A0A087XT53_POEFO Loading...

Phospholipid-transporting ATPase

AlphaFold DB , UniProt , Accession A0A087XT53, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,179 aa.

						>A0A087XT53_POEFO|A0A087XT53
MTKPGGRGGEEEEEGAGPSGSSAGYRKADDEMSGTTSQADPVDATARTVILNRTQSTKFCDNHVSTTKYGILTFLPRFLYEQIRRAANAFFLFIALMQQIPDVSPTGRYTTLVPLIFILTVAGIKEIIEDYKRHKADNTVNKKKTTVLRSGAWQTIIWKQVAVGDIVKVTNGQHLPADMVIVSSSEPQAMCYIETSNLDGETNLKIRQGLPLTAGFQTLDDLMALSGHLECEGPNRHLYDFTGTLRLVNQNPAPLGPDQVLLRGAQLRNTQWVVGIVVYTGHDSKLMQNSTKVPLKRSNVERVTNMQILVLFGILLVMALVSSVGAAIWNREHTDEACWYLSRAGDISLNFAYNLLTFIILYNNLIPISLLVTLEVVKFTQALFINWDVEMYYSETDTPAMARTSNLNEELGQVKYLFSDKTGTLTCNIMHFKKCTIAGITYGHFPDLDCDRSMEDFSNLPSNSHNSTEFDDPSLIQNIEKNHPTSPQICEFLTMMAVCHTVVPEREDDQIIYQASSPDEGALVKAAKGLGFVFTARTPHSVIIDARGKEMTYELLNVLEFSSNRKRMSVVVRTPSGKLRLYCKGADNVIFERLTEASQYKDLTIAHLEQFATEGLRTLCFAYVDLEEGAYQEWLKEYNRVSTELKDRTQKLEECYELLEKNLMLLGATAIEDRLQAGVPDTIATLMRAGIKIWVLTGDKQETAINIGYSCRLVTHGMSLIIVNEDSLDATRATLTTHCSSLGDSLRKENELALIIDGQTLKYALSFELRQAFLDLALSCKAVICCRVSPLQKSEIVDMVKKHVKAITLAIGDGANDVGMIQTAHVGVGISGNEGMQATNSSDYSIAQFSYLEKLLLVHGAWSYNRVTKCILYCFYKNVVLYIIELWFAFVNGFSGQILFERWCIGLYNVIFTALPPFTLGIFDRPCSQQNMLRFPQLYRITQNAEGFNTKVFWGHCINALIHSIILFWFPLKMLEHDSPFSNGQGNDYLFAGNMVYTYVVVTVCLKAGMETTAWTRFSHLAVWGSMALWMVFFAVYSVFWPAIPIAPDMLGQAGKVMQCWYFWLGLVLVPTACLLKDFAWAATRRTLRKTLLEEVQELEARAVDPGAAVLRDSSGRSLNERAHLLTRVFRKTPSSVGRSNSVQQTVSHGYAFSQEEHGVVSQSQVVRSYDTTRQRPSL
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.9	Very low	31.6	Very low	235 Å²	235	145.4 Å²	145.4	100%	1.158	84%	0.842	S	S	*	*				0	129.1	0	-74.4	165.3	170.8	0	0	107.1
2	T	30.8	Very low	31.4	Very low	127 Å²	127	147.8 Å²	147.8	78%	0.779	84%	0.84	S	S	*	*			cis	-163.9	139.8	-5	-5.2	0	0	0	0	111
3	K	29.8	Very low	31	Very low	204 Å²	204	150.5 Å²	150.5	89%	0.887	84%	0.841	S	S	*	*			trans	66.1	134.4	168.2	-68.6	-170.2	172.1	-174.9	0	119.8
4	P	53.1	Low	30.8	Very low	134 Å²	134	153.9 Å²	153.9	87%	0.87	85%	0.847	S	S	*	*			trans	-121.9	179.5	170.5	43	-32.5	0	0	0	114.6
5	G	28.5	Very low	30.4	Very low	84 Å²	84	149.1 Å²	149.1	87%	0.866	85%	0.847	S	S	*	*			trans	100.4	151.8	162.2	0	0	0	0	0	116.1
6	G	29.9	Very low	30.2	Very low	73 Å²	73	146.6 Å²	146.6	75%	0.753	85%	0.851	S	S	*	*			cis	159.3	162.1	-6.6	0	0	0	0	0	113.7
7	R	31.5	Very low	29.9	Very low	265 Å²	265	142.4 Å²	142.4	100%	1	85%	0.846	S	S	*	*			trans	70.1	151.9	-175.1	-58.5	176.8	168.1	175.1	-6.4	115.1
8	G	26.8	Very low	30.2	Very low	71 Å²	71	142.1 Å²	142.1	73%	0.732	85%	0.848	S	S	*	*			cis	-151.2	164.3	-11	0	0	0	0	0	107.1
9	G	27.8	Very low	30.2	Very low	57 Å²	57	141.3 Å²	141.3	59%	0.588	85%	0.851	S	S	*	*			cis	105.5	134.4	43.2	0	0	0	0	0	108.7
10	E	28.8	Very low	29.9	Very low	174 Å²	174	138.2 Å²	138.2	81%	0.813	85%	0.848	S	S	*	*			cis	-116.3	-141.6	-1	-100.4	48.5	-107.2	0	0	108.6
11	E	27.8	Very low	29.8	Very low	175 Å²	175	137.7 Å²	137.7	82%	0.818	85%	0.851	S	S	*	*			cis	-153.5	-122.4	8.2	-149.6	145.1	-110.8	0	0	111.3
12	E	28.5	Very low	29.5	Very low	175 Å²	175	132.2 Å²	132.2	82%	0.818	84%	0.835	S	S	*	*			trans	-126.1	174.2	-160.5	-59.3	173.2	141.8	0	0	113.9
13	E	26.9	Very low	29.4	Very low	182 Å²	182	130.8 Å²	130.8	85%	0.85	84%	0.837	S	S	*	*			cis	-153.4	161.7	12.4	-155.7	178.9	-165.6	0	0	111.6
14	E	27.7	Very low	29.3	Very low	198 Å²	198	124.7 Å²	124.7	93%	0.925	83%	0.832	S	S	*	*			trans	-102.4	149.9	175.4	-78.4	-166.8	122.7	0	0	113.9
15	G	25.3	Very low	27.9	Very low	82 Å²	82	129.7 Å²	129.7	85%	0.845	84%	0.835	S	S	*	*			trans	-141.7	130.8	169.7	0	0	0	0	0	112.2
16	A	26.7	Very low	27.7	Very low	110 Å²	110	137 Å²	137	91%	0.909	84%	0.837	S	S	*	*			trans	-116.5	138.7	-155.2	0	0	0	0	0	117.4
17	G	25.2	Very low	27.6	Very low	75 Å²	75	142.4 Å²	142.4	77%	0.773	84%	0.839	S	S	*	*			trans	86.7	177.9	151.9	0	0	0	0	0	117.9
18	P	35.9	Very low	27.6	Very low	136 Å²	136	133.7 Å²	133.7	88%	0.883	82%	0.824	S	S	*	*			cis	-112.7	174.5	-0.3	40.5	-30.6	0	0	0	114.1
19	S	29.5	Very low	27.5	Very low	128 Å²	128	138.2 Å²	138.2	90%	0.895	83%	0.832	S	S	*	*			trans	-86.4	150	176.6	49.6	0	0	0	0	113.4
20	G	25.1	Very low	27.4	Very low	78 Å²	78	140.9 Å²	140.9	80%	0.804	83%	0.832	S	S	*	*			trans	-146.7	128.2	172.2	0	0	0	0	0	110.6
21	S	27.4	Very low	27.4	Very low	129 Å²	129	142 Å²	142	90%	0.902	84%	0.837	S	S	*	*			trans	-86.6	136.2	-171.7	48.6	0	0	0	0	113.2
22	S	26.8	Very low	27.4	Very low	119 Å²	119	142.9 Å²	142.9	83%	0.832	84%	0.844	S	S	*	*			trans	-111.9	117.9	165.1	53.9	0	0	0	0	110
23	A	27.7	Very low	27.2	Very low	98 Å²	98	138.5 Å²	138.5	81%	0.81	83%	0.832	S	S	*	*			trans	-78.8	143.1	174.4	0	0	0	0	0	110.4
24	G	27.7	Very low	27.2	Very low	76 Å²	76	133.3 Å²	133.3	78%	0.784	83%	0.828	S	S	*	*			trans	-70	149.3	-166.2	0	0	0	0	0	115.5
25	Y	24.4	Very low	27.4	Very low	239 Å²	239	130.3 Å²	130.3	94%	0.937	82%	0.824	S	S	*	*			trans	-114.4	154.3	157.2	-103.6	-98	0	0	0	110.5
26	R	24.9	Very low	27.7	Very low	238 Å²	238	133.1 Å²	133.1	90%	0.898	83%	0.825	S	S	*	*			trans	-79.3	141	-161.5	-66.8	173.2	173.4	153.7	-3.3	113.1	A28	R26-A28 PolarHBondContact O-N 3.15Å
27	K	27.7	Very low	27.6	Very low	185 Å²	185	132.7 Å²	132.7	80%	0.804	82%	0.815	S	S	*	*			trans	-64.6	117.1	158	-90.1	-163.5	166.9	-147.5	0	110.1	D30	K27-D30 IonicContact NZ-OD2 3.65Å; K27-D30 PolarHBondContact NZ-OD2 2.59Å
28	A	30.1	Very low	27.9	Very low	83 Å²	83	138.7 Å²	138.7	69%	0.686	82%	0.823	S	S	*	*			trans	-167.4	93.6	158.9	0	0	0	0	0	108.5	R26	R26-A28 PolarHBondContact O-N 3.15Å
29	D	26.1	Very low	27.5	Very low	166 Å²	166	136.3 Å²	136.3	89%	0.888	81%	0.814	S	S	*	*			trans	163.7	52.1	156	-84.7	-12.1	0	0	0	110.5
30	D	25	Very low	27.3	Very low	112 Å²	112	136.7 Å²	136.7	60%	0.599	81%	0.806	S	S	*	*			trans	-105.5	70	174.3	-88.9	-39.8	0	0	0	110	K27	K27-D30 IonicContact NZ-OD2 3.65Å; K27-D30 PolarHBondContact NZ-OD2 2.59Å
31	E	28.8	Very low	27.8	Very low	197 Å²	197	139 Å²	139	92%	0.921	81%	0.807	S	S	*	*	S	Bend	trans	-140.5	11.5	174.5	-142.3	174.7	-137.1	0	0	113.7
32	M	27.3	Very low	28.2	Very low	194 Å²	194	138.8 Å²	138.8	96%	0.956	80%	0.8	S	S	*	*	S	Bend	trans	-145.5	22.2	-177.7	-146.3	174.1	-171.2	0	0	115.5
33	S	25.5	Very low	28.7	Very low	83 Å²	83	139.9 Å²	139.9	58%	0.58	80%	0.797	S	S	*	*			trans	-111.1	1.7	178.2	50.5	0	0	0	0	114	T35	S33-T35 PolarHBondContact O-N 2.86Å
34	G	27.5	Very low	29.7	Very low	74 Å²	74	139 Å²	139	76%	0.763	79%	0.79	S	S	*	*			trans	-86.5	24.8	-163.7	0	0	0	0	0	118.3
35	T	30.3	Very low	31.4	Very low	135 Å²	135	141.1 Å²	141.1	83%	0.828	79%	0.788	S	S	*	*	S	Bend	trans	-143.3	42.7	178.7	61.5	0	0	0	0	114.6	S33	S33-T35 PolarHBondContact O-N 2.86Å
36	T	31.2	Very low	34	Very low	141 Å²	141	133.2 Å²	133.2	87%	0.865	77%	0.772	S	S	*	*			trans	-134.9	55.4	166	54.9	0	0	0	0	112.3
37	S	24.6	Very low	37	Very low	101 Å²	101	123.3 Å²	123.3	71%	0.706	73%	0.734	S	S	*	*	S	Bend	trans	-125.4	138.8	152.2	51.8	0	0	0	0	108	A39	S37-A39 VanDerWaalsContact C-N 3.34Å; S37-A39 PolarHBondContact O-N 3.23Å
38	Q	32.7	Very low	40	Very low	201 Å²	201	117.3 Å²	117.3	94%	0.939	71%	0.713	S	S	*	*			trans	-71.8	97.2	164.5	-73.2	173.8	-52.2	0	0	106.8
39	A	26.2	Very low	42.8	Very low	85 Å²	85	113.3 Å²	113.3	70%	0.702	68%	0.68	S	S	*	*			trans	-80	128.7	159.6	0	0	0	0	0	107.4	S37	S37-A39 VanDerWaalsContact C-N 3.34Å; S37-A39 PolarHBondContact O-N 3.23Å
40	D	26.9	Very low	45.8	Very low	136 Å²	136	107.8 Å²	107.8	73%	0.727	65%	0.65	S	S	*	*			trans	-56	148	172.5	-62.7	-69.8	0	0	0	110.6	V42	D40-V42 PolarHBondContact O-N 3.25Å
41	P	35.8	Very low	48.8	Very low	127 Å²	127	102.7 Å²	102.7	83%	0.825	62%	0.623	S	S	*	*			trans	-74.1	75.1	-176.2	31.1	-36.2	0	0	0	111.8	D43	P41-D43 PolarHBondContact O-N 3.5Å; P41-D43 VanDerWaalsContact O-N 3.15Å
42	V	34	Very low	51.4	Low	124 Å²	124	96.3 Å²	96.3	75%	0.752	60%	0.595	S	S	*	*			trans	-71.3	104	173.1	-178.1	0	0	0	0	109.4	D40	D40-V42 PolarHBondContact O-N 3.25Å
43	D	38.8	Very low	53.9	Low	143 Å²	143	95.8 Å²	95.8	77%	0.765	58%	0.582	S	S	*	*			trans	46.6	65.1	167.7	-66.2	-31.6	0	0	0	116.6	P41 T45	P41-D43 PolarHBondContact O-N 3.5Å; P41-D43 VanDerWaalsContact O-N 3.15Å; D43-T45 PolarHBondContact O-N 3.43Å
44	A	49.2	Very low	56.4	Low	80 Å²	80	98.2 Å²	98.2	66%	0.661	59%	0.594	S	S	*	*			trans	-64.1	97.1	154.4	0	0	0	0	0	109.2	A46	A44-A46 PolarHBondContact O-N 2.69Å; A44-A46 VanDerWaalsContact O-N 3.14Å
45	T	63.4	Low	59.2	Low	120 Å²	120	96.7 Å²	96.7	74%	0.736	57%	0.567	S	S	*	*			trans	-56	117.3	-172.2	54.4	0	0	0	0	112.3	D43	D43-T45 PolarHBondContact O-N 3.43Å
46	A	77.4	Confident	61.4	Low	73 Å²	73	95.4 Å²	95.4	60%	0.603	56%	0.564	S	S	*	*			trans	-59.3	136	-178.9	0	0	0	0	0	112.1	A44 C231	A44-A46 PolarHBondContact O-N 2.69Å; A44-A46 VanDerWaalsContact O-N 3.14Å; A46-C231 CarbonylContact C-O 3.55Å; A46-C231 WeakPolarHBondContact CA-O 3.44Å
47	R	88.5	Confident	63.8	Low	29 Å²	29	92.4 Å²	92.4	11%	0.109	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	115.7	177	173.2	172.6	-61.1	-145.8	-3.3	109.7	V49 F59 C231 V278 D283	R47-V49 HydrophobicContact CG-CG2 4.12Å; R47-F59 HydrophobicContact CG-CE1 3.8Å; R47-F59 HydrophobicContact CG-CZ 4.12Å; R47-C231 PolarHBondContact N-O 3.21Å; R47-C231 PolarHBondContact O-N 3.42Å; R47-C231 PolarHBondContact O-SG 2.84Å; R47-C231 VanDerWaalsContact O-SG 3.35Å; R47-V278 PolarHBondContact NH1-O 3.38Å; R47-V278 VanDerWaalsContact NH1-O 3.11Å; R47-D283 IonicContact CZ-OD2 2.92Å; R47-D283 VanDerWaalsContact CZ-OD2 3.25Å; R47-D283 IonicContact NH1-OD2 2.73Å; R47-D283 PolarHBondContact NH1-OD2 3.45Å; R47-D283 IonicContact NH2-OD2 3.85Å; R47-D283 PolarHBondContact NH2-OD2 3.3Å
48	T	89.9	Confident	66.7	Low	59 Å²	59	97.5 Å²	97.5	36%	0.362	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.4	128.8	170.7	-48.2	0	0	0	0	110.7	H228 L229 E230	T48-H228 HydrophobicContact CG2-CB 4.25Å; T48-L229 CarbonylContact C-O 3.55Å; T48-L229 VanDerWaalsContact CA-O 3.3Å; T48-L229 WeakPolarHBondContact CA-O 3.46Å; T48-E230 HydrophobicContact CG2-CG 4.26Å
