG2-CD2 4.42Å; V1085-L1114 HydrophobicContact CG1-CD1 4.12Å
1086	T	88.8	Confident	81.9	Confident	15 Å²	15	42.5 Å²	42.5	9%	0.092	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	131.3	177.1	-51.7	0	0	0	0	109	F1020 Q1024 L1069 Q1070 T1098	F1020-T1086 WeakPolarHBondContact CZ-OG1 3.43Å; Q1024-T1086 PolarHBondContact NE2-OG1 3.25Å; L1069-T1086 HydrophobicContact CD1-CG2 3.59Å; L1069-T1086 HydrophobicContact CG-CG2 4.35Å; Q1070-T1086 WeakPolarHBondContact O-CA 3.33Å; T1086-T1098 PolarHBondContact N-O 3.46Å; T1086-T1098 PolarHBondContact O-N 3.43Å
1087	L	87	Confident	82	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	113.3	173.6	-173.4	154.5	0	0	0	108.9	I1037 I1049 Q1070 L1089 A1095 L1096 L1097 L1118	I1037-L1087 HydrophobicContact CD1-CD1 4.47Å; I1049-L1087 HydrophobicContact CD1-CD2 4.28Å; I1049-L1087 HydrophobicContact CG2-CD1 3.83Å; I1049-L1087 HydrophobicContact CG2-CD2 4.35Å; Q1070-L1087 PolarHBondContact N-O 3.31Å; Q1070-L1087 PolarHBondContact O-N 2.92Å; L1087-L1089 HydrophobicContact CD2-CD2 4.2Å; L1087-L1089 HydrophobicContact CD2-CG 4.02Å; L1087-A1095 HydrophobicContact CD2-CB 4.06Å; L1087-A1095 HydrophobicContact CG-CB 4.27Å; L1087-L1096 WeakPolarHBondContact CA-O 3.41Å; L1087-L1097 HydrophobicContact CB-CD1 4.3Å; L1087-L1097 HydrophobicContact CD1-CD1 4.44Å; L1087-L1118 HydrophobicContact CD1-CD1 3.9Å
1088	E	85.2	Confident	82.2	Confident	73 Å²	73	42.1 Å²	42.1	34%	0.341	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	119.8	176.3	177.4	-167.1	-123.8	0	0	109.2	L1069 R1090 A1095 L1096	L1069-E1088 HydrophobicContact CD1-CB 3.93Å; L1069-E1088 HydrophobicContact CD1-CG 4.5Å; E1088-R1090 HydrophobicContact CG-CG 4.49Å; E1088-R1090 IonicContact OE2-CZ 3.51Å; E1088-R1090 IonicContact OE2-NE 2.7Å; E1088-R1090 PolarHBondContact OE2-NE 2.72Å; E1088-R1090 IonicContact OE2-NH2 3.14Å; E1088-R1090 PolarHBondContact OE2-NH2 3.16Å; E1088-A1095 CarbonylContact O-C 3.58Å; E1088-A1095 WeakPolarHBondContact O-CA 3Å; E1088-A1095 WeakPolarHBondContact O-CB 3.26Å; E1088-L1096 HydrophobicContact CB-CB 4.36Å; E1088-L1096 PolarHBondContact N-O 3.08Å; E1088-L1096 PolarHBondContact O-N 3.44Å
1089	L	80.2	Confident	82.6	Confident	42 Å²	42	40.6 Å²	40.6	22%	0.22	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	127	173.1	-72.2	163	0	0	0	110.1	I1049 N1068 L1087 A1095	I1049-L1089 HydrophobicContact CD1-CD1 4.03Å; I1049-L1089 HydrophobicContact CD1-CD2 4.09Å; I1049-L1089 HydrophobicContact CD1-CG 4.41Å; N1068-L1089 PolarHBondContact O-N 2.81Å; L1087-L1089 HydrophobicContact CD2-CD2 4.2Å; L1087-L1089 HydrophobicContact CD2-CG 4.02Å; L1089-A1095 HydrophobicContact CD2-CB 4.25Å
1090	R	78.3	Confident	83	Confident	130 Å²	130	37.3 Å²	37.3	49%	0.491	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	164.3	175.4	-64.6	-175.4	178.6	-154.3	-7.9	110	E1088 T1094	E1088-R1090 HydrophobicContact CG-CG 4.49Å; E1088-R1090 IonicContact OE2-CZ 3.51Å; E1088-R1090 IonicContact OE2-NE 2.7Å; E1088-R1090 PolarHBondContact OE2-NE 2.72Å; E1088-R1090 IonicContact OE2-NH2 3.14Å; E1088-R1090 PolarHBondContact OE2-NH2 3.16Å; R1090-T1094 CarbonylContact C-O 3.55Å; R1090-T1094 WeakPolarHBondContact CA-O 3.43Å; R1090-T1094 PolarHBondContact N-O 3.32Å; R1090-T1094 VanDerWaalsContact O-O 3.09Å
1091	E	61.9	Low	83.2	Confident	179 Å²	179	35.6 Å²	35.6	84%	0.836	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	145.1	-173.1	-62.7	-174.3	164.5	0	0	112.3	T1094	E1091-T1094 PolarHBondContact O-OG1 3.29Å
1092	S	58.7	Low	83.1	Confident	106 Å²	106	41 Å²	41	74%	0.741	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	73.5	-178.3	59.8	0	0	0	0	115.4	T1094	S1092-T1094 PolarHBondContact O-N 2.94Å
1093	S	66.1	Low	82.9	Confident	61 Å²	61	42.5 Å²	42.5	43%	0.427	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	18.4	167.1	68	0	0	0	0	116.8	M1039	M1039-S1093 WeakPolarHBondContact CB-O 3.38Å; M1039-S1093 PolarHBondContact N-O 3.27Å
1094	T	77.4	Confident	82.5	Confident	43 Å²	43	45.5 Å²	45.5	26%	0.264	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	144.4	173.8	58.9	0	0	0	0	110.7	I1037 R1090 E1091 S1092	I1037-T1094 WeakPolarHBondContact O-CA 3.38Å; R1090-T1094 CarbonylContact C-O 3.55Å; R1090-T1094 WeakPolarHBondContact CA-O 3.43Å; R1090-T1094 PolarHBondContact N-O 3.32Å; R1090-T1094 VanDerWaalsContact O-O 3.09Å; E1091-T1094 PolarHBondContact O-OG1 3.29Å; S1092-T1094 PolarHBondContact O-N 2.94Å
1095	A	82.3	Confident	82.2	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	148.1	171.4	0	0	0	0	0	110.5	T1036 I1037 M1039 L1087 E1088 L1089	T1036-A1095 WeakPolarHBondContact CA-O 3.3Å; I1037-A1095 HydrophobicContact CD1-CB 4.22Å; I1037-A1095 HydrophobicContact CG1-CB 3.83Å; I1037-A1095 PolarHBondContact N-O 3.2Å; I1037-A1095 PolarHBondContact O-N 3.09Å; M1039-A1095 HydrophobicContact CG-CB 3.95Å; M1039-A1095 HydrophobicContact SD-CB 4.2Å; L1087-A1095 HydrophobicContact CD2-CB 4.06Å; L1087-A1095 HydrophobicContact CG-CB 4.27Å; E1088-A1095 CarbonylContact O-C 3.58Å; E1088-A1095 WeakPolarHBondContact O-CA 3Å; E1088-A1095 WeakPolarHBondContact O-CB 3.26Å; L1089-A1095 HydrophobicContact CD2-CB 4.25Å
1096	L	86.5	Confident	81.9	Confident	37 Å²	37	50.8 Å²	50.8	19%	0.194	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	117.5	167.2	178.7	62.2	0	0	0	108.1	L1087 E1088	L1087-L1096 WeakPolarHBondContact CA-O 3.41Å; E1088-L1096 HydrophobicContact CB-CB 4.36Å; E1088-L1096 PolarHBondContact N-O 3.08Å; E1088-L1096 PolarHBondContact O-N 3.44Å