49	V	89.9	Confident	69.4	Low	0 Å²	0	90.2 Å²	90.2	0%	0	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	122.2	175.2	-177.1	0	0	0	0	108.9	R47 V163 H228 L229	R47-V49 HydrophobicContact CG-CG2 4.12Å; V49-V163 HydrophobicContact CB-CG1 4.3Å; V49-V163 HydrophobicContact CG1-CG1 3.85Å; V49-V163 HydrophobicContact CG2-CG1 3.47Å; V49-V163 VanDerWaalsContact CG2-CG1 3.47Å; V49-H228 WeakPolarHBondContact O-CA 3.26Å; V49-L229 HydrophobicContact CB-CB 4.31Å; V49-L229 PolarHBondContact N-O 2.8Å; V49-L229 PolarHBondContact O-N 3.01Å
50	I	90	Very high	72.4	Confident	49 Å²	49	88 Å²	88	25%	0.251	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	132	-178.5	-47.7	175.8	0	0	0	109.1	R53 Q55	I50-R53 HydrophobicContact CG2-CB 3.86Å; I50-R53 HydrophobicContact CG2-CG 4.33Å; I50-Q55 PolarHBondContact O-NE2 3.48Å
51	L	86.9	Confident	75.5	Confident	5 Å²	5	85.8 Å²	85.8	3%	0.026	49%	0.487	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	138.8	-177.8	-52.9	-177.7	0	0	0	111.4	R53 L225 G227 L245 L247 I276	L51-R53 PolarHBondContact O-N 2.87Å; L51-L225 HydrophobicContact CD1-CD2 4.2Å; L51-L225 HydrophobicContact CD1-CG 4.21Å; L51-G227 WeakPolarHBondContact CB-O 3.4Å; L51-G227 WeakPolarHBondContact CG-O 3.39Å; L51-G227 PolarHBondContact N-O 3.27Å; L51-L245 HydrophobicContact CD1-CD1 4.09Å; L51-L247 HydrophobicContact CD1-CD2 3.67Å; L51-I276 HydrophobicContact CD2-CD1 3.72Å; L51-I276 HydrophobicContact CD2-CG1 4.33Å; L51-I276 HydrophobicContact CD2-CG2 4.07Å
52	N	82.5	Confident	78.3	Confident	63 Å²	63	79.7 Å²	79.7	34%	0.337	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	28.6	177.2	-75.5	-31.9	0	0	0	115.4	I166 L222 L225	N52-I166 WeakPolarHBondContact OD1-CD1 3.31Å; N52-L222 PolarHBondContact ND2-O 2.71Å; N52-L225 PolarHBondContact ND2-O 2.87Å
53	R	80.8	Confident	81	Confident	183 Å²	183	76.5 Å²	76.5	69%	0.691	42%	0.424	S	S	*	.	S	Bend	trans	-141.3	160.2	179.3	-66.2	-176.5	179.4	-173.8	0.6	111.5	I50 L51 Q55	I50-R53 HydrophobicContact CG2-CB 3.86Å; I50-R53 HydrophobicContact CG2-CG 4.33Å; L51-R53 PolarHBondContact O-N 2.87Å; R53-Q55 PolarHBondContact O-N 2.98Å; R53-Q55 PolarHBondContact O-NE2 3.1Å
54	T	78.4	Confident	83.2	Confident	134 Å²	134	70.1 Å²	70.1	82%	0.822	39%	0.391	S	S	*	.			trans	-63.7	127.9	171	49.9	0	0	0	0	110.7
55	Q	85.5	Confident	84.7	Confident	42 Å²	42	68.5 Å²	68.5	20%	0.196	37%	0.374	C	S	.	.			trans	-65.3	140.2	176.2	-51.3	-52.6	-34.7	0	0	111	I50 R53 F59 V163	I50-Q55 PolarHBondContact O-NE2 3.48Å; R53-Q55 PolarHBondContact O-N 2.98Å; R53-Q55 PolarHBondContact O-NE2 3.1Å; Q55-F59 HydrophobicContact CB-CD2 4.24Å; Q55-F59 HydrophobicContact CB-CE2 3.91Å; Q55-F59 HydrophobicContact CG-CD2 4.18Å; Q55-F59 HydrophobicContact CG-CE2 3.89Å; Q55-V163 WeakPolarHBondContact CG-O 3.42Å
56	S	76.9	Confident	85.2	Confident	109 Å²	109	66.4 Å²	66.4	76%	0.762	36%	0.362	S	S	*	.	S	Bend	trans	-80.2	-25.8	175.5	52.2	0	0	0	0	112.9
57	T	81.9	Confident	85.2	Confident	77 Å²	77	64.2 Å²	64.2	47%	0.472	34%	0.34	S	S	.	.	S	Bend	trans	-97.1	146.6	177.7	44.3	0	0	0	0	111.2	F59	T57-F59 WeakPolarHBondContact OG1-CE2 3.38Å; T57-F59 WeakPolarHBondContact OG1-CZ 3.47Å
58	K	85.6	Confident	84.2	Confident	209 Å²	209	65.2 Å²	65.2	91%	0.909	35%	0.346	S	S	*	.			trans	-91.8	107.5	178.4	-173.5	-178.8	179	-176.8	0	110.6
59	F	89.4	Confident	83.6	Confident	47 Å²	47	62.7 Å²	62.7	21%	0.206	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-86.7	171.8	177.4	-63.2	-67.1	0	0	0	113.5	R47 Q55 T57 V163	R47-F59 HydrophobicContact CG-CE1 3.8Å; R47-F59 HydrophobicContact CG-CZ 4.12Å; Q55-F59 HydrophobicContact CB-CD2 4.24Å; Q55-F59 HydrophobicContact CB-CE2 3.91Å; Q55-F59 HydrophobicContact CG-CD2 4.18Å; Q55-F59 HydrophobicContact CG-CE2 3.89Å; T57-F59 WeakPolarHBondContact OG1-CE2 3.38Å; T57-F59 WeakPolarHBondContact OG1-CZ 3.47Å; F59-V163 HydrophobicContact CB-CB 4.14Å; F59-V163 HydrophobicContact CB-CG2 3.68Å; F59-V163 HydrophobicContact CD1-CG2 4.36Å; F59-V163 HydrophobicContact CD2-CB 3.55Å; F59-V163 HydrophobicContact CD2-CG1 3.75Å; F59-V163 HydrophobicContact CD2-CG2 4Å; F59-V163 HydrophobicContact CE2-CB 4.06Å; F59-V163 HydrophobicContact CE2-CG1 3.72Å; F59-V163 HydrophobicContact CG-CB 3.87Å; F59-V163 HydrophobicContact CG-CG1 4.18Å; F59-V163 HydrophobicContact CG-CG2 3.76Å; F59-V163 HydrophobicContact CZ-CG1 4.16Å
60	C	89.2	Confident	83.2	Confident	39 Å²	39	64.3 Å²	64.3	26%	0.264	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-62.8	142.2	171.9	-167.1	0	0	0	0	111.1	T280 D283	C60-T280 PolarHBondContact O-OG1 3.21Å; C60-D283 HydrophobicContact CB-CB 4.5Å
61	D	92.4	Very high	82.7	Confident	89 Å²	89	69.9 Å²	69.9	48%	0.476	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-76.6	150.4	172	70.9	-49.6	0	0	0	110.6	H63 G281	D61-H63 PolarHBondContact O-N 3.44Å; D61-H63 WeakPolarHBondContact OD2-CB 3.26Å; D61-G281 WeakPolarHBondContact O-CA 3.36Å
62	N	93	Very high	82.7	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	41%	0.414	C	S	.	.	S	Bend	trans	-75.8	19.8	-173.7	-161.9	48.4	0	0	0	114.7	W158 V161 P176 R263 T280 G281	N62-W158 WeakPolarHBondContact CB-O 3.45Å; N62-W158 PolarHBondContact ND2-O 3.3Å; N62-V161 HydrophobicContact CB-CB 4.11Å; N62-V161 WeakPolarHBondContact CB-O 3.48Å; N62-P176 PolarHBondContact ND2-O 3.47Å; N62-P176 PolarHBondContact OD1-O 3.46Å; N62-R263 VanDerWaalsContact CG-NH1 3.26Å; N62-R263 PolarHBondContact ND2-NH1 3.09Å; N62-R263 PolarHBondContact O-NH1 2.83Å; N62-R263 PolarHBondContact OD1-NH1 3.39Å; N62-T280 HydrophobicContact CB-CG2 3.94Å; N62-T280 WeakPolarHBondContact OD1-CA 3.49Å; N62-G281 PolarHBondContact OD1-N 2.95Å
63	H	91.3	Very high	82.9	Confident	57 Å²	57	77.1 Å²	77.1	26%	0.264	42%	0.415	S	S	.	.			trans	-74.8	134.4	173.9	-177.7	-118.1	0	0	0	111.2	D61 N141 K159	D61-H63 PolarHBondContact O-N 3.44Å; D61-H63 WeakPolarHBondContact OD2-CB 3.26Å; H63-N141 WeakPolarHBondContact CA-OD1 3.45Å; H63-N141 PolarHBondContact CD2-ND2 2.9Å; H63-K159 HydrophobicContact CB-CD 4.3Å; H63-K159 HydrophobicContact CB-CG 4.21Å; H63-K159 PolarHBondContact CD2-NZ 2.75Å; H63-K159 PolarHBondContact NE2-NZ 2.98Å
64	V	84.7	Confident	83.2	Confident	9 Å²	9	70.1 Å²	70.1	6%	0.055	39%	0.389	C	S	.	.			trans	-113.5	138	172.2	162.1	0	0	0	0	110	T66 N141 M287	V64-T66 HydrophobicContact CG1-CG2 4.4Å; V64-N141 PolarHBondContact N-OD1 2.93Å; V64-N141 PolarHBondContact O-ND2 2.86Å; V64-M287 HydrophobicContact CB-CE 4.46Å; V64-M287 HydrophobicContact CB-SD 4.35Å; V64-M287 HydrophobicContact CG1-CE 3.65Å; V64-M287 HydrophobicContact CG1-SD 3.69Å; V64-M287 HydrophobicContact CG2-CE 4.15Å; V64-M287 HydrophobicContact CG2-CG 3.8Å; V64-M287 HydrophobicContact CG2-SD 3.67Å
65	S	81.3	Confident	83.7	Confident	45 Å²	45	68.7 Å²	68.7	32%	0.315	38%	0.376	S	S	.	.			trans	-136.4	121.8	173.4	-174.3	0	0	0	0	110.8	T67 D137 H282	S65-T67 PolarHBondContact OG-OG1 3.12Å; S65-D137 WeakPolarHBondContact CA-OD2 3.33Å; S65-H282 PolarHBondContact N-NE2 3.26Å
66	T	74.5	Confident	83.8	Confident	77 Å²	77	70.5 Å²	70.5	47%	0.472	39%	0.391	S	S	.	.			trans	-103.6	-6.4	175.9	63.4	0	0	0	0	112.5	V64 D137	V64-T66 HydrophobicContact CG1-CG2 4.4Å; T66-D137 WeakPolarHBondContact CB-OD1 3.09Å; T66-D137 WeakPolarHBondContact CG2-OD1 3.36Å; T66-D137 PolarHBondContact N-OD1 3.01Å; T66-D137 PolarHBondContact N-OD2 2.88Å; T66-D137 PolarHBondContact OG1-OD1 2.85Å; T66-D137 PolarHBondContact OG1-OD2 3.18Å
67	T	75.6	Confident	84.1	Confident	26 Å²	26	71.7 Å²	71.7	16%	0.16	38%	0.379	C	S	.	.			trans	-66.6	139.3	-175.5	54.7	0	0	0	0	113.4	S65 R133 H134 D137	S65-T67 PolarHBondContact OG-OG1 3.12Å; T67-R133 HydrophobicContact CG2-CB 3.67Å; T67-H134 WeakPolarHBondContact CB-NE2 3.2Å; T67-H134 HydrophobicContact CG2-CB 4.14Å; T67-H134 WeakPolarHBondContact CG2-CD2 3.4Å; T67-H134 VanDerWaalsContact CG2-CE1 3.44Å; T67-H134 WeakPolarHBondContact CG2-CE1 3.34Å; T67-H134 VanDerWaalsContact CG2-CG 3.45Å; T67-H134 VanDerWaalsContact CG2-NE2 3.34Å; T67-H134 WeakPolarHBondContact CG2-NE2 3.42Å; T67-D137 WeakPolarHBondContact CG2-OD2 3.46Å
68	K	68.4	Low	84.4	Confident	50 Å²	50	68.3 Å²	68.3	22%	0.217	36%	0.358	C	S	.	.	S	Bend	trans	-75.7	-30.1	-177.9	-172.9	179.1	171.1	-158.8	0	111.7	R77 E81 E126 D130	K68-R77 PolarHBondContact O-NH1 2.9Å; K68-E81 WeakPolarHBondContact CE-OE1 3.5Å; K68-E81 WeakPolarHBondContact CE-OE2 3.5Å; K68-E81 IonicContact NZ-OE1 3.67Å; K68-E81 IonicContact NZ-OE2 3.68Å; K68-E81 PolarHBondContact NZ-OE2 2.71Å; K68-E126 IonicContact NZ-OE1 2.73Å; K68-E126 PolarHBondContact NZ-OE1 2.67Å; K68-E126 IonicContact NZ-OE2 3.61Å; K68-E126 PolarHBondContact NZ-OE2 3.18Å; K68-D130 WeakPolarHBondContact CB-OD1 3.42Å; K68-D130 PolarHBondContact N-OD1 3.4Å; K68-D130 PolarHBondContact N-OD2 3.01Å
69	Y	76.6	Confident	84.4	Confident	7 Å²	7	61.2 Å²	61.2	3%	0.027	33%	0.33	C	S	.	.			trans	-130.5	141.3	-174.2	-49.2	-73.7	0	0	0	112.8	F74 R77 E81 E126 D130 H134	Y69-F74 HydrophobicContact CD1-CD2 4.18Å; Y69-F74 AromaticContact CD2-CD2 3.65Å; Y69-F74 HydrophobicContact CD2-CD2 3.65Å; Y69-F74 HydrophobicContact CD2-CE2 4.14Å; Y69-F74 HydrophobicContact CE2-CD2 4.01Å; Y69-F74 HydrophobicContact CE2-CE2 4.09Å; Y69-F74 HydrophobicContact CG-CB 4.36Å; Y69-F74 AromaticContact CG-CD2 3.71Å; Y69-F74 HydrophobicContact CG-CD2 3.71Å; Y69-R77 HydrophobicContact CD1-CB 3.88Å; Y69-R77 HydrophobicContact CE1-CB 3.7Å; Y69-E81 PolarHBondContact OH-OE2 2.9Å; Y69-E126 HydrophobicContact CE2-CB 4.32Å; Y69-E126 WeakPolarHBondContact CE2-OE2 3.4Å; Y69-E126 PolarHBondContact OH-OE2 2.99Å; Y69-D130 HydrophobicContact CD2-CB 4.17Å; Y69-D130 PolarHBondContact N-OD2 2.83Å; Y69-H134 PolarHBondContact O-NE2 3.4Å; Y69-H134 VanDerWaalsContact O-NE2 3.17Å
70	G	81.4	Confident	84.2	Confident	33 Å²	33	65.8 Å²	65.8	34%	0.34	35%	0.347	S	S	.	.			trans	-92.7	160.9	159.1	0	0	0	0	0	110.1	L72 T73 F74	G70-L72 VanDerWaalsContact C-N 3.26Å; G70-L72 PolarHBondContact O-N 3.12Å; G70-L72 VanDerWaalsContact O-N 3.14Å; G70-T73 WeakPolarHBondContact CA-OG1 3.47Å; G70-T73 PolarHBondContact N-OG1 2.94Å; G70-T73 CarbonylContact O-C 3.5Å; G70-T73 PolarHBondContact O-N 3.39Å; G70-T73 PolarHBondContact O-OG1 2.81Å; G70-F74 PolarHBondContact O-N 3.11Å
71	I	81.2	Confident	83.6	Confident	167 Å²	167	66.7 Å²	66.7	86%	0.856	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-44.6	-175.3	-60.6	170.3	0	0	0	112.2
72	L	85.4	Confident	83.2	Confident	163 Å²	163	62.7 Å²	62.7	85%	0.853	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-19.1	179.1	-61.6	176.2	0	0	0	114.1	G70	G70-L72 VanDerWaalsContact C-N 3.26Å; G70-L72 PolarHBondContact O-N 3.12Å; G70-L72 VanDerWaalsContact O-N 3.14Å
73	T	86.9	Confident	82.8	Confident	57 Å²	57	66.3 Å²	66.3	35%	0.35	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-8	-176.5	60.3	0	0	0	0	113.7	G70 R77	G70-T73 WeakPolarHBondContact CA-OG1 3.47Å; G70-T73 PolarHBondContact N-OG1 2.94Å; G70-T73 CarbonylContact O-C 3.5Å; G70-T73 PolarHBondContact O-N 3.39Å; G70-T73 PolarHBondContact O-OG1 2.81Å; T73-R77 VanDerWaalsContact O-CB 3.31Å; T73-R77 WeakPolarHBondContact O-CB 3.4Å; T73-R77 WeakPolarHBondContact O-CG 3.47Å; T73-R77 PolarHBondContact O-N 3.02Å
74	F	87.8	Confident	82.2	Confident	35 Å²	35	71.7 Å²	71.7	15%	0.154	36%	0.362	C	S	.	.	H	α-helix	trans	-54.2	-66.9	174.1	174.3	-101.5	0	0	0	111.8	Y69 G70 R77 F78 E126 I127	Y69-F74 HydrophobicContact CD1-CD2 4.18Å; Y69-F74 AromaticContact CD2-CD2 3.65Å; Y69-F74 HydrophobicContact CD2-CD2 3.65Å; Y69-F74 HydrophobicContact CD2-CE2 4.14Å; Y69-F74 HydrophobicContact CE2-CD2 4.01Å; Y69-F74 HydrophobicContact CE2-CE2 4.09Å; Y69-F74 HydrophobicContact CG-CB 4.36Å; Y69-F74 AromaticContact CG-CD2 3.71Å; Y69-F74 HydrophobicContact CG-CD2 3.71Å; G70-F74 PolarHBondContact O-N 3.11Å; F74-R77 PolarHBondContact O-N 2.84Å; F74-F78 HydrophobicContact CD2-CB 4.5Å; F74-F78 HydrophobicContact CE1-CB 4.42Å; F74-F78 HydrophobicContact CE1-CG 4.46Å; F74-F78 HydrophobicContact CE2-CB 4.14Å; F74-F78 HydrophobicContact CE2-CD2 4.35Å; F74-F78 HydrophobicContact CE2-CG 4.34Å; F74-F78 HydrophobicContact CZ-CB 4.08Å; F74-F78 HydrophobicContact CZ-CD1 4.44Å; F74-F78 HydrophobicContact CZ-CD2 4.13Å; F74-F78 AromaticContact CZ-CG 3.95Å; F74-F78 HydrophobicContact CZ-CG 3.95Å; F74-F78 WeakPolarHBondContact O-CB 3.43Å; F74-F78 PolarHBondContact O-N 3.27Å; F74-E126 HydrophobicContact CE2-CB 4.1Å; F74-I127 HydrophobicContact CD1-CG1 4.49Å; F74-I127 HydrophobicContact CD2-CG1 4.4Å; F74-I127 HydrophobicContact CE1-CD1 3.82Å; F74-I127 HydrophobicContact CE1-CG1 3.89Å; F74-I127 HydrophobicContact CE2-CG1 3.79Å; F74-I127 HydrophobicContact CZ-CD1 3.85Å; F74-I127 HydrophobicContact CZ-CG1 3.51Å
75	L	87.8	Confident	81.8	Confident	105 Å²	105	74.4 Å²	74.4	55%	0.55	37%	0.371	S	S	.	.	H	α-helix	trans	-55	-50.5	-172.6	-174.6	64.8	0	0	0	113.8	L79	L75-L79 HydrophobicContact CD1-CD1 3.78Å; L75-L79 HydrophobicContact CD1-CG 4.02Å; L75-L79 HydrophobicContact CG-CD1 3.95Å; L75-L79 HydrophobicContact CG-CG 4.5Å; L75-L79 WeakPolarHBondContact O-CB 3.35Å; L75-L79 VanDerWaalsContact O-CG 3.3Å; L75-L79 WeakPolarHBondContact O-CG 3.49Å; L75-L79 PolarHBondContact O-N 3.14Å
76	P	89.4	Confident	81.7	Confident	80 Å²	80	75.2 Å²	75.2	52%	0.519	38%	0.38	S	S	.	.	H	α-helix	trans	-67.3	-37.1	-179.8	25.4	-34.3	0	0	0	113.3	Y80	P76-Y80 VanDerWaalsContact O-CB 3.27Å; P76-Y80 WeakPolarHBondContact O-CB 3.48Å; P76-Y80 PolarHBondContact O-N 3.26Å; P76-Y80 VanDerWaalsContact O-N 3.08Å
77	R	83.3	Confident	81.8	Confident	133 Å²	133	71.6 Å²	71.6	50%	0.502	36%	0.358	S	S	.	.	H	α-helix	trans	-71	-44.5	176.7	-72.4	-177.8	170.7	-178.9	-0.7	111.9	K68 Y69 T73 F74 Y80 E81	K68-R77 PolarHBondContact O-NH1 2.9Å; Y69-R77 HydrophobicContact CD1-CB 3.88Å; Y69-R77 HydrophobicContact CE1-CB 3.7Å; T73-R77 VanDerWaalsContact O-CB 3.31Å; T73-R77 WeakPolarHBondContact O-CB 3.4Å; T73-R77 WeakPolarHBondContact O-CG 3.47Å; T73-R77 PolarHBondContact O-N 3.02Å; F74-R77 PolarHBondContact O-N 2.84Å; R77-Y80 PolarHBondContact O-N 2.61Å; R77-E81 WeakPolarHBondContact O-CB 3.37Å; R77-E81 WeakPolarHBondContact O-CG 3.49Å; R77-E81 PolarHBondContact O-N 3.27Å
78	F	86.2	Confident	82.2	Confident	7 Å²	7	70.6 Å²	70.6	3%	0.031	35%	0.352	C	S	.	.	H	α-helix	trans	-58.6	-49.9	176.7	171.7	-99	0	0	0	111.3	F74 Y80 E81 Q82 L119 A122 G123 E126	F74-F78 HydrophobicContact CD2-CB 4.5Å; F74-F78 HydrophobicContact CE1-CB 4.42Å; F74-F78 HydrophobicContact CE1-CG 4.46Å; F74-F78 HydrophobicContact CE2-CB 4.14Å; F74-F78 HydrophobicContact CE2-CD2 4.35Å; F74-F78 HydrophobicContact CE2-CG 4.34Å; F74-F78 HydrophobicContact CZ-CB 4.08Å; F74-F78 HydrophobicContact CZ-CD1 4.44Å; F74-F78 HydrophobicContact CZ-CD2 4.13Å; F74-F78 AromaticContact CZ-CG 3.95Å; F74-F78 HydrophobicContact CZ-CG 3.95Å; F74-F78 WeakPolarHBondContact O-CB 3.43Å; F74-F78 PolarHBondContact O-N 3.27Å; F78-Y80 VanDerWaalsContact C-N 3.35Å; F78-Y80 PolarHBondContact O-N 3.29Å; F78-E81 PolarHBondContact O-N 3.4Å; F78-Q82 HydrophobicContact CD1-CG 4.44Å; F78-Q82 HydrophobicContact CD2-CG 4.17Å; F78-Q82 HydrophobicContact CE1-CG 4.02Å; F78-Q82 HydrophobicContact CE2-CG 3.73Å; F78-Q82 HydrophobicContact CG-CG 4.5Å; F78-Q82 HydrophobicContact CZ-CG 3.63Å; F78-Q82 WeakPolarHBondContact O-CB 3.3Å; F78-Q82 VanDerWaalsContact O-CG 3.31Å; F78-Q82 WeakPolarHBondContact O-CG 3.29Å; F78-Q82 PolarHBondContact O-N 3.27Å; F78-L119 WeakPolarHBondContact CZ-O 3.34Å; F78-A122 HydrophobicContact CE2-CB 4.28Å; F78-A122 HydrophobicContact CZ-CB 4.01Å; F78-G123 VanDerWaalsContact CZ-CA 3.4Å; F78-G123 VanDerWaalsContact CZ-N 3.26Å; F78-E126 HydrophobicContact CD2-CB 4.38Å; F78-E126 HydrophobicContact CD2-CG 4.12Å; F78-E126 HydrophobicContact CE2-CG 4.08Å
79	L	86.1	Confident	83	Confident	60 Å²	60	70.1 Å²	70.1	31%	0.314	36%	0.357	S	S	.	.	H	α-helix	trans	-62.7	-40.6	177.3	-70.6	175.3	0	0	0	111.9	L75 Q82 I83	L75-L79 HydrophobicContact CD1-CD1 3.78Å; L75-L79 HydrophobicContact CD1-CG 4.02Å; L75-L79 HydrophobicContact CG-CD1 3.95Å; L75-L79 HydrophobicContact CG-CG 4.5Å; L75-L79 WeakPolarHBondContact O-CB 3.35Å; L75-L79 VanDerWaalsContact O-CG 3.3Å; L75-L79 WeakPolarHBondContact O-CG 3.49Å; L75-L79 PolarHBondContact O-N 3.14Å; L79-Q82 PolarHBondContact O-N 2.91Å; L79-I83 HydrophobicContact CB-CD1 4.48Å; L79-I83 VanDerWaalsContact O-CB 3.3Å; L79-I83 WeakPolarHBondContact O-CB 3.46Å; L79-I83 WeakPolarHBondContact O-CD1 3.2Å; L79-I83 WeakPolarHBondContact O-CG1 3.38Å; L79-I83 PolarHBondContact O-N 3.15Å
80	Y	84.9	Confident	83.3	Confident	143 Å²	143	70.7 Å²	70.7	56%	0.561	36%	0.36	S	S	*	.	H	α-helix	trans	-62.1	-45.4	175.1	179.1	-108.4	0	0	0	112.5	P76 R77 F78 R84	P76-Y80 VanDerWaalsContact O-CB 3.27Å; P76-Y80 WeakPolarHBondContact O-CB 3.48Å; P76-Y80 PolarHBondContact O-N 3.26Å; P76-Y80 VanDerWaalsContact O-N 3.08Å; R77-Y80 PolarHBondContact O-N 2.61Å; F78-Y80 VanDerWaalsContact C-N 3.35Å; F78-Y80 PolarHBondContact O-N 3.29Å; Y80-R84 HydrophobicContact CE2-CG 4.48Å; Y80-R84 VanDerWaalsContact O-CG 3.32Å; Y80-R84 WeakPolarHBondContact O-CG 3.16Å; Y80-R84 PolarHBondContact O-N 2.86Å
81	E	78.3	Confident	83.5	Confident	57 Å²	57	69.3 Å²	69.3	27%	0.266	34%	0.344	S	S	.	.	H	α-helix	trans	-64.1	-39.1	176	-75.2	178.7	-150.1	0	0	112.6	K68 Y69 R77 F78	K68-E81 WeakPolarHBondContact CE-OE1 3.5Å; K68-E81 WeakPolarHBondContact CE-OE2 3.5Å; K68-E81 IonicContact NZ-OE1 3.67Å; K68-E81 IonicContact NZ-OE2 3.68Å; K68-E81 PolarHBondContact NZ-OE2 2.71Å; Y69-E81 PolarHBondContact OH-OE2 2.9Å; R77-E81 WeakPolarHBondContact O-CB 3.37Å; R77-E81 WeakPolarHBondContact O-CG 3.49Å; R77-E81 PolarHBondContact O-N 3.27Å; F78-E81 PolarHBondContact O-N 3.4Å
82	Q	83.8	Confident	83.9	Confident	6 Å²	6	64.2 Å²	64.2	3%	0.028	32%	0.319	C	S	.	.	H	α-helix	trans	-71.8	-41.2	177.6	-69.6	-63.7	-13.1	0	0	112.5	F78 L79 R84 R85 N88 L119	F78-Q82 HydrophobicContact CD1-CG 4.44Å; F78-Q82 HydrophobicContact CD2-CG 4.17Å; F78-Q82 HydrophobicContact CE1-CG 4.02Å; F78-Q82 HydrophobicContact CE2-CG 3.73Å; F78-Q82 HydrophobicContact CG-CG 4.5Å; F78-Q82 HydrophobicContact CZ-CG 3.63Å; F78-Q82 WeakPolarHBondContact O-CB 3.3Å; F78-Q82 VanDerWaalsContact O-CG 3.31Å; F78-Q82 WeakPolarHBondContact O-CG 3.29Å; F78-Q82 PolarHBondContact O-N 3.27Å; L79-Q82 PolarHBondContact O-N 2.91Å; Q82-R84 VanDerWaalsContact C-N 3.28Å; Q82-R84 PolarHBondContact O-N 3.4Å; Q82-R85 VanDerWaalsContact O-CB 3.31Å; Q82-R85 WeakPolarHBondContact O-CB 3.35Å; Q82-R85 PolarHBondContact O-N 2.71Å; Q82-R85 VanDerWaalsContact OE1-CZ 3.26Å; Q82-R85 VanDerWaalsContact OE1-NE 3.16Å; Q82-N88 VanDerWaalsContact O-CB 3.27Å; Q82-N88 WeakPolarHBondContact O-CB 3.46Å; Q82-N88 PolarHBondContact O-ND2 3.04Å; Q82-N88 PolarHBondContact OE1-ND2 2.89Å; Q82-N88 VanDerWaalsContact OE1-ND2 3.09Å; Q82-L119 HydrophobicContact CB-CD2 3.77Å; Q82-L119 HydrophobicContact CG-CD2 4.03Å
83	I	83.6	Confident	84	Confident	75 Å²	75	61.8 Å²	61.8	39%	0.385	30%	0.302	S	S	.	.	H	α-helix	trans	-70.7	-25.5	178.7	-67.2	166.4	0	0	0	111.2	L79 R85 L92	L79-I83 HydrophobicContact CB-CD1 4.48Å; L79-I83 VanDerWaalsContact O-CB 3.3Å; L79-I83 WeakPolarHBondContact O-CB 3.46Å; L79-I83 WeakPolarHBondContact O-CD1 3.2Å; L79-I83 WeakPolarHBondContact O-CG1 3.38Å; L79-I83 PolarHBondContact O-N 3.15Å; I83-R85 PolarHBondContact O-N 3.02Å; I83-L92 HydrophobicContact CD1-CD2 3.92Å; I83-L92 HydrophobicContact CG1-CD2 4.1Å
84	R	79	Confident	84	Confident	171 Å²	171	59.1 Å²	59.1	65%	0.645	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-7.1	168.2	-76	179.7	77.6	174.2	6.9	114.2	Y80 Q82	Y80-R84 HydrophobicContact CE2-CG 4.48Å; Y80-R84 VanDerWaalsContact O-CG 3.32Å; Y80-R84 WeakPolarHBondContact O-CG 3.16Å; Y80-R84 PolarHBondContact O-N 2.86Å; Q82-R84 VanDerWaalsContact C-N 3.28Å; Q82-R84 PolarHBondContact O-N 3.4Å
85	R	77.1	Confident	84	Confident	66 Å²	66	57.6 Å²	57.6	25%	0.249	28%	0.279	C	S	.	.	S	Bend	trans	-83.4	119	167.3	-54.3	-174.2	-174.7	-175	3.1	109	Q82 I83 A87 N88 A89 E375	Q82-R85 VanDerWaalsContact O-CB 3.31Å; Q82-R85 WeakPolarHBondContact O-CB 3.35Å; Q82-R85 PolarHBondContact O-N 2.71Å; Q82-R85 VanDerWaalsContact OE1-CZ 3.26Å; Q82-R85 VanDerWaalsContact OE1-NE 3.16Å; I83-R85 PolarHBondContact O-N 3.02Å; R85-A87 VanDerWaalsContact C-N 3.28Å; R85-A87 PolarHBondContact O-N 3.02Å; R85-A87 VanDerWaalsContact O-N 3.14Å; R85-N88 HydrophobicContact CB-CB 4.29Å; R85-N88 WeakPolarHBondContact O-CB 3.3Å; R85-N88 PolarHBondContact O-N 2.91Å; R85-A89 PolarHBondContact O-N 2.8Å; R85-A89 VanDerWaalsContact O-N 3.08Å; R85-E375 IonicContact CZ-OE1 2.71Å; R85-E375 IonicContact NH1-OE1 2.71Å; R85-E375 PolarHBondContact NH1-OE1 2.68Å; R85-E375 IonicContact NH2-OE1 2.66Å