1097	L	88.7	Confident	81.8	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	121.3	173.4	179.2	62	0	0	0	108.6	S1034 A1035 I1037 V1085 L1087 L1111 L1114 L1118	S1034-L1097 CarbonylContact C-O 3.59Å; S1034-L1097 WeakPolarHBondContact CA-O 3.5Å; A1035-L1097 PolarHBondContact N-O 3.17Å; A1035-L1097 PolarHBondContact O-N 2.68Å; I1037-L1097 HydrophobicContact CD1-CB 4.44Å; V1085-L1097 HydrophobicContact CG1-CD1 3.61Å; L1087-L1097 HydrophobicContact CB-CD1 4.3Å; L1087-L1097 HydrophobicContact CD1-CD1 4.44Å; L1097-L1111 HydrophobicContact CB-CD1 4.18Å; L1097-L1111 HydrophobicContact CD2-CD1 3.77Å; L1097-L1111 HydrophobicContact CG-CD1 3.7Å; L1097-L1114 HydrophobicContact CD2-CB 3.72Å; L1097-L1114 HydrophobicContact CD2-CD1 4.33Å; L1097-L1118 HydrophobicContact CD2-CD1 4.26Å
1098	T	89.2	Confident	81.7	Confident	15 Å²	15	52.9 Å²	52.9	9%	0.092	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.7	-178.3	-69.1	0	0	0	0	109.6	E1032 S1034 V1085 T1086	E1032-T1098 HydrophobicContact CG-CG2 3.92Å; S1034-T1098 WeakPolarHBondContact CB-OG1 3.4Å; S1034-T1098 WeakPolarHBondContact OG-CB 3.46Å; S1034-T1098 VanDerWaalsContact OG-CG2 3.28Å; S1034-T1098 WeakPolarHBondContact OG-CG2 3.47Å; S1034-T1098 PolarHBondContact OG-OG1 3.14Å; V1085-T1098 WeakPolarHBondContact CA-O 3.32Å; T1086-T1098 PolarHBondContact N-O 3.46Å; T1086-T1098 PolarHBondContact O-N 3.43Å
1099	I	91.2	Very high	81.8	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.6	176.7	-56.4	-177.5	0	0	0	108.6	T1033 V1083 L1084 V1085 A1107 L1110 L1111 L1114	T1033-I1099 PolarHBondContact N-O 3.28Å; T1033-I1099 PolarHBondContact O-N 2.92Å; V1083-I1099 HydrophobicContact CG1-CG2 4.2Å; L1084-I1099 CarbonylContact O-C 3.55Å; L1084-I1099 WeakPolarHBondContact O-CA 3.38Å; V1085-I1099 HydrophobicContact CG1-CG1 4.3Å; V1085-I1099 HydrophobicContact CG2-CG1 4.29Å; I1099-A1107 HydrophobicContact CG2-CB 4.11Å; I1099-L1110 HydrophobicContact CD1-CB 4.01Å; I1099-L1110 HydrophobicContact CD1-CD2 4.1Å; I1099-L1110 HydrophobicContact CD1-CG 3.88Å; I1099-L1111 HydrophobicContact CD1-CB 3.82Å; I1099-L1111 HydrophobicContact CD1-CD1 4.07Å; I1099-L1111 HydrophobicContact CG1-CD1 4.19Å; I1099-L1114 HydrophobicContact CD1-CD1 4.18Å
1100	N	90.7	Very high	82.2	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119.7	175.2	-61.5	96.4	0	0	0	109.5	Q1024 L1027 N1031 E1032 L1084	Q1024-N1100 PolarHBondContact NE2-OD1 2.72Å; L1027-N1100 HydrophobicContact CB-CB 3.93Å; L1027-N1100 PolarHBondContact O-ND2 3.16Å; N1031-N1100 CarbonylContact O-C 3.24Å; N1031-N1100 WeakPolarHBondContact O-CA 3.23Å; E1032-N1100 WeakPolarHBondContact CG-ND2 3.29Å; L1084-N1100 HydrophobicContact CB-CB 4.33Å; L1084-N1100 PolarHBondContact N-O 2.85Å; L1084-N1100 PolarHBondContact O-N 2.77Å
1101	T	87.7	Confident	82.7	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164	152.1	172.5	-174	0	0	0	0	111.4	N1031 L1082 K1103 A1107	N1031-T1101 WeakPolarHBondContact CB-O 3.43Å; N1031-T1101 PolarHBondContact O-N 3.37Å; L1082-T1101 VanDerWaalsContact O-CB 3.26Å; L1082-T1101 WeakPolarHBondContact O-CB 3.41Å; L1082-T1101 PolarHBondContact O-OG1 3.25Å; T1101-K1103 PolarHBondContact O-N 3.22Å; T1101-K1103 PolarHBondContact OG1-N 2.93Å; T1101-A1107 HydrophobicContact CG2-CB 3.61Å
1102	E	85.7	Confident	83.9	Confident	125 Å²	125	42.2 Å²	42.2	58%	0.584	23%	0.233	S	C	*	.	S	Bend	trans	-64.4	-23.4	174.8	-58	177.5	164.9	0	0	112.6	L1027 T1104	L1027-E1102 HydrophobicContact CD2-CG 3.79Å; E1102-T1104 PolarHBondContact O-N 3.12Å
1103	K	84.5	Confident	85.2	Confident	60 Å²	60	38.8 Å²	38.8	26%	0.261	21%	0.206	S	C	.	.			trans	-95.3	72.9	-178.9	-63.3	-169.4	179	-174.7	0	111.2	D982 S1079 T1101 V1105 M1106 A1107	D982-K1103 HydrophobicContact CB-CD 4.19Å; D982-K1103 VanDerWaalsContact CB-NZ 3.34Å; D982-K1103 IonicContact OD2-NZ 3.6Å; D982-K1103 PolarHBondContact OD2-NZ 3.41Å; S1079-K1103 WeakPolarHBondContact OG-CE 3.04Å; S1079-K1103 PolarHBondContact OG-NZ 3.3Å; T1101-K1103 PolarHBondContact O-N 3.22Å; T1101-K1103 PolarHBondContact OG1-N 2.93Å; K1103-V1105 PolarHBondContact O-N 3.48Å; K1103-V1105 VanDerWaalsContact O-N 3.08Å; K1103-M1106 HydrophobicContact CB-CB 4.22Å; K1103-M1106 HydrophobicContact CB-CG 4.06Å; K1103-M1106 HydrophobicContact CB-SD 3.77Å; K1103-M1106 HydrophobicContact CD-SD 3.62Å; K1103-M1106 HydrophobicContact CG-SD 4.29Å; K1103-M1106 WeakPolarHBondContact O-CA 3.5Å; K1103-M1106 WeakPolarHBondContact O-CB 3.45Å; K1103-M1106 PolarHBondContact O-N 3.07Å; K1103-A1107 PolarHBondContact O-N 2.97Å
1104	T	81.9	Confident	86.2	Confident	65 Å²	65	35.9 Å²	35.9	40%	0.399	19%	0.186	S	C	.	.	H	α-helix	trans	-49.5	-35.4	-175.9	56.8	0	0	0	0	115	M1030 E1102 A1107 S1108	M1030-T1104 VanDerWaalsContact O-CG2 3.28Å; M1030-T1104 WeakPolarHBondContact O-CG2 3.39Å; E1102-T1104 PolarHBondContact O-N 3.12Å; T1104-A1107 WeakPolarHBondContact O-CB 3.38Å; T1104-A1107 PolarHBondContact O-N 3.45Å; T1104-S1108 PolarHBondContact O-N 2.57Å
1105	V	83.6	Confident	86.6	Confident	101 Å²	101	38.1 Å²	38.1	61%	0.612	19%	0.192	S	C	*	.	H	α-helix	trans	-62.2	-47.7	174.9	-178.7	0	0	0	0	111.2	K1103 A1107 S1108 M1109	K1103-V1105 PolarHBondContact O-N 3.48Å; K1103-V1105 VanDerWaalsContact O-N 3.08Å; V1105-A1107 VanDerWaalsContact C-N 3.3Å; V1105-A1107 PolarHBondContact O-N 3.41Å; V1105-S1108 PolarHBondContact O-N 3.41Å; V1105-S1108 PolarHBondContact O-OG 2.76Å; V1105-M1109 HydrophobicContact CG1-SD 4.37Å; V1105-M1109 PolarHBondContact O-N 2.94Å