86	A	77.7	Confident	84.1	Confident	61 Å²	61	57.9 Å²	57.9	50%	0.504	28%	0.281	S	S	.	.	H	α-helix	trans	-54.5	-38.2	-172.5	0	0	0	0	0	114.4	A89 F90	A86-A89 PolarHBondContact O-N 2.85Å; A86-F90 PolarHBondContact O-N 3.44Å
87	A	77.9	Confident	83.9	Confident	2 Å²	2	54.7 Å²	54.7	2%	0.017	26%	0.259	C	S	.	.	H	α-helix	trans	-65.5	-40.1	176.2	0	0	0	0	0	112.9	R85 F90 F91 I308 L371	R85-A87 VanDerWaalsContact C-N 3.28Å; R85-A87 PolarHBondContact O-N 3.02Å; R85-A87 VanDerWaalsContact O-N 3.14Å; A87-F90 PolarHBondContact O-N 3.01Å; A87-F91 HydrophobicContact CB-CE2 4.3Å; A87-F91 WeakPolarHBondContact O-CD2 3Å; A87-F91 WeakPolarHBondContact O-CG 3.3Å; A87-F91 PolarHBondContact O-N 2.94Å; A87-I308 HydrophobicContact CB-CD1 4.34Å; A87-I308 HydrophobicContact CB-CG2 4.38Å; A87-L371 HydrophobicContact CB-CD1 3.91Å
88	N	83.1	Confident	84.1	Confident	5 Å²	5	48.4 Å²	48.4	3%	0.027	24%	0.235	C	C	.	.	H	α-helix	trans	-66.8	-39.7	175.8	-69.2	-9.4	0	0	0	111.3	Q82 R85 F91 L92	Q82-N88 VanDerWaalsContact O-CB 3.27Å; Q82-N88 WeakPolarHBondContact O-CB 3.46Å; Q82-N88 PolarHBondContact O-ND2 3.04Å; Q82-N88 PolarHBondContact OE1-ND2 2.89Å; Q82-N88 VanDerWaalsContact OE1-ND2 3.09Å; R85-N88 HydrophobicContact CB-CB 4.29Å; R85-N88 WeakPolarHBondContact O-CB 3.3Å; R85-N88 PolarHBondContact O-N 2.91Å; N88-F91 PolarHBondContact O-N 3.46Å; N88-L92 VanDerWaalsContact O-CB 3.3Å; N88-L92 WeakPolarHBondContact O-CB 3.22Å; N88-L92 PolarHBondContact O-N 3.07Å
89	A	84.8	Confident	84.2	Confident	39 Å²	39	51.3 Å²	51.3	32%	0.322	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-42.7	173.6	0	0	0	0	0	112	R85 A86 L92 F93	R85-A89 PolarHBondContact O-N 2.8Å; R85-A89 VanDerWaalsContact O-N 3.08Å; A86-A89 PolarHBondContact O-N 2.85Å; A89-L92 PolarHBondContact O-N 3.32Å; A89-F93 WeakPolarHBondContact O-CB 3.25Å; A89-F93 PolarHBondContact O-N 3.29Å
90	F	84.6	Confident	84.2	Confident	19 Å²	19	51.5 Å²	51.5	8%	0.083	25%	0.249	C	C	.	.	H	α-helix	trans	-60.3	-50.8	174.2	167.6	-106.3	0	0	0	112	A86 A87 L92 F93 I94 F312 L315 I366	A86-F90 PolarHBondContact O-N 3.44Å; A87-F90 PolarHBondContact O-N 3.01Å; F90-L92 VanDerWaalsContact C-N 3.32Å; F90-L92 PolarHBondContact O-N 3.15Å; F90-F93 WeakPolarHBondContact O-CB 3.39Å; F90-F93 PolarHBondContact O-N 2.98Å; F90-I94 HydrophobicContact CD2-CG1 4.04Å; F90-I94 HydrophobicContact CE1-CG1 4.29Å; F90-I94 HydrophobicContact CE2-CD1 3.86Å; F90-I94 HydrophobicContact CE2-CG1 3.53Å; F90-I94 HydrophobicContact CZ-CD1 4.21Å; F90-I94 HydrophobicContact CZ-CG1 3.68Å; F90-I94 WeakPolarHBondContact O-CG1 3.25Å; F90-I94 PolarHBondContact O-N 2.88Å; F90-F312 AromaticContact CD2-CD2 3.65Å; F90-F312 HydrophobicContact CD2-CD2 3.65Å; F90-F312 AromaticContact CD2-CE2 3.71Å; F90-F312 HydrophobicContact CD2-CE2 3.71Å; F90-F312 HydrophobicContact CD2-CG 4.37Å; F90-F312 HydrophobicContact CD2-CZ 4.46Å; F90-F312 AromaticContact CE2-CD2 3.39Å; F90-F312 HydrophobicContact CE2-CD2 3.39Å; F90-F312 AromaticContact CE2-CE2 3.52Å; F90-F312 HydrophobicContact CE2-CE2 3.52Å; F90-F312 HydrophobicContact CE2-CG 4.43Å; F90-F312 HydrophobicContact CZ-CD2 4.27Å; F90-L315 HydrophobicContact CZ-CD1 4.26Å; F90-I366 HydrophobicContact CD1-CD1 4.21Å; F90-I366 HydrophobicContact CE1-CB 4.03Å; F90-I366 HydrophobicContact CE1-CD1 3.75Å; F90-I366 HydrophobicContact CE1-CG1 4.31Å; F90-I366 HydrophobicContact CE1-CG2 4.4Å; F90-I366 HydrophobicContact CZ-CD1 3.93Å
91	F	85.1	Confident	83.9	Confident	4 Å²	4	48 Å²	48	2%	0.018	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-32.2	179.9	-62.6	-50	0	0	0	112.9	A87 N88 A95 T111 L115 I366 I368 L371	A87-F91 HydrophobicContact CB-CE2 4.3Å; A87-F91 WeakPolarHBondContact O-CD2 3Å; A87-F91 WeakPolarHBondContact O-CG 3.3Å; A87-F91 PolarHBondContact O-N 2.94Å; N88-F91 PolarHBondContact O-N 3.46Å; F91-A95 WeakPolarHBondContact O-CB 3.41Å; F91-A95 PolarHBondContact O-N 3.03Å; F91-T111 HydrophobicContact CB-CG2 4.36Å; F91-L115 HydrophobicContact CB-CD1 4.13Å; F91-L115 HydrophobicContact CB-CD2 4.38Å; F91-I366 HydrophobicContact CE1-CB 4.39Å; F91-I366 HydrophobicContact CE1-CG2 4.26Å; F91-I366 HydrophobicContact CZ-CB 4.39Å; F91-I366 HydrophobicContact CZ-CG2 3.82Å; F91-I368 HydrophobicContact CD1-CD1 4.3Å; F91-I368 HydrophobicContact CD1-CG1 3.55Å; F91-I368 HydrophobicContact CD2-CG1 4.38Å; F91-I368 HydrophobicContact CE1-CB 4.28Å; F91-I368 HydrophobicContact CE1-CD1 4.29Å; F91-I368 HydrophobicContact CE1-CG1 3.25Å; F91-I368 HydrophobicContact CE2-CB 4.42Å; F91-I368 HydrophobicContact CE2-CG1 4.15Å; F91-I368 HydrophobicContact CG-CG1 4.12Å; F91-I368 HydrophobicContact CZ-CB 4.13Å; F91-I368 HydrophobicContact CZ-CG1 3.59Å; F91-L371 HydrophobicContact CE2-CD1 4.43Å
92	L	88.3	Confident	83.8	Confident	61 Å²	61	52 Å²	52	32%	0.319	27%	0.267	S	S	.	.	H	α-helix	trans	-65.2	-44.9	171.6	-179.9	60.4	0	0	0	111.6	I83 N88 A89 F90 A95 L96 L115	I83-L92 HydrophobicContact CD1-CD2 3.92Å; I83-L92 HydrophobicContact CG1-CD2 4.1Å; N88-L92 VanDerWaalsContact O-CB 3.3Å; N88-L92 WeakPolarHBondContact O-CB 3.22Å; N88-L92 PolarHBondContact O-N 3.07Å; A89-L92 PolarHBondContact O-N 3.32Å; F90-L92 VanDerWaalsContact C-N 3.32Å; F90-L92 PolarHBondContact O-N 3.15Å; L92-A95 PolarHBondContact O-N 3.16Å; L92-L96 HydrophobicContact CG-CD1 4.37Å; L92-L96 WeakPolarHBondContact O-CG 3.31Å; L92-L96 PolarHBondContact O-N 2.91Å; L92-L115 HydrophobicContact CB-CD2 4.13Å; L92-L115 HydrophobicContact CD1-CD2 4.34Å
93	F	88.3	Confident	83.5	Confident	112 Å²	112	51.8 Å²	51.8	49%	0.491	27%	0.267	S	S	.	.	H	α-helix	trans	-59.9	-45.4	175.9	174.8	-103.5	0	0	0	112.1	A89 F90 L96 M97	A89-F93 WeakPolarHBondContact O-CB 3.25Å; A89-F93 PolarHBondContact O-N 3.29Å; F90-F93 WeakPolarHBondContact O-CB 3.39Å; F90-F93 PolarHBondContact O-N 2.98Å; F93-L96 PolarHBondContact O-N 2.79Å; F93-M97 HydrophobicContact CD1-SD 4.06Å; F93-M97 HydrophobicContact CE1-CG 4.41Å; F93-M97 HydrophobicContact CE1-SD 3.39Å; F93-M97 WeakPolarHBondContact CE1-SD 3.31Å; F93-M97 HydrophobicContact CE2-SD 4.49Å; F93-M97 HydrophobicContact CZ-CG 4.36Å; F93-M97 HydrophobicContact CZ-SD 3.64Å; F93-M97 PolarHBondContact O-N 3.34Å
94	I	87.3	Confident	83.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.5	-40.5	175.8	-64.3	-64.4	0	0	0	111.9	F90 L96 M97 Q98 T111 I359 N363	F90-I94 HydrophobicContact CD2-CG1 4.04Å; F90-I94 HydrophobicContact CE1-CG1 4.29Å; F90-I94 HydrophobicContact CE2-CD1 3.86Å; F90-I94 HydrophobicContact CE2-CG1 3.53Å; F90-I94 HydrophobicContact CZ-CD1 4.21Å; F90-I94 HydrophobicContact CZ-CG1 3.68Å; F90-I94 WeakPolarHBondContact O-CG1 3.25Å; F90-I94 PolarHBondContact O-N 2.88Å; I94-L96 VanDerWaalsContact C-N 3.26Å; I94-L96 PolarHBondContact O-N 2.97Å; I94-M97 HydrophobicContact CD1-SD 4.27Å; I94-M97 PolarHBondContact O-N 3.21Å; I94-Q98 WeakPolarHBondContact O-CG 3.28Å; I94-Q98 PolarHBondContact O-N 3.05Å; I94-T111 HydrophobicContact CG2-CG2 4.27Å; I94-I359 HydrophobicContact CD1-CG2 3.64Å; I94-N363 HydrophobicContact CG2-CB 3.87Å; I94-N363 WeakPolarHBondContact CG2-ND2 3.43Å
95	A	87.1	Confident	82.9	Confident	3 Å²	3	42 Å²	42	3%	0.025	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-32.1	176.3	0	0	0	0	0	112.4	F91 L92 Q99 T111 L112 L115	F91-A95 WeakPolarHBondContact O-CB 3.41Å; F91-A95 PolarHBondContact O-N 3.03Å; L92-A95 PolarHBondContact O-N 3.16Å; A95-Q99 WeakPolarHBondContact O-CG 3.46Å; A95-Q99 PolarHBondContact O-NE2 2.73Å; A95-T111 HydrophobicContact CB-CG2 4.18Å; A95-L112 HydrophobicContact CB-CB 4.26Å; A95-L112 HydrophobicContact CB-CD1 4.25Å; A95-L115 HydrophobicContact CB-CD2 4.36Å
96	L	89.4	Confident	82.7	Confident	112 Å²	112	39.1 Å²	39.1	59%	0.586	22%	0.22	S	C	*	.	H	α-helix	trans	-71.1	-45.3	171.3	-70.1	168.4	0	0	0	111.7	L92 F93 I94 Q98 Q99	L92-L96 HydrophobicContact CG-CD1 4.37Å; L92-L96 WeakPolarHBondContact O-CG 3.31Å; L92-L96 PolarHBondContact O-N 2.91Å; F93-L96 PolarHBondContact O-N 2.79Å; I94-L96 VanDerWaalsContact C-N 3.26Å; I94-L96 PolarHBondContact O-N 2.97Å; L96-Q98 VanDerWaalsContact C-N 3.26Å; L96-Q98 PolarHBondContact O-N 3.09Å; L96-Q99 WeakPolarHBondContact O-CB 3.35Å; L96-Q99 PolarHBondContact O-N 3.25Å
97	M	86.8	Confident	82.6	Confident	13 Å²	13	37.2 Å²	37.2	6%	0.064	21%	0.207	C	C	.	.	H	α-helix	trans	-56.7	-38.7	173.7	-79.4	-179.3	47.8	0	0	112.5	F93 I94 Q99 I100 L356 I359 I360	F93-M97 HydrophobicContact CD1-SD 4.06Å; F93-M97 HydrophobicContact CE1-CG 4.41Å; F93-M97 HydrophobicContact CE1-SD 3.39Å; F93-M97 WeakPolarHBondContact CE1-SD 3.31Å; F93-M97 HydrophobicContact CE2-SD 4.49Å; F93-M97 HydrophobicContact CZ-CG 4.36Å; F93-M97 HydrophobicContact CZ-SD 3.64Å; F93-M97 PolarHBondContact O-N 3.34Å; I94-M97 HydrophobicContact CD1-SD 4.27Å; I94-M97 PolarHBondContact O-N 3.21Å; M97-Q99 PolarHBondContact O-N 2.97Å; M97-Q99 VanDerWaalsContact O-N 3.15Å; M97-I100 WeakPolarHBondContact O-CB 3.43Å; M97-I100 WeakPolarHBondContact O-CG1 3.14Å; M97-I100 PolarHBondContact O-N 2.89Å; M97-I100 VanDerWaalsContact O-N 3.15Å; M97-L356 HydrophobicContact CE-CB 4.07Å; M97-L356 HydrophobicContact CE-CD2 3.47Å; M97-L356 VanDerWaalsContact CE-CD2 3.47Å; M97-L356 HydrophobicContact CE-CG 4.35Å; M97-L356 HydrophobicContact SD-CD2 4.12Å; M97-I359 HydrophobicContact CE-CB 4.04Å; M97-I359 HydrophobicContact CE-CG2 3.61Å; M97-I359 HydrophobicContact SD-CG2 4.26Å; M97-I360 HydrophobicContact CB-CD1 4.29Å; M97-I360 HydrophobicContact CB-CG1 4.49Å; M97-I360 HydrophobicContact CE-CD1 4.37Å; M97-I360 HydrophobicContact CE-CG1 3.95Å