1106	M	85.2	Confident	86.7	Confident	12 Å²	12	42.8 Å²	42.8	6%	0.059	21%	0.214	C	C	.	.	H	α-helix	trans	-62.2	-39.6	175.3	-62.9	177.4	77.9	0	0	110.9	D982 V1006 L1009 T1076 K1103 S1108 M1109 L1110	D982-M1106 HydrophobicContact CB-CE 4.3Å; D982-M1106 HydrophobicContact CB-SD 4Å; V1006-M1106 HydrophobicContact CG1-CB 3.95Å; V1006-M1106 HydrophobicContact CG1-CE 3.97Å; V1006-M1106 HydrophobicContact CG1-CG 4.43Å; L1009-M1106 HydrophobicContact CB-CE 4.15Å; L1009-M1106 HydrophobicContact CD1-CE 4.26Å; T1076-M1106 HydrophobicContact CG2-CE 3.8Å; T1076-M1106 HydrophobicContact CG2-SD 4.05Å; K1103-M1106 HydrophobicContact CB-CB 4.22Å; K1103-M1106 HydrophobicContact CB-CG 4.06Å; K1103-M1106 HydrophobicContact CB-SD 3.77Å; K1103-M1106 HydrophobicContact CD-SD 3.62Å; K1103-M1106 HydrophobicContact CG-SD 4.29Å; K1103-M1106 WeakPolarHBondContact O-CA 3.5Å; K1103-M1106 WeakPolarHBondContact O-CB 3.45Å; K1103-M1106 PolarHBondContact O-N 3.07Å; M1106-S1108 VanDerWaalsContact C-N 3.35Å; M1106-S1108 PolarHBondContact O-N 3.07Å; M1106-M1109 PolarHBondContact O-N 2.94Å; M1106-L1110 VanDerWaalsContact O-CB 3.24Å; M1106-L1110 WeakPolarHBondContact O-CB 3.42Å; M1106-L1110 PolarHBondContact O-N 3.33Å
1107	A	85.4	Confident	86.4	Confident	1 Å²	1	42 Å²	42	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-57.2	-47.6	175.5	0	0	0	0	0	111.4	I1099 T1101 K1103 T1104 V1105 M1109 L1111	I1099-A1107 HydrophobicContact CG2-CB 4.11Å; T1101-A1107 HydrophobicContact CG2-CB 3.61Å; K1103-A1107 PolarHBondContact O-N 2.97Å; T1104-A1107 WeakPolarHBondContact O-CB 3.38Å; T1104-A1107 PolarHBondContact O-N 3.45Å; V1105-A1107 VanDerWaalsContact C-N 3.3Å; V1105-A1107 PolarHBondContact O-N 3.41Å; A1107-M1109 PolarHBondContact O-N 3.38Å; A1107-L1111 WeakPolarHBondContact O-CB 3.18Å; A1107-L1111 PolarHBondContact O-N 3.48Å
1108	S	86.4	Confident	85.9	Confident	58 Å²	58	42 Å²	42	41%	0.406	21%	0.213	S	C	.	.	H	α-helix	trans	-64.2	-37.8	-178.9	77.3	0	0	0	0	113.4	T1104 V1105 M1106 R1112	T1104-S1108 PolarHBondContact O-N 2.57Å; V1105-S1108 PolarHBondContact O-N 3.41Å; V1105-S1108 PolarHBondContact O-OG 2.76Å; M1106-S1108 VanDerWaalsContact C-N 3.35Å; M1106-S1108 PolarHBondContact O-N 3.07Å; S1108-R1112 PolarHBondContact O-N 3.35Å
1109	M	86.9	Confident	85.2	Confident	43 Å²	43	44.2 Å²	44.2	21%	0.212	23%	0.229	C	C	.	.	H	α-helix	trans	-75.5	-45.9	178.7	-68.6	-179.9	72	0	0	111.5	T984 V1006 V1105 M1106 A1107 L1111 R1112 D1113	T984-M1109 HydrophobicContact CG2-CE 3.89Å; T984-M1109 HydrophobicContact CG2-SD 4.17Å; V1006-M1109 HydrophobicContact CG2-CB 3.77Å; V1006-M1109 HydrophobicContact CG2-CE 4.41Å; V1006-M1109 HydrophobicContact CG2-SD 4.43Å; V1105-M1109 HydrophobicContact CG1-SD 4.37Å; V1105-M1109 PolarHBondContact O-N 2.94Å; M1106-M1109 PolarHBondContact O-N 2.94Å; A1107-M1109 PolarHBondContact O-N 3.38Å; M1109-L1111 VanDerWaalsContact C-N 3.27Å; M1109-L1111 PolarHBondContact O-N 2.98Å; M1109-R1112 WeakPolarHBondContact O-CB 3.15Å; M1109-R1112 PolarHBondContact O-N 2.74Å; M1109-R1112 VanDerWaalsContact O-N 3.17Å; M1109-D1113 PolarHBondContact O-N 2.93Å