98	Q	87.1	Confident	82.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-11.7	177	-77.9	-169	-36.2	0	0	114.7	I94 L96 T106 R108 T110 T111 I360	I94-Q98 WeakPolarHBondContact O-CG 3.28Å; I94-Q98 PolarHBondContact O-N 3.05Å; L96-Q98 VanDerWaalsContact C-N 3.26Å; L96-Q98 PolarHBondContact O-N 3.09Å; Q98-T106 PolarHBondContact NE2-OG1 2.77Å; Q98-R108 WeakPolarHBondContact O-CA 3.12Å; Q98-R108 WeakPolarHBondContact O-CG 3.45Å; Q98-T110 PolarHBondContact NE2-OG1 2.94Å; Q98-T110 PolarHBondContact OE1-OG1 2.95Å; Q98-T111 PolarHBondContact NE2-OG1 2.99Å; Q98-T111 PolarHBondContact OE1-OG1 3.39Å; Q98-I360 HydrophobicContact CG-CD1 4.14Å; Q98-I360 HydrophobicContact CG-CG1 4.35Å; Q98-I360 HydrophobicContact CG-CG2 3.84Å
99	Q	88.7	Confident	82.7	Confident	68 Å²	68	50 Å²	50	32%	0.318	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-15.3	174.8	-52.3	-42.4	-55.4	0	0	113.3	A95 L96 M97 R108	A95-Q99 WeakPolarHBondContact O-CG 3.46Å; A95-Q99 PolarHBondContact O-NE2 2.73Å; L96-Q99 WeakPolarHBondContact O-CB 3.35Å; L96-Q99 PolarHBondContact O-N 3.25Å; M97-Q99 PolarHBondContact O-N 2.97Å; M97-Q99 VanDerWaalsContact O-N 3.15Å; Q99-R108 PolarHBondContact NE2-O 3.48Å
100	I	85.8	Confident	82.4	Confident	64 Å²	64	50.3 Å²	50.3	33%	0.328	25%	0.253	S	S	.	.	S	Bend	trans	-64.7	127	176.7	-54.8	173.8	0	0	0	107.8	M97 V103	M97-I100 WeakPolarHBondContact O-CB 3.43Å; M97-I100 WeakPolarHBondContact O-CG1 3.14Å; M97-I100 PolarHBondContact O-N 2.89Å; M97-I100 VanDerWaalsContact O-N 3.15Å; I100-V103 HydrophobicContact CB-CB 4.38Å; I100-V103 HydrophobicContact CB-CG2 4.15Å; I100-V103 HydrophobicContact CG2-CB 4.38Å; I100-V103 HydrophobicContact CG2-CG2 3.62Å
101	P	79.3	Confident	82.1	Confident	70 Å²	70	49.4 Å²	49.4	46%	0.455	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	145.6	178	26.5	-34.7	0	0	0	110.5	V103	P101-V103 PolarHBondContact O-N 3.18Å
102	D	75	Confident	82.1	Confident	140 Å²	140	51.5 Å²	51.5	75%	0.749	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	5.7	168.9	-41.5	-38.3	0	0	0	116.7
103	V	78.3	Confident	81.8	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.012	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-27	174.7	-175.4	0	0	0	0	113.5	I100 P101 P105 Y353 L356 T357 I360	I100-V103 HydrophobicContact CB-CB 4.38Å; I100-V103 HydrophobicContact CB-CG2 4.15Å; I100-V103 HydrophobicContact CG2-CB 4.38Å; I100-V103 HydrophobicContact CG2-CG2 3.62Å; P101-V103 PolarHBondContact O-N 3.18Å; V103-P105 VanDerWaalsContact O-CD 3.24Å; V103-P105 WeakPolarHBondContact O-CD 3.32Å; V103-Y353 HydrophobicContact CG2-CD1 3.66Å; V103-Y353 HydrophobicContact CG2-CE1 3.89Å; V103-L356 HydrophobicContact CG1-CB 3.57Å; V103-T357 PolarHBondContact O-OG1 3Å; V103-I360 HydrophobicContact CG1-CD1 3.96Å
104	S	78.8	Confident	81.2	Confident	21 Å²	21	49.3 Å²	49.3	15%	0.147	26%	0.259	C	S	.	.			trans	-92.6	109	-174	-174.2	0	0	0	0	113.1	G107	S104-G107 PolarHBondContact OG-N 3.43Å; S104-G107 PolarHBondContact OG-O 2.97Å
105	P	71.7	Confident	81	Confident	21 Å²	21	49.5 Å²	49.5	14%	0.136	26%	0.26	C	S	.	.	S	Bend	trans	-71.7	-31.9	179	28.6	-34	0	0	0	112.4	V103 T357 L361 I898 R902	V103-P105 VanDerWaalsContact O-CD 3.24Å; V103-P105 WeakPolarHBondContact O-CD 3.32Å; P105-T357 HydrophobicContact CG-CG2 4.29Å; P105-L361 HydrophobicContact CG-CB 4.4Å; P105-L361 HydrophobicContact CG-CD1 4.41Å; P105-I898 HydrophobicContact CB-CG2 4.33Å; P105-R902 PolarHBondContact O-NE 2.88Å; P105-R902 PolarHBondContact O-NH2 2.95Å
106	T	71.2	Confident	80.9	Confident	4 Å²	4	53.7 Å²	53.7	3%	0.025	28%	0.282	C	S	.	.	S	Bend	trans	-85	-13.6	-179.3	57.9	0	0	0	0	113.6	Q98 T110 I898 I905	Q98-T106 PolarHBondContact NE2-OG1 2.77Å; T106-T110 WeakPolarHBondContact O-CG2 3.49Å; T106-T110 PolarHBondContact OG1-OG1 2.85Å; T106-I898 HydrophobicContact CG2-CG2 4.37Å; T106-I905 HydrophobicContact CG2-CD1 4.41Å
107	G	75.4	Confident	80.6	Confident	22 Å²	22	54.5 Å²	54.5	23%	0.227	28%	0.28	C	S	.	.			trans	107.4	171.6	179.5	0	0	0	0	0	114.3	S104 T110	S104-G107 PolarHBondContact OG-N 3.43Å; S104-G107 PolarHBondContact OG-O 2.97Å; G107-T110 PolarHBondContact O-OG1 2.9Å
108	R	82.9	Confident	80.2	Confident	119 Å²	119	54.4 Å²	54.4	45%	0.449	28%	0.28	S	S	.	.	S	Bend	trans	-81.9	-22.2	-169.6	-56.8	-168.4	-176.8	163.3	3.3	115	Q98 Q99	Q98-R108 WeakPolarHBondContact O-CA 3.12Å; Q98-R108 WeakPolarHBondContact O-CG 3.45Å; Q99-R108 PolarHBondContact NE2-O 3.48Å
109	Y	81.6	Confident	80.1	Confident	156 Å²	156	56 Å²	56	61%	0.612	29%	0.289	S	S	*	.	S	Bend	trans	-107.1	-4.1	-170.9	-60.9	-62	0	0	0	114.6	T111 L112 V113	Y109-T111 PolarHBondContact O-N 2.92Å; Y109-L112 HydrophobicContact CD1-CD2 4.41Å; Y109-L112 PolarHBondContact O-N 3.05Å; Y109-V113 PolarHBondContact O-N 3.03Å; Y109-V113 VanDerWaalsContact O-N 3.08Å
110	T	77.2	Confident	80	Confident	45 Å²	45	56.2 Å²	56.2	28%	0.276	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-36.1	-169.2	49.7	0	0	0	0	114.1	Q98 T106 G107 P114	Q98-T110 PolarHBondContact NE2-OG1 2.94Å; Q98-T110 PolarHBondContact OE1-OG1 2.95Å; T106-T110 WeakPolarHBondContact O-CG2 3.49Å; T106-T110 PolarHBondContact OG1-OG1 2.85Å; G107-T110 PolarHBondContact O-OG1 2.9Å; T110-P114 WeakPolarHBondContact O-CD 3.38Å; T110-P114 VanDerWaalsContact O-CG 3.3Å; T110-P114 WeakPolarHBondContact O-CG 3.33Å
111	T	80	Confident	79.8	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-36.1	171.9	-47.9	0	0	0	0	111.8	F91 I94 A95 Q98 Y109 L115 N363 I368	F91-T111 HydrophobicContact CB-CG2 4.36Å; I94-T111 HydrophobicContact CG2-CG2 4.27Å; A95-T111 HydrophobicContact CB-CG2 4.18Å; Q98-T111 PolarHBondContact NE2-OG1 2.99Å; Q98-T111 PolarHBondContact OE1-OG1 3.39Å; Y109-T111 PolarHBondContact O-N 2.92Å; T111-L115 WeakPolarHBondContact O-CB 3.43Å; T111-L115 PolarHBondContact O-N 3.41Å; T111-L115 VanDerWaalsContact O-N 3.1Å; T111-N363 PolarHBondContact OG1-ND2 2.65Å; T111-N363 VanDerWaalsContact OG1-ND2 3.07Å; T111-I368 HydrophobicContact CG2-CD1 4.08Å
112	L	83.8	Confident	79.7	Confident	49 Å²	49	52.5 Å²	52.5	26%	0.257	27%	0.274	S	S	.	.	H	α-helix	trans	-68.2	-44.1	-170.6	-177.1	60.2	0	0	0	113.1	A95 Y109 L115 I116	A95-L112 HydrophobicContact CB-CB 4.26Å; A95-L112 HydrophobicContact CB-CD1 4.25Å; Y109-L112 HydrophobicContact CD1-CD2 4.41Å; Y109-L112 PolarHBondContact O-N 3.05Å; L112-L115 PolarHBondContact O-N 2.88Å; L112-I116 HydrophobicContact CD1-CD1 3.93Å; L112-I116 HydrophobicContact CD1-CG1 4.18Å; L112-I116 HydrophobicContact CG-CD1 3.88Å; L112-I116 WeakPolarHBondContact O-CG1 3.06Å; L112-I116 PolarHBondContact O-N 2.88Å
113	V	82.6	Confident	80.2	Confident	89 Å²	89	46.1 Å²	46.1	54%	0.539	24%	0.241	S	C	.	.	H	α-helix	trans	-65.3	-47.3	-178.6	170.8	0	0	0	0	111.8	Y109 L115 I116 F117	Y109-V113 PolarHBondContact O-N 3.03Å; Y109-V113 VanDerWaalsContact O-N 3.08Å; V113-L115 PolarHBondContact O-N 3.1Å; V113-I116 PolarHBondContact O-N 3.36Å; V113-F117 PolarHBondContact O-N 3.06Å; V113-F117 VanDerWaalsContact O-N 3.09Å
114	P	76.3	Confident	80.5	Confident	37 Å²	37	50.3 Å²	50.3	24%	0.24	26%	0.263	C	S	.	.	H	α-helix	trans	-55.6	-46.6	169	-29.1	37.3	0	0	0	113.3	T110 I116 F117 I118 I368	T110-P114 WeakPolarHBondContact O-CD 3.38Å; T110-P114 VanDerWaalsContact O-CG 3.3Å; T110-P114 WeakPolarHBondContact O-CG 3.33Å; P114-I116 VanDerWaalsContact C-N 3.35Å; P114-I116 PolarHBondContact O-N 3.03Å; P114-F117 WeakPolarHBondContact O-CB 3.21Å; P114-F117 PolarHBondContact O-N 3.35Å; P114-F117 VanDerWaalsContact O-N 3.09Å; P114-I118 WeakPolarHBondContact O-CG1 3.45Å; P114-I118 PolarHBondContact O-N 2.96Å; P114-I368 HydrophobicContact CB-CG2 3.97Å
115	L	82.4	Confident	80.5	Confident	5 Å²	5	51.7 Å²	51.7	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-41.6	-178.5	-178.2	61.7	0	0	0	112.5	F91 L92 A95 T111 L112 V113 F117 I118 L119	F91-L115 HydrophobicContact CB-CD1 4.13Å; F91-L115 HydrophobicContact CB-CD2 4.38Å; L92-L115 HydrophobicContact CB-CD2 4.13Å; L92-L115 HydrophobicContact CD1-CD2 4.34Å; A95-L115 HydrophobicContact CB-CD2 4.36Å; T111-L115 WeakPolarHBondContact O-CB 3.43Å; T111-L115 PolarHBondContact O-N 3.41Å; T111-L115 VanDerWaalsContact O-N 3.1Å; L112-L115 PolarHBondContact O-N 2.88Å; V113-L115 PolarHBondContact O-N 3.1Å; L115-F117 VanDerWaalsContact C-N 3.34Å; L115-I118 PolarHBondContact O-N 2.84Å; L115-L119 HydrophobicContact CD1-CD1 4.29Å; L115-L119 HydrophobicContact CD1-CG 4.42Å; L115-L119 HydrophobicContact CG-CD1 4.18Å; L115-L119 WeakPolarHBondContact O-CG 3.48Å; L115-L119 PolarHBondContact O-N 3.12Å
116	I	85.8	Confident	80.8	Confident	91 Å²	91	52.2 Å²	52.2	47%	0.467	27%	0.267	S	S	.	.	H	α-helix	trans	-62.4	-41.9	174.2	-69.7	168.9	0	0	0	110.7	L112 V113 P114 L119 T120	L112-I116 HydrophobicContact CD1-CD1 3.93Å; L112-I116 HydrophobicContact CD1-CG1 4.18Å; L112-I116 HydrophobicContact CG-CD1 3.88Å; L112-I116 WeakPolarHBondContact O-CG1 3.06Å; L112-I116 PolarHBondContact O-N 2.88Å; V113-I116 PolarHBondContact O-N 3.36Å; P114-I116 VanDerWaalsContact C-N 3.35Å; P114-I116 PolarHBondContact O-N 3.03Å; I116-L119 PolarHBondContact O-N 2.88Å; I116-T120 VanDerWaalsContact O-CB 3.31Å; I116-T120 WeakPolarHBondContact O-CB 3.3Å; I116-T120 PolarHBondContact O-N 2.68Å; I116-T120 PolarHBondContact O-OG1 3.14Å
117	F	82.4	Confident	81.4	Confident	128 Å²	128	56.2 Å²	56.2	56%	0.561	29%	0.287	S	S	*	.	H	α-helix	trans	-62.2	-45.4	175.9	179.3	-98.1	0	0	0	112.2	V113 P114 L115 L119 T120 V121	V113-F117 PolarHBondContact O-N 3.06Å; V113-F117 VanDerWaalsContact O-N 3.09Å; P114-F117 WeakPolarHBondContact O-CB 3.21Å; P114-F117 PolarHBondContact O-N 3.35Å; P114-F117 VanDerWaalsContact O-N 3.09Å; L115-F117 VanDerWaalsContact C-N 3.34Å; F117-L119 PolarHBondContact O-N 2.85Å; F117-T120 PolarHBondContact O-N 2.75Å; F117-V121 HydrophobicContact CD1-CG2 4.37Å; F117-V121 HydrophobicContact CD2-CG2 4.46Å; F117-V121 HydrophobicContact CE1-CG2 3.97Å; F117-V121 HydrophobicContact CE2-CG2 4.06Å; F117-V121 HydrophobicContact CZ-CG2 3.81Å; F117-V121 WeakPolarHBondContact O-CG2 3.48Å; F117-V121 PolarHBondContact O-N 2.98Å