1110	L	88.7	Confident	83.8	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.016	26%	0.26	C	S	.	.	H	α-helix	trans	-60.7	-37.3	175.6	-173.9	62	0	0	0	111.7	V1006 L1010 A1057 V1083 V1085 I1099 M1106 D1113 L1114	V1006-L1110 HydrophobicContact CB-CB 4.49Å; V1006-L1110 HydrophobicContact CG1-CB 4.02Å; L1010-L1110 HydrophobicContact CD1-CD2 4.02Å; A1057-L1110 HydrophobicContact CB-CD1 4.06Å; V1083-L1110 HydrophobicContact CG1-CD2 3.93Å; V1085-L1110 HydrophobicContact CG2-CD2 4.42Å; I1099-L1110 HydrophobicContact CD1-CB 4.01Å; I1099-L1110 HydrophobicContact CD1-CD2 4.1Å; I1099-L1110 HydrophobicContact CD1-CG 3.88Å; M1106-L1110 VanDerWaalsContact O-CB 3.24Å; M1106-L1110 WeakPolarHBondContact O-CB 3.42Å; M1106-L1110 PolarHBondContact O-N 3.33Å; L1110-D1113 PolarHBondContact O-N 3.27Å; L1110-L1114 HydrophobicContact CD1-CD1 4.18Å; L1110-L1114 HydrophobicContact CD1-CG 4.27Å; L1110-L1114 HydrophobicContact CG-CD1 3.96Å; L1110-L1114 HydrophobicContact CG-CG 4.46Å; L1110-L1114 VanDerWaalsContact O-CB 3.28Å; L1110-L1114 WeakPolarHBondContact O-CB 3.27Å; L1110-L1114 WeakPolarHBondContact O-CG 3.31Å; L1110-L1114 PolarHBondContact O-N 2.95Å
1111	L	87.8	Confident	81.8	Confident	16 Å²	16	54.5 Å²	54.5	8%	0.084	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-43.1	175.4	-172.8	67.6	0	0	0	112	T1033 A1035 L1097 I1099 A1107 M1109 K1115	T1033-L1111 HydrophobicContact CG2-CD2 3.65Å; A1035-L1111 HydrophobicContact CB-CD1 4.22Å; A1035-L1111 HydrophobicContact CB-CD2 3.83Å; A1035-L1111 HydrophobicContact CB-CG 4.16Å; L1097-L1111 HydrophobicContact CB-CD1 4.18Å; L1097-L1111 HydrophobicContact CD2-CD1 3.77Å; L1097-L1111 HydrophobicContact CG-CD1 3.7Å; I1099-L1111 HydrophobicContact CD1-CB 3.82Å; I1099-L1111 HydrophobicContact CD1-CD1 4.07Å; I1099-L1111 HydrophobicContact CG1-CD1 4.19Å; A1107-L1111 WeakPolarHBondContact O-CB 3.18Å; A1107-L1111 PolarHBondContact O-N 3.48Å; M1109-L1111 VanDerWaalsContact C-N 3.27Å; M1109-L1111 PolarHBondContact O-N 2.98Å; L1111-K1115 WeakPolarHBondContact O-CB 3.41Å; L1111-K1115 PolarHBondContact O-N 2.81Å
1112	R	88.1	Confident	81.5	Confident	139 Å²	139	57.2 Å²	57.2	53%	0.525	30%	0.304	S	S	.	.	H	α-helix	trans	-64.2	-47.8	175.3	-179.6	-163.2	66.2	-169	-3.9	111.3	S1108 M1109 K1115 Q1116	S1108-R1112 PolarHBondContact O-N 3.35Å; M1109-R1112 WeakPolarHBondContact O-CB 3.15Å; M1109-R1112 PolarHBondContact O-N 2.74Å; M1109-R1112 VanDerWaalsContact O-N 3.17Å; R1112-K1115 PolarHBondContact O-N 2.8Å; R1112-Q1116 PolarHBondContact O-N 3.45Å