118	I	78.6	Confident	81.7	Confident	11 Å²	11	59.5 Å²	59.5	6%	0.056	30%	0.298	C	S	.	.	H	α-helix	trans	-55.3	-54	174.7	-64.2	-174.6	0	0	0	110.7	P114 L115 T120 V121 A122 I368 V372	P114-I118 WeakPolarHBondContact O-CG1 3.45Å; P114-I118 PolarHBondContact O-N 2.96Å; L115-I118 PolarHBondContact O-N 2.84Å; I118-T120 VanDerWaalsContact C-N 3.26Å; I118-T120 PolarHBondContact O-N 2.75Å; I118-V121 PolarHBondContact O-N 2.89Å; I118-A122 WeakPolarHBondContact O-CB 3.38Å; I118-A122 PolarHBondContact O-N 3.39Å; I118-I368 HydrophobicContact CD1-CG2 3.63Å; I118-I368 WeakPolarHBondContact CD1-O 3.4Å; I118-V372 HydrophobicContact CB-CG2 3.99Å; I118-V372 HydrophobicContact CD1-CG2 4.28Å; I118-V372 HydrophobicContact CG1-CG2 3.6Å; I118-V372 HydrophobicContact CG2-CG2 3.87Å
119	L	84	Confident	81.1	Confident	35 Å²	35	57 Å²	57	18%	0.183	29%	0.292	C	S	.	.	H	α-helix	trans	-64.6	-31.5	-177.9	-67.6	172.2	0	0	0	112.2	F78 Q82 L115 I116 F117 G123	F78-L119 WeakPolarHBondContact CZ-O 3.34Å; Q82-L119 HydrophobicContact CB-CD2 3.77Å; Q82-L119 HydrophobicContact CG-CD2 4.03Å; L115-L119 HydrophobicContact CD1-CD1 4.29Å; L115-L119 HydrophobicContact CD1-CG 4.42Å; L115-L119 HydrophobicContact CG-CD1 4.18Å; L115-L119 WeakPolarHBondContact O-CG 3.48Å; L115-L119 PolarHBondContact O-N 3.12Å; I116-L119 PolarHBondContact O-N 2.88Å; F117-L119 PolarHBondContact O-N 2.85Å; L119-G123 PolarHBondContact O-N 2.83Å
120	T	87.3	Confident	81	Confident	72 Å²	72	49.8 Å²	49.8	44%	0.442	26%	0.264	S	S	.	.	H	α-helix	trans	-69.9	-46.4	175.9	-57.4	0	0	0	0	111.6	I116 F117 I118 G123 I124	I116-T120 VanDerWaalsContact O-CB 3.31Å; I116-T120 WeakPolarHBondContact O-CB 3.3Å; I116-T120 PolarHBondContact O-N 2.68Å; I116-T120 PolarHBondContact O-OG1 3.14Å; F117-T120 PolarHBondContact O-N 2.75Å; I118-T120 VanDerWaalsContact C-N 3.26Å; I118-T120 PolarHBondContact O-N 2.75Å; T120-G123 PolarHBondContact O-N 3.4Å; T120-I124 HydrophobicContact CG2-CD1 3.98Å; T120-I124 VanDerWaalsContact O-CG1 3.32Å; T120-I124 WeakPolarHBondContact O-CG1 3.44Å; T120-I124 PolarHBondContact O-N 2.82Å
121	V	80.8	Confident	81.2	Confident	49 Å²	49	55.2 Å²	55.2	30%	0.297	28%	0.281	S	S	.	.	H	α-helix	trans	-63.2	-46.1	177.9	172	0	0	0	0	111.1	F117 I118 G123 I124 K125	F117-V121 HydrophobicContact CD1-CG2 4.37Å; F117-V121 HydrophobicContact CD2-CG2 4.46Å; F117-V121 HydrophobicContact CE1-CG2 3.97Å; F117-V121 HydrophobicContact CE2-CG2 4.06Å; F117-V121 HydrophobicContact CZ-CG2 3.81Å; F117-V121 WeakPolarHBondContact O-CG2 3.48Å; F117-V121 PolarHBondContact O-N 2.98Å; I118-V121 PolarHBondContact O-N 2.89Å; V121-G123 VanDerWaalsContact C-N 3.3Å; V121-G123 PolarHBondContact O-N 3.09Å; V121-I124 PolarHBondContact O-N 2.84Å; V121-K125 PolarHBondContact O-N 2.85Å; V121-K125 VanDerWaalsContact O-N 3.11Å
122	A	76.9	Confident	81	Confident	6 Å²	6	62 Å²	62	5%	0.05	31%	0.31	C	S	.	.	H	α-helix	trans	-63.4	-35.7	175.3	0	0	0	0	0	112.4	F78 I118 K125 E126	F78-A122 HydrophobicContact CE2-CB 4.28Å; F78-A122 HydrophobicContact CZ-CB 4.01Å; I118-A122 WeakPolarHBondContact O-CB 3.38Å; I118-A122 PolarHBondContact O-N 3.39Å; A122-K125 PolarHBondContact O-N 2.86Å; A122-E126 PolarHBondContact O-N 3.28Å; A122-E126 VanDerWaalsContact O-N 3.13Å
123	G	85.4	Confident	80.4	Confident	6 Å²	6	64 Å²	64	6%	0.062	31%	0.314	C	S	.	.	H	α-helix	trans	-66.5	-44.4	176.1	0	0	0	0	0	112.6	F78 L119 T120 V121 K125 E126 I127	F78-G123 VanDerWaalsContact CZ-CA 3.4Å; F78-G123 VanDerWaalsContact CZ-N 3.26Å; L119-G123 PolarHBondContact O-N 2.83Å; T120-G123 PolarHBondContact O-N 3.4Å; V121-G123 VanDerWaalsContact C-N 3.3Å; V121-G123 PolarHBondContact O-N 3.09Å; G123-K125 VanDerWaalsContact C-N 3.3Å; G123-K125 PolarHBondContact O-N 2.95Å; G123-E126 PolarHBondContact O-N 2.73Å; G123-I127 WeakPolarHBondContact O-CB 3.14Å; G123-I127 WeakPolarHBondContact O-CD1 3.27Å; G123-I127 VanDerWaalsContact O-CG1 3.23Å; G123-I127 WeakPolarHBondContact O-CG1 3.23Å; G123-I127 PolarHBondContact O-N 1.85Å
124	I	85.8	Confident	80.3	Confident	91 Å²	91	62.9 Å²	62.9	47%	0.467	30%	0.303	S	S	.	.	H	α-helix	trans	-59.9	-40.9	175.2	-69.8	165.1	0	0	0	110.8	T120 V121 I127 I128	T120-I124 HydrophobicContact CG2-CD1 3.98Å; T120-I124 VanDerWaalsContact O-CG1 3.32Å; T120-I124 WeakPolarHBondContact O-CG1 3.44Å; T120-I124 PolarHBondContact O-N 2.82Å; V121-I124 PolarHBondContact O-N 2.84Å; I124-I127 PolarHBondContact O-N 2.79Å; I124-I128 HydrophobicContact CG2-CD1 3.81Å; I124-I128 VanDerWaalsContact O-CG1 3.3Å; I124-I128 WeakPolarHBondContact O-CG1 3.41Å; I124-I128 PolarHBondContact O-N 3.46Å
125	K	77.8	Confident	80.6	Confident	49 Å²	49	67.7 Å²	67.7	21%	0.213	32%	0.32	C	S	.	.	H	α-helix	trans	-59.3	-54.8	174.9	-179.7	179.3	175	176.5	0	112	V121 A122 G123 I127 I128 E129 S405 N406	V121-K125 PolarHBondContact O-N 2.85Å; V121-K125 VanDerWaalsContact O-N 3.11Å; A122-K125 PolarHBondContact O-N 2.86Å; G123-K125 VanDerWaalsContact C-N 3.3Å; G123-K125 PolarHBondContact O-N 2.95Å; K125-I127 VanDerWaalsContact C-N 3.28Å; K125-I127 PolarHBondContact O-N 3.48Å; K125-I128 PolarHBondContact O-N 2.95Å; K125-I128 VanDerWaalsContact O-N 3.15Å; K125-E129 WeakPolarHBondContact CE-OE1 3.38Å; K125-E129 WeakPolarHBondContact CG-OE1 3.5Å; K125-E129 IonicContact NZ-OE1 3.4Å; K125-E129 PolarHBondContact O-N 2.94Å; K125-S405 PolarHBondContact NZ-OG 2.81Å; K125-N406 PolarHBondContact NZ-OD1 2.89Å
126	E	78.4	Confident	80.2	Confident	33 Å²	33	70 Å²	70	15%	0.154	34%	0.339	C	S	.	.	H	α-helix	trans	-61.8	-34.6	-179.9	-69.4	-95.8	172	0	0	111.9	K68 Y69 F74 F78 A122 G123 E129 D130	K68-E126 IonicContact NZ-OE1 2.73Å; K68-E126 PolarHBondContact NZ-OE1 2.67Å; K68-E126 IonicContact NZ-OE2 3.61Å; K68-E126 PolarHBondContact NZ-OE2 3.18Å; Y69-E126 HydrophobicContact CE2-CB 4.32Å; Y69-E126 WeakPolarHBondContact CE2-OE2 3.4Å; Y69-E126 PolarHBondContact OH-OE2 2.99Å; F74-E126 HydrophobicContact CE2-CB 4.1Å; F78-E126 HydrophobicContact CD2-CB 4.38Å; F78-E126 HydrophobicContact CD2-CG 4.12Å; F78-E126 HydrophobicContact CE2-CG 4.08Å; A122-E126 PolarHBondContact O-N 3.28Å; A122-E126 VanDerWaalsContact O-N 3.13Å; G123-E126 PolarHBondContact O-N 2.73Å; E126-E129 PolarHBondContact O-N 3.47Å; E126-D130 PolarHBondContact O-N 3Å
127	I	84.9	Confident	79.9	Confident	87 Å²	87	66.2 Å²	66.2	45%	0.446	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-45.4	173.7	-70.8	164.6	0	0	0	111.4	F74 G123 I124 K125 E129 Y131	F74-I127 HydrophobicContact CD1-CG1 4.49Å; F74-I127 HydrophobicContact CD2-CG1 4.4Å; F74-I127 HydrophobicContact CE1-CD1 3.82Å; F74-I127 HydrophobicContact CE1-CG1 3.89Å; F74-I127 HydrophobicContact CE2-CG1 3.79Å; F74-I127 HydrophobicContact CZ-CD1 3.85Å; F74-I127 HydrophobicContact CZ-CG1 3.51Å; G123-I127 WeakPolarHBondContact O-CB 3.14Å; G123-I127 WeakPolarHBondContact O-CD1 3.27Å; G123-I127 VanDerWaalsContact O-CG1 3.23Å; G123-I127 WeakPolarHBondContact O-CG1 3.23Å; G123-I127 PolarHBondContact O-N 1.85Å; I124-I127 PolarHBondContact O-N 2.79Å; K125-I127 VanDerWaalsContact C-N 3.28Å; K125-I127 PolarHBondContact O-N 3.48Å; I127-E129 VanDerWaalsContact C-N 3.33Å; I127-E129 PolarHBondContact O-N 2.75Å; I127-Y131 WeakPolarHBondContact O-CB 3.37Å; I127-Y131 PolarHBondContact O-N 3.25Å
128	I	81.3	Confident	80.1	Confident	91 Å²	91	63.7 Å²	63.7	47%	0.467	31%	0.312	S	S	.	.	H	α-helix	trans	-64.9	-38.5	178.9	-69.3	165.1	0	0	0	110.9	I124 K125 K132	I124-I128 HydrophobicContact CG2-CD1 3.81Å; I124-I128 VanDerWaalsContact O-CG1 3.3Å; I124-I128 WeakPolarHBondContact O-CG1 3.41Å; I124-I128 PolarHBondContact O-N 3.46Å; K125-I128 PolarHBondContact O-N 2.95Å; K125-I128 VanDerWaalsContact O-N 3.15Å; I128-K132 WeakPolarHBondContact O-CG 3.19Å; I128-K132 PolarHBondContact O-N 3.04Å
129	E	70.4	Confident	80.4	Confident	66 Å²	66	67.5 Å²	67.5	31%	0.308	34%	0.336	S	S	.	.	H	α-helix	trans	-69.8	-47.6	178	-72.3	178.3	-158.7	0	0	112.5	K125 E126 I127 K132 R133	K125-E129 WeakPolarHBondContact CE-OE1 3.38Å; K125-E129 WeakPolarHBondContact CG-OE1 3.5Å; K125-E129 IonicContact NZ-OE1 3.4Å; K125-E129 PolarHBondContact O-N 2.94Å; E126-E129 PolarHBondContact O-N 3.47Å; I127-E129 VanDerWaalsContact C-N 3.33Å; I127-E129 PolarHBondContact O-N 2.75Å; E129-K132 WeakPolarHBondContact O-CB 3.5Å; E129-K132 PolarHBondContact O-N 3.44Å; E129-R133 PolarHBondContact O-N 2.96Å
130	D	78.3	Confident	80.4	Confident	6 Å²	6	68.2 Å²	68.2	3%	0.032	34%	0.342	C	S	.	.	H	α-helix	trans	-72.3	-29.8	179.5	-141.5	49.3	0	0	0	111.7	K68 Y69 E126 K132 R133 H134	K68-D130 WeakPolarHBondContact CB-OD1 3.42Å; K68-D130 PolarHBondContact N-OD1 3.4Å; K68-D130 PolarHBondContact N-OD2 3.01Å; Y69-D130 HydrophobicContact CD2-CB 4.17Å; Y69-D130 PolarHBondContact N-OD2 2.83Å; E126-D130 PolarHBondContact O-N 3Å; D130-K132 VanDerWaalsContact C-N 3.29Å; D130-K132 PolarHBondContact O-N 3.2Å; D130-R133 WeakPolarHBondContact O-CA 3.5Å; D130-R133 WeakPolarHBondContact O-CB 3.33Å; D130-R133 PolarHBondContact O-N 2.95Å; D130-R133 WeakPolarHBondContact OD1-CD 3.11Å; D130-R133 IonicContact OD1-CZ 3.62Å; D130-R133 IonicContact OD1-NH1 2.71Å; D130-R133 PolarHBondContact OD1-NH1 2.77Å; D130-H134 PolarHBondContact O-CD2 2.78Å; D130-H134 PolarHBondContact O-N 2.87Å; D130-H134 IonicContact OD2-CD2 3.78Å; D130-H134 IonicContact OD2-NE2 3.7Å
131	Y	82.7	Confident	80.4	Confident	159 Å²	159	65.1 Å²	65.1	62%	0.624	32%	0.323	S	S	*	.	H	α-helix	trans	-59.9	-36.9	170.7	179.8	-96.1	0	0	0	112.5	I127 R133 H134 K135	I127-Y131 WeakPolarHBondContact O-CB 3.37Å; I127-Y131 PolarHBondContact O-N 3.25Å; Y131-R133 VanDerWaalsContact C-N 3.34Å; Y131-H134 PolarHBondContact O-N 2.89Å; Y131-K135 PolarHBondContact O-N 2.97Å
132	K	75.3	Confident	80.9	Confident	143 Å²	143	69.1 Å²	69.1	62%	0.622	34%	0.336	S	S	*	.	H	α-helix	trans	-62.8	-39.9	172.5	-71.4	172.3	179	-179.2	0	111.4	I128 E129 D130 K135 A136	I128-K132 WeakPolarHBondContact O-CG 3.19Å; I128-K132 PolarHBondContact O-N 3.04Å; E129-K132 WeakPolarHBondContact O-CB 3.5Å; E129-K132 PolarHBondContact O-N 3.44Å; D130-K132 VanDerWaalsContact C-N 3.29Å; D130-K132 PolarHBondContact O-N 3.2Å; K132-K135 PolarHBondContact O-N 3.04Å; K132-A136 PolarHBondContact O-N 2.87Å