1113	D	86.1	Confident	81.3	Confident	33 Å²	33	53.6 Å²	53.6	18%	0.176	29%	0.29	C	S	.	.	H	α-helix	trans	-69.6	-39.1	-173.8	-60.4	-5.7	0	0	0	111	V1056 M1109 L1110 A1117	V1056-D1113 HydrophobicContact CG1-CB 4.3Å; M1109-D1113 PolarHBondContact O-N 2.93Å; L1110-D1113 PolarHBondContact O-N 3.27Å; D1113-A1117 PolarHBondContact O-N 3.04Å
1114	L	86.8	Confident	81.1	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-66.4	-44.9	169.9	-74.3	171.6	0	0	0	112.2	V1053 V1056 V1085 L1097 I1099 L1110 Q1116 A1117 L1118	V1053-L1114 HydrophobicContact CB-CD2 4.39Å; V1053-L1114 HydrophobicContact CG1-CD2 4.16Å; V1053-L1114 HydrophobicContact CG2-CD2 4.28Å; V1056-L1114 HydrophobicContact CB-CD2 3.8Å; V1056-L1114 HydrophobicContact CG1-CD2 3.83Å; V1056-L1114 HydrophobicContact CG1-CG 4.19Å; V1056-L1114 HydrophobicContact CG2-CD2 4.33Å; V1085-L1114 HydrophobicContact CG1-CD1 4.12Å; L1097-L1114 HydrophobicContact CD2-CB 3.72Å; L1097-L1114 HydrophobicContact CD2-CD1 4.33Å; I1099-L1114 HydrophobicContact CD1-CD1 4.18Å; L1110-L1114 HydrophobicContact CD1-CD1 4.18Å; L1110-L1114 HydrophobicContact CD1-CG 4.27Å; L1110-L1114 HydrophobicContact CG-CD1 3.96Å; L1110-L1114 HydrophobicContact CG-CG 4.46Å; L1110-L1114 VanDerWaalsContact O-CB 3.28Å; L1110-L1114 WeakPolarHBondContact O-CB 3.27Å; L1110-L1114 WeakPolarHBondContact O-CG 3.31Å; L1110-L1114 PolarHBondContact O-N 2.95Å; L1114-Q1116 VanDerWaalsContact C-N 3.27Å; L1114-Q1116 PolarHBondContact O-N 2.9Å; L1114-A1117 PolarHBondContact O-N 2.83Å; L1114-L1118 HydrophobicContact CB-CD1 4.47Å; L1114-L1118 VanDerWaalsContact O-CB 3.3Å; L1114-L1118 WeakPolarHBondContact O-CB 3.46Å; L1114-L1118 VanDerWaalsContact O-CG 3.25Å; L1114-L1118 WeakPolarHBondContact O-CG 3.49Å; L1114-L1118 PolarHBondContact O-N 3.09Å
1115	K	85.6	Confident	81.1	Confident	90 Å²	90	52.6 Å²	52.6	39%	0.391	29%	0.285	S	S	.	.	H	α-helix	trans	-56.7	-41.8	176.3	172.6	164.1	-174.7	153	0	111.6	T1036 I1037 L1111 R1112 S1119	T1036-K1115 PolarHBondContact O-NZ 3.45Å; I1037-K1115 HydrophobicContact CG2-CB 3.93Å; I1037-K1115 HydrophobicContact CG2-CD 3.79Å; I1037-K1115 HydrophobicContact CG2-CG 3.63Å; L1111-K1115 WeakPolarHBondContact O-CB 3.41Å; L1111-K1115 PolarHBondContact O-N 2.81Å; R1112-K1115 PolarHBondContact O-N 2.8Å; K1115-S1119 WeakPolarHBondContact O-CB 3.47Å; K1115-S1119 PolarHBondContact O-N 3.19Å; K1115-S1119 PolarHBondContact O-OG 2.86Å
1116	Q	84	Confident	80.9	Confident	97 Å²	97	49.6 Å²	49.6	45%	0.453	26%	0.264	S	S	.	.	H	α-helix	trans	-61.1	-57.2	176.4	-177.5	175.2	-18.1	0	0	110.9	R1112 L1114 L1118 S1119 Q1120	R1112-Q1116 PolarHBondContact O-N 3.45Å; L1114-Q1116 VanDerWaalsContact C-N 3.27Å; L1114-Q1116 PolarHBondContact O-N 2.9Å; Q1116-L1118 VanDerWaalsContact C-N 3.3Å; Q1116-L1118 PolarHBondContact O-N 2.84Å; Q1116-S1119 PolarHBondContact O-N 3.03Å; Q1116-S1119 PolarHBondContact O-OG 3.08Å; Q1116-Q1120 VanDerWaalsContact CG-CD 3.43Å; Q1116-Q1120 HydrophobicContact CG-CG 4.15Å; Q1116-Q1120 WeakPolarHBondContact O-CB 3.28Å; Q1116-Q1120 WeakPolarHBondContact O-CG 3.33Å; Q1116-Q1120 PolarHBondContact O-N 3.31Å