133	R	71.6	Confident	81.5	Confident	91 Å²	91	72.6 Å²	72.6	34%	0.343	35%	0.35	S	S	.	.	H	α-helix	trans	-64	-47.8	173	-59.9	-170.8	-173	109.1	4.2	111.6	T67 E129 D130 Y131 K135 A136 D137	T67-R133 HydrophobicContact CG2-CB 3.67Å; E129-R133 PolarHBondContact O-N 2.96Å; D130-R133 WeakPolarHBondContact O-CA 3.5Å; D130-R133 WeakPolarHBondContact O-CB 3.33Å; D130-R133 PolarHBondContact O-N 2.95Å; D130-R133 WeakPolarHBondContact OD1-CD 3.11Å; D130-R133 IonicContact OD1-CZ 3.62Å; D130-R133 IonicContact OD1-NH1 2.71Å; D130-R133 PolarHBondContact OD1-NH1 2.77Å; Y131-R133 VanDerWaalsContact C-N 3.34Å; R133-K135 PolarHBondContact O-N 3.44Å; R133-A136 PolarHBondContact O-N 3.29Å; R133-D137 PolarHBondContact O-N 2.75Å
134	H	80.2	Confident	81.8	Confident	64 Å²	64	79.6 Å²	79.6	30%	0.296	38%	0.379	S	S	.	.	H	α-helix	trans	-55.1	-38.7	174.8	-81.9	-74.4	0	0	0	111.8	T67 Y69 D130 Y131 N138	T67-H134 WeakPolarHBondContact CB-NE2 3.2Å; T67-H134 HydrophobicContact CG2-CB 4.14Å; T67-H134 WeakPolarHBondContact CG2-CD2 3.4Å; T67-H134 VanDerWaalsContact CG2-CE1 3.44Å; T67-H134 WeakPolarHBondContact CG2-CE1 3.34Å; T67-H134 VanDerWaalsContact CG2-CG 3.45Å; T67-H134 VanDerWaalsContact CG2-NE2 3.34Å; T67-H134 WeakPolarHBondContact CG2-NE2 3.42Å; Y69-H134 PolarHBondContact O-NE2 3.4Å; Y69-H134 VanDerWaalsContact O-NE2 3.17Å; D130-H134 PolarHBondContact O-CD2 2.78Å; D130-H134 PolarHBondContact O-N 2.87Å; D130-H134 IonicContact OD2-CD2 3.78Å; D130-H134 IonicContact OD2-NE2 3.7Å; Y131-H134 PolarHBondContact O-N 2.89Å; H134-N138 VanDerWaalsContact O-CB 3.26Å; H134-N138 WeakPolarHBondContact O-CB 3.28Å; H134-N138 PolarHBondContact O-N 2.76Å; H134-N138 PolarHBondContact O-ND2 3.3Å
135	K	82.6	Confident	82.1	Confident	139 Å²	139	75.3 Å²	75.3	60%	0.604	36%	0.357	S	S	*	.	H	α-helix	trans	-68	-41.3	174.9	-172.5	179.6	177.1	-175.1	0	112.6	Y131 K132 R133 T139	Y131-K135 PolarHBondContact O-N 2.97Å; K132-K135 PolarHBondContact O-N 3.04Å; R133-K135 PolarHBondContact O-N 3.44Å; K135-T139 PolarHBondContact O-N 3.24Å; K135-T139 VanDerWaalsContact O-N 3.13Å; K135-T139 PolarHBondContact O-OG1 3.34Å
136	A	73.3	Confident	83	Confident	52 Å²	52	74.5 Å²	74.5	43%	0.43	36%	0.357	S	S	.	.	H	α-helix	trans	-65.3	-50.8	176.7	0	0	0	0	0	111.7	K132 R133 N138 T139 V140	K132-A136 PolarHBondContact O-N 2.87Å; R133-A136 PolarHBondContact O-N 3.29Å; A136-N138 VanDerWaalsContact C-N 3.32Å; A136-N138 PolarHBondContact O-N 2.73Å; A136-T139 WeakPolarHBondContact O-CA 3.46Å; A136-T139 WeakPolarHBondContact O-CB 3.15Å; A136-T139 PolarHBondContact O-N 2.84Å; A136-V140 PolarHBondContact O-N 2.76Å; A136-V140 VanDerWaalsContact O-N 3.08Å
137	D	80.7	Confident	83.7	Confident	12 Å²	12	73 Å²	73	6%	0.064	35%	0.349	C	S	.	.	H	α-helix	trans	-55.3	-46.7	175.7	-72.1	-12.4	0	0	0	111.1	S65 T66 T67 R133 T139 V140 N141	S65-D137 WeakPolarHBondContact CA-OD2 3.33Å; T66-D137 WeakPolarHBondContact CB-OD1 3.09Å; T66-D137 WeakPolarHBondContact CG2-OD1 3.36Å; T66-D137 PolarHBondContact N-OD1 3.01Å; T66-D137 PolarHBondContact N-OD2 2.88Å; T66-D137 PolarHBondContact OG1-OD1 2.85Å; T66-D137 PolarHBondContact OG1-OD2 3.18Å; T67-D137 WeakPolarHBondContact CG2-OD2 3.46Å; R133-D137 PolarHBondContact O-N 2.75Å; D137-T139 PolarHBondContact O-N 2.83Å; D137-V140 PolarHBondContact O-N 2.93Å; D137-N141 WeakPolarHBondContact O-CB 3.45Å; D137-N141 VanDerWaalsContact O-CG 3.31Å; D137-N141 PolarHBondContact O-N 2.9Å; D137-N141 PolarHBondContact O-ND2 3.47Å
138	N	86.4	Confident	83.9	Confident	75 Å²	75	69.3 Å²	69.3	40%	0.401	33%	0.331	S	S	.	.	H	α-helix	trans	-61.7	-28.1	175.9	-91.8	-81.7	0	0	0	113.3	H134 A136 K142	H134-N138 VanDerWaalsContact O-CB 3.26Å; H134-N138 WeakPolarHBondContact O-CB 3.28Å; H134-N138 PolarHBondContact O-N 2.76Å; H134-N138 PolarHBondContact O-ND2 3.3Å; A136-N138 VanDerWaalsContact C-N 3.32Å; A136-N138 PolarHBondContact O-N 2.73Å; N138-K142 VanDerWaalsContact O-CB 3.29Å; N138-K142 WeakPolarHBondContact O-CB 3.48Å; N138-K142 VanDerWaalsContact O-CD 3.31Å; N138-K142 WeakPolarHBondContact O-CD 3.33Å; N138-K142 WeakPolarHBondContact O-CG 3.26Å; N138-K142 PolarHBondContact O-N 3.48Å
139	T	85.3	Confident	84.2	Confident	91 Å²	91	68.5 Å²	68.5	56%	0.558	32%	0.322	S	S	*	.	H	α-helix	trans	-75.5	-42.3	178.1	-55.8	0	0	0	0	110.5	K135 A136 D137 K143	K135-T139 PolarHBondContact O-N 3.24Å; K135-T139 VanDerWaalsContact O-N 3.13Å; K135-T139 PolarHBondContact O-OG1 3.34Å; A136-T139 WeakPolarHBondContact O-CA 3.46Å; A136-T139 WeakPolarHBondContact O-CB 3.15Å; A136-T139 PolarHBondContact O-N 2.84Å; D137-T139 PolarHBondContact O-N 2.83Å; T139-K143 PolarHBondContact O-N 3.28Å
140	V	82.7	Confident	84.7	Confident	50 Å²	50	71.4 Å²	71.4	30%	0.303	35%	0.349	S	S	.	.	H	α-helix	trans	-65.3	-49	174.4	179.3	0	0	0	0	111.2	A136 D137 K142 K143 W158	A136-V140 PolarHBondContact O-N 2.76Å; A136-V140 VanDerWaalsContact O-N 3.08Å; D137-V140 PolarHBondContact O-N 2.93Å; V140-K142 PolarHBondContact O-N 2.92Å; V140-K142 VanDerWaalsContact O-N 3.14Å; V140-K143 WeakPolarHBondContact O-CB 3.25Å; V140-K143 PolarHBondContact O-N 2.9Å; V140-K143 VanDerWaalsContact O-N 3.08Å; V140-W158 HydrophobicContact CG1-CE3 4.01Å; V140-W158 HydrophobicContact CG1-CZ3 4.07Å
141	N	88.6	Confident	84.8	Confident	8 Å²	8	72.5 Å²	72.5	4%	0.043	36%	0.362	C	S	.	.	H	α-helix	trans	-64.3	-19.1	-177.8	-72.6	-47.2	0	0	0	113.9	H63 V64 D137 K159	H63-N141 WeakPolarHBondContact CA-OD1 3.45Å; H63-N141 PolarHBondContact CD2-ND2 2.9Å; V64-N141 PolarHBondContact N-OD1 2.93Å; V64-N141 PolarHBondContact O-ND2 2.86Å; D137-N141 WeakPolarHBondContact O-CB 3.45Å; D137-N141 VanDerWaalsContact O-CG 3.31Å; D137-N141 PolarHBondContact O-N 2.9Å; D137-N141 PolarHBondContact O-ND2 3.47Å; N141-K159 HydrophobicContact CB-CB 4.46Å; N141-K159 PolarHBondContact O-N 3.34Å
142	K	91	Very high	85	Confident	133 Å²	133	67.1 Å²	67.1	58%	0.578	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-0.5	176.7	-69.1	175.1	-172.3	178.2	0	114.3	N138 V140	N138-K142 VanDerWaalsContact O-CB 3.29Å; N138-K142 WeakPolarHBondContact O-CB 3.48Å; N138-K142 VanDerWaalsContact O-CD 3.31Å; N138-K142 WeakPolarHBondContact O-CD 3.33Å; N138-K142 WeakPolarHBondContact O-CG 3.26Å; N138-K142 PolarHBondContact O-N 3.48Å; V140-K142 PolarHBondContact O-N 2.92Å; V140-K142 VanDerWaalsContact O-N 3.14Å
143	K	88.4	Confident	85.8	Confident	79 Å²	79	64.5 Å²	64.5	34%	0.343	34%	0.336	S	S	.	.			trans	-54.9	149	167.4	-74.5	-174.6	173.2	-173.3	0	109.4	T139 V140 I157 W158	T139-K143 PolarHBondContact O-N 3.28Å; V140-K143 WeakPolarHBondContact O-CB 3.25Å; V140-K143 PolarHBondContact O-N 2.9Å; V140-K143 VanDerWaalsContact O-N 3.08Å; K143-I157 CarbonylContact O-C 3.56Å; K143-I157 VanDerWaalsContact O-CA 3.31Å; K143-I157 WeakPolarHBondContact O-CA 3.36Å; K143-W158 VanDerWaalsContact C-CD1 3.42Å; K143-W158 HydrophobicContact CB-CD2 3.64Å; K143-W158 HydrophobicContact CB-CE3 4.33Å; K143-W158 HydrophobicContact CB-CG 3.74Å; K143-W158 HydrophobicContact CB-CZ2 4.2Å; K143-W158 HydrophobicContact CD-CD2 4.22Å; K143-W158 HydrophobicContact CD-CE3 4.24Å; K143-W158 HydrophobicContact CD-CH2 3.77Å; K143-W158 HydrophobicContact CD-CZ2 3.69Å; K143-W158 HydrophobicContact CD-CZ3 4.03Å; K143-W158 PolarHBondContact O-N 3.06Å
144	K	92.6	Very high	86.8	Confident	152 Å²	152	63.8 Å²	63.8	66%	0.661	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	156.7	179.8	-67.3	-179.3	179.9	-179.4	0	111.3	T155 I156 W158	K144-T155 HydrophobicContact CB-CG2 4Å; K144-T155 HydrophobicContact CD-CG2 4.04Å; K144-T155 HydrophobicContact CG-CG2 4.39Å; K144-I156 CarbonylContact C-O 3.55Å; K144-I156 VanDerWaalsContact CA-O 3.28Å; K144-I156 WeakPolarHBondContact CA-O 3.4Å; K144-W158 PolarHBondContact O-NE1 2.92Å
145	T	92.9	Very high	87.4	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.012	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	163.1	170.7	-168.6	0	0	0	0	109.6	V147 T155 I156 V161 V167 P176	T145-V147 HydrophobicContact CG2-CG1 4.44Å; T145-T155 CarbonylContact O-C 3.58Å; T145-T155 WeakPolarHBondContact O-CA 3.39Å; T145-I156 HydrophobicContact CG2-CG1 4.24Å; T145-I156 PolarHBondContact N-O 3.23Å; T145-I156 PolarHBondContact O-N 3.4Å; T145-V161 HydrophobicContact CG2-CG2 3.66Å; T145-V167 WeakPolarHBondContact OG1-CG1 3.31Å; T145-P176 HydrophobicContact CG2-CB 4.18Å; T145-P176 HydrophobicContact CG2-CG 4.17Å
146	T	94.6	Very high	88	Confident	32 Å²	32	59.4 Å²	59.4	20%	0.196	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.8	-174	-47.4	0	0	0	0	109.9	W153 V167 K168	T146-W153 HydrophobicContact CG2-CB 3.89Å; T146-W153 HydrophobicContact CG2-CD2 4.43Å; T146-W153 HydrophobicContact CG2-CE3 4.01Å; T146-W153 HydrophobicContact CG2-CG 4.44Å; T146-V167 CarbonylContact O-C 3.56Å; T146-V167 WeakPolarHBondContact O-CA 3.37Å; T146-V167 WeakPolarHBondContact O-CG1 3.23Å; T146-K168 PolarHBondContact O-N 3.38Å
147	V	93.4	Very high	89	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	147.2	-179.5	-58.7	0	0	0	0	111.9	T145 R149 W153 Q154 I156 I166 V167	T145-V147 HydrophobicContact CG2-CG1 4.44Å; V147-R149 HydrophobicContact CG2-CG 3.84Å; V147-R149 PolarHBondContact O-N 3.44Å; V147-W153 CarbonylContact O-C 3.52Å; V147-W153 WeakPolarHBondContact O-CA 3.29Å; V147-Q154 HydrophobicContact CG2-CB 4.46Å; V147-Q154 PolarHBondContact N-O 2.85Å; V147-Q154 PolarHBondContact O-N 3.02Å; V147-I156 HydrophobicContact CB-CD1 4.36Å; V147-I156 HydrophobicContact CG1-CD1 3.65Å; V147-I156 HydrophobicContact CG1-CG1 3.89Å; V147-I156 HydrophobicContact CG2-CD1 3.73Å; V147-I156 HydrophobicContact CG2-CG1 3.89Å; V147-I156 HydrophobicContact CG2-CG2 4Å; V147-I166 CarbonylContact C-O 3.57Å; V147-I166 VanDerWaalsContact CA-O 3.3Å; V147-I166 WeakPolarHBondContact CA-O 3.14Å; V147-V167 HydrophobicContact CG1-CG2 4.12Å
148	L	90.1	Very high	89.6	Confident	11 Å²	11	59.6 Å²	59.6	6%	0.058	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	109.5	170.4	176.6	55.3	0	0	0	108.7	W153 I166 L219 L222 M223	L148-W153 HydrophobicContact CB-CE3 3.96Å; L148-W153 HydrophobicContact CB-CH2 4.07Å; L148-W153 HydrophobicContact CB-CZ3 3.67Å; L148-I166 HydrophobicContact CB-CB 4.14Å; L148-I166 HydrophobicContact CB-CG2 4.19Å; L148-I166 HydrophobicContact CD2-CD1 4.45Å; L148-I166 HydrophobicContact CD2-CG2 4.4Å; L148-I166 PolarHBondContact N-O 3.14Å; L148-L219 HydrophobicContact CD1-CD1 3.46Å; L148-L219 VanDerWaalsContact CD1-CD1 3.46Å; L148-L219 HydrophobicContact CD2-CD1 4.44Å; L148-L222 HydrophobicContact CD2-CB 3.74Å; L148-M223 HydrophobicContact CD1-SD 4.06Å; L148-M223 HydrophobicContact CD2-CG 4.28Å; L148-M223 HydrophobicContact CD2-SD 4.14Å; L148-M223 HydrophobicContact CG-SD 4.16Å