1117	A	79.8	Confident	80.6	Confident	21 Å²	21	52.1 Å²	52.1	17%	0.174	28%	0.278	C	S	.	.	H	α-helix	trans	-60.1	-37.5	-177.5	0	0	0	0	0	113.5	V1056 D1113 L1114 S1119	V1056-A1117 HydrophobicContact CG2-CB 3.39Å; D1113-A1117 PolarHBondContact O-N 3.04Å; L1114-A1117 PolarHBondContact O-N 2.83Å; A1117-S1119 VanDerWaalsContact C-N 3.27Å; A1117-S1119 PolarHBondContact O-N 3.23Å
1118	L	78.3	Confident	80.3	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-71.7	-20	179	-70.2	170.1	0	0	0	113.2	I1037 M1039 N1043 Q1052 V1053 L1087 L1097 L1114 Q1116	I1037-L1118 HydrophobicContact CD1-CB 3.89Å; I1037-L1118 HydrophobicContact CD1-CD1 3.61Å; I1037-L1118 HydrophobicContact CD1-CG 4.37Å; M1039-L1118 HydrophobicContact CE-CB 3.64Å; M1039-L1118 HydrophobicContact CE-CD2 3.98Å; M1039-L1118 HydrophobicContact CE-CG 4.34Å; M1039-L1118 WeakPolarHBondContact CE-O 3.48Å; N1043-L1118 PolarHBondContact ND2-O 2.62Å; Q1052-L1118 HydrophobicContact CB-CD2 4.01Å; V1053-L1118 HydrophobicContact CG2-CD2 4.44Å; L1087-L1118 HydrophobicContact CD1-CD1 3.9Å; L1097-L1118 HydrophobicContact CD2-CD1 4.26Å; L1114-L1118 HydrophobicContact CB-CD1 4.47Å; L1114-L1118 VanDerWaalsContact O-CB 3.3Å; L1114-L1118 WeakPolarHBondContact O-CB 3.46Å; L1114-L1118 VanDerWaalsContact O-CG 3.25Å; L1114-L1118 WeakPolarHBondContact O-CG 3.49Å; L1114-L1118 PolarHBondContact O-N 3.09Å; Q1116-L1118 VanDerWaalsContact C-N 3.3Å; Q1116-L1118 PolarHBondContact O-N 2.84Å
1119	S	74.6	Confident	79.8	Confident	61 Å²	61	55.5 Å²	55.5	43%	0.427	29%	0.289	S	S	.	.	H	α-helix	trans	-102.4	-9.9	176.8	66.8	0	0	0	0	116	K1115 Q1116 A1117	K1115-S1119 WeakPolarHBondContact O-CB 3.47Å; K1115-S1119 PolarHBondContact O-N 3.19Å; K1115-S1119 PolarHBondContact O-OG 2.86Å; Q1116-S1119 PolarHBondContact O-N 3.03Å; Q1116-S1119 PolarHBondContact O-OG 3.08Å; A1117-S1119 VanDerWaalsContact C-N 3.27Å; A1117-S1119 PolarHBondContact O-N 3.23Å
1120	Q	62.8	Low	79.3	Confident	140 Å²	140	56.6 Å²	56.6	65%	0.654	30%	0.296	S	S	*	.			trans	-110.5	22	-172.6	-73.3	-170.9	-20.6	0	0	114.5	Q1116	Q1116-Q1120 VanDerWaalsContact CG-CD 3.43Å; Q1116-Q1120 HydrophobicContact CG-CG 4.15Å; Q1116-Q1120 WeakPolarHBondContact O-CB 3.28Å; Q1116-Q1120 WeakPolarHBondContact O-CG 3.33Å; Q1116-Q1120 PolarHBondContact O-N 3.31Å
1121	A	48.4	Very low	78.4	Confident	77 Å²	77	61.5 Å²	61.5	64%	0.636	32%	0.321	S	S	*	.			trans	-124.3	0	-176.9	0	0	0	0	0	113.1	A1040	A1040-A1121 WeakPolarHBondContact CB-O 3.35Å

Retrieved 1,121 of 1,121 residues in 285 ms (Link to these results)

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