149	R	87.5	Confident	90	Very high	74 Å²	74	60.2 Å²	60.2	28%	0.279	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	137.6	176.2	-73.8	-177.1	178.8	172.1	0.4	110.3	V147 G151 A152 Q154 Q160 D165	V147-R149 HydrophobicContact CG2-CG 3.84Å; V147-R149 PolarHBondContact O-N 3.44Å; R149-G151 PolarHBondContact O-N 3.44Å; R149-A152 PolarHBondContact N-O 2.71Å; R149-A152 PolarHBondContact O-N 2.82Å; R149-A152 VanDerWaalsContact O-N 3.1Å; R149-Q154 PolarHBondContact O-NE2 2.72Å; R149-Q160 PolarHBondContact NH2-O 3.36Å; R149-D165 IonicContact CZ-OD1 3.31Å; R149-D165 VanDerWaalsContact CZ-OD1 3.31Å; R149-D165 IonicContact CZ-OD2 3.64Å; R149-D165 IonicContact NE-OD1 2.88Å; R149-D165 PolarHBondContact NE-OD1 3.38Å; R149-D165 IonicContact NE-OD2 2.8Å; R149-D165 IonicContact NH2-OD1 2.79Å; R149-D165 PolarHBondContact NH2-OD1 3.44Å; R149-D165 IonicContact NH2-OD2 2.89Å; R149-D165 PolarHBondContact NH2-OD2 2.99Å
150	S	80.4	Confident	90.3	Very high	126 Å²	126	61 Å²	61	88%	0.881	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	34	178.5	-53.7	0	0	0	0	114.6
151	G	80.9	Confident	90.8	Very high	29 Å²	29	58.8 Å²	58.8	30%	0.299	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	12.7	-179.4	0	0	0	0	0	115.4	R149	R149-G151 PolarHBondContact O-N 3.44Å
152	A	87.4	Confident	91.1	Very high	46 Å²	46	60.6 Å²	60.6	38%	0.38	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	153.4	177.4	0	0	0	0	0	112.4	R149 Q154	R149-A152 PolarHBondContact N-O 2.71Å; R149-A152 PolarHBondContact O-N 2.82Å; R149-A152 VanDerWaalsContact O-N 3.1Å; A152-Q154 PolarHBondContact O-N 2.79Å
153	W	90.4	Very high	91.2	Very high	88 Å²	88	54.6 Å²	54.6	33%	0.333	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	119.4	167.8	-68.4	114.4	0	0	0	110.1	T146 V147 L148 I166 K168 L222 V274	T146-W153 HydrophobicContact CG2-CB 3.89Å; T146-W153 HydrophobicContact CG2-CD2 4.43Å; T146-W153 HydrophobicContact CG2-CE3 4.01Å; T146-W153 HydrophobicContact CG2-CG 4.44Å; V147-W153 CarbonylContact O-C 3.52Å; V147-W153 WeakPolarHBondContact O-CA 3.29Å; L148-W153 HydrophobicContact CB-CE3 3.96Å; L148-W153 HydrophobicContact CB-CH2 4.07Å; L148-W153 HydrophobicContact CB-CZ3 3.67Å; W153-I166 HydrophobicContact CH2-CG2 4.34Å; W153-K168 HydrophobicContact CE3-CB 4.04Å; W153-K168 HydrophobicContact CH2-CB 3.7Å; W153-K168 HydrophobicContact CZ2-CB 4.29Å; W153-K168 HydrophobicContact CZ2-CD 4.37Å; W153-K168 HydrophobicContact CZ3-CB 3.55Å; W153-L222 HydrophobicContact CH2-CD1 4.09Å; W153-L222 HydrophobicContact CZ2-CD1 3.82Å; W153-V274 HydrophobicContact CH2-CG1 4.39Å; W153-V274 HydrophobicContact CH2-CG2 4.2Å
154	Q	92.9	Very high	91.3	Very high	77 Å²	77	51.4 Å²	51.4	36%	0.36	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	129.7	-177.6	-57.7	-174.7	26.9	0	0	110.6	V147 R149 A152 I156	V147-Q154 HydrophobicContact CG2-CB 4.46Å; V147-Q154 PolarHBondContact N-O 2.85Å; V147-Q154 PolarHBondContact O-N 3.02Å; R149-Q154 PolarHBondContact O-NE2 2.72Å; A152-Q154 PolarHBondContact O-N 2.79Å; Q154-I156 PolarHBondContact O-N 3.28Å
155	T	93.8	Very high	91.2	Very high	97 Å²	97	45 Å²	45	60%	0.595	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	106.6	177.3	-50.8	0	0	0	0	110.7	K144 T145	K144-T155 HydrophobicContact CB-CG2 4Å; K144-T155 HydrophobicContact CD-CG2 4.04Å; K144-T155 HydrophobicContact CG-CG2 4.39Å; T145-T155 CarbonylContact O-C 3.58Å; T145-T155 WeakPolarHBondContact O-CA 3.39Å
156	I	94.6	Very high	91.3	Very high	14 Å²	14	45.1 Å²	45.1	7%	0.072	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	169.3	179.7	66.2	167	0	0	0	111.8	K144 T145 V147 Q154 Q160 V161	K144-I156 CarbonylContact C-O 3.55Å; K144-I156 VanDerWaalsContact CA-O 3.28Å; K144-I156 WeakPolarHBondContact CA-O 3.4Å; T145-I156 HydrophobicContact CG2-CG1 4.24Å; T145-I156 PolarHBondContact N-O 3.23Å; T145-I156 PolarHBondContact O-N 3.4Å; V147-I156 HydrophobicContact CB-CD1 4.36Å; V147-I156 HydrophobicContact CG1-CD1 3.65Å; V147-I156 HydrophobicContact CG1-CG1 3.89Å; V147-I156 HydrophobicContact CG2-CD1 3.73Å; V147-I156 HydrophobicContact CG2-CG1 3.89Å; V147-I156 HydrophobicContact CG2-CG2 4Å; Q154-I156 PolarHBondContact O-N 3.28Å; I156-Q160 HydrophobicContact CB-CB 4.39Å; I156-Q160 HydrophobicContact CD1-CB 4.02Å; I156-V161 HydrophobicContact CD1-CG2 3.88Å; I156-V161 HydrophobicContact CG1-CG2 4.45Å
157	I	95.1	Very high	91.2	Very high	55 Å²	55	43.6 Å²	43.6	28%	0.282	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	151.4	169.5	57.9	168.8	0	0	0	111.3	K143 K159 Q160	K143-I157 CarbonylContact O-C 3.56Å; K143-I157 VanDerWaalsContact O-CA 3.31Å; K143-I157 WeakPolarHBondContact O-CA 3.36Å; I157-K159 HydrophobicContact CD1-CB 4.28Å; I157-K159 PolarHBondContact O-N 2.88Å; I157-K159 VanDerWaalsContact O-N 3.12Å; I157-Q160 HydrophobicContact CD1-CG 4.29Å; I157-Q160 HydrophobicContact CG1-CB 4.27Å; I157-Q160 HydrophobicContact CG1-CG 3.75Å; I157-Q160 WeakPolarHBondContact O-CB 3.35Å; I157-Q160 PolarHBondContact O-N 3.46Å
158	W	93.4	Very high	91.2	Very high	13 Å²	13	45.1 Å²	45.1	5%	0.049	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-52.8	-37.6	-177.8	-79	23.4	0	0	0	113.2	N62 V140 K143 K144 Q160 V161 H174 L175 P176	N62-W158 WeakPolarHBondContact CB-O 3.45Å; N62-W158 PolarHBondContact ND2-O 3.3Å; V140-W158 HydrophobicContact CG1-CE3 4.01Å; V140-W158 HydrophobicContact CG1-CZ3 4.07Å; K143-W158 VanDerWaalsContact C-CD1 3.42Å; K143-W158 HydrophobicContact CB-CD2 3.64Å; K143-W158 HydrophobicContact CB-CE3 4.33Å; K143-W158 HydrophobicContact CB-CG 3.74Å; K143-W158 HydrophobicContact CB-CZ2 4.2Å; K143-W158 HydrophobicContact CD-CD2 4.22Å; K143-W158 HydrophobicContact CD-CE3 4.24Å; K143-W158 HydrophobicContact CD-CH2 3.77Å; K143-W158 HydrophobicContact CD-CZ2 3.69Å; K143-W158 HydrophobicContact CD-CZ3 4.03Å; K143-W158 PolarHBondContact O-N 3.06Å; K144-W158 PolarHBondContact O-NE1 2.92Å; W158-Q160 PolarHBondContact O-N 3.44Å; W158-V161 WeakPolarHBondContact O-CB 3.46Å; W158-V161 WeakPolarHBondContact O-CG2 3.27Å; W158-V161 PolarHBondContact O-N 3.28Å; W158-H174 HydrophobicContact CH2-CB 3.83Å; W158-H174 HydrophobicContact CZ2-CB 4.05Å; W158-H174 WeakPolarHBondContact CZ2-O 3.29Å; W158-L175 WeakPolarHBondContact CH2-O 3.49Å; W158-P176 HydrophobicContact CD2-CB 3.84Å; W158-P176 HydrophobicContact CE3-CB 4.45Å; W158-P176 HydrophobicContact CG-CB 3.96Å; W158-P176 HydrophobicContact CZ2-CB 4.23Å
159	K	93.3	Very high	91.4	Very high	87 Å²	87	44.6 Å²	44.6	38%	0.378	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-59.7	-23.5	176.1	-177.4	167	-172.7	157.4	0	114.2	H63 N141 I157	H63-K159 HydrophobicContact CB-CD 4.3Å; H63-K159 HydrophobicContact CB-CG 4.21Å; H63-K159 PolarHBondContact CD2-NZ 2.75Å; H63-K159 PolarHBondContact NE2-NZ 2.98Å; N141-K159 HydrophobicContact CB-CB 4.46Å; N141-K159 PolarHBondContact O-N 3.34Å; I157-K159 HydrophobicContact CD1-CB 4.28Å; I157-K159 PolarHBondContact O-N 2.88Å; I157-K159 VanDerWaalsContact O-N 3.12Å
160	Q	93.2	Very high	91.6	Very high	109 Å²	109	43.5 Å²	43.5	51%	0.509	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-94	-1.2	-177.6	-69.9	172.4	-26.5	0	0	114	R149 I156 I157 W158	R149-Q160 PolarHBondContact NH2-O 3.36Å; I156-Q160 HydrophobicContact CB-CB 4.39Å; I156-Q160 HydrophobicContact CD1-CB 4.02Å; I157-Q160 HydrophobicContact CD1-CG 4.29Å; I157-Q160 HydrophobicContact CG1-CB 4.27Å; I157-Q160 HydrophobicContact CG1-CG 3.75Å; I157-Q160 WeakPolarHBondContact O-CB 3.35Å; I157-Q160 PolarHBondContact O-N 3.46Å; W158-Q160 PolarHBondContact O-N 3.44Å
161	V	93.2	Very high	92	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.018	23%	0.23	C	C	.	.			trans	-71.4	140.3	172.6	179.6	0	0	0	0	109.2	N62 T145 I156 W158 D165 P176 A177 V277	N62-V161 HydrophobicContact CB-CB 4.11Å; N62-V161 WeakPolarHBondContact CB-O 3.48Å; T145-V161 HydrophobicContact CG2-CG2 3.66Å; I156-V161 HydrophobicContact CD1-CG2 3.88Å; I156-V161 HydrophobicContact CG1-CG2 4.45Å; W158-V161 WeakPolarHBondContact O-CB 3.46Å; W158-V161 WeakPolarHBondContact O-CG2 3.27Å; W158-V161 PolarHBondContact O-N 3.28Å; V161-D165 WeakPolarHBondContact CA-OD2 3.47Å; V161-P176 HydrophobicContact CG2-CB 4.41Å; V161-A177 HydrophobicContact CG1-CB 4.36Å; V161-V277 HydrophobicContact CG1-CG1 4.29Å; V161-V277 HydrophobicContact CG1-CG2 3.87Å
162	A	93	Very high	92.2	Very high	45 Å²	45	41.6 Å²	41.6	37%	0.372	23%	0.232	S	C	.	.			trans	-131.6	160.2	-179.6	0	0	0	0	0	111.3	G164 D165	A162-G164 PolarHBondContact O-N 3.05Å; A162-D165 PolarHBondContact N-OD2 3.33Å; A162-D165 WeakPolarHBondContact O-CB 3.47Å; A162-D165 PolarHBondContact O-N 3.22Å; A162-D165 VanDerWaalsContact O-N 3.14Å
163	V	93.2	Very high	92.3	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.042	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	129.4	173.9	178.4	0	0	0	0	109.9	V49 Q55 F59 V278 T280	V49-V163 HydrophobicContact CB-CG1 4.3Å; V49-V163 HydrophobicContact CG1-CG1 3.85Å; V49-V163 HydrophobicContact CG2-CG1 3.47Å; V49-V163 VanDerWaalsContact CG2-CG1 3.47Å; Q55-V163 WeakPolarHBondContact CG-O 3.42Å; F59-V163 HydrophobicContact CB-CB 4.14Å; F59-V163 HydrophobicContact CB-CG2 3.68Å; F59-V163 HydrophobicContact CD1-CG2 4.36Å; F59-V163 HydrophobicContact CD2-CB 3.55Å; F59-V163 HydrophobicContact CD2-CG1 3.75Å; F59-V163 HydrophobicContact CD2-CG2 4Å; F59-V163 HydrophobicContact CE2-CB 4.06Å; F59-V163 HydrophobicContact CE2-CG1 3.72Å; F59-V163 HydrophobicContact CG-CB 3.87Å; F59-V163 HydrophobicContact CG-CG1 4.18Å; F59-V163 HydrophobicContact CG-CG2 3.76Å; F59-V163 HydrophobicContact CZ-CG1 4.16Å; V163-V278 WeakPolarHBondContact CG2-O 3.4Å; V163-T280 HydrophobicContact CG2-CG2 3.96Å; V163-T280 WeakPolarHBondContact CG2-OG1 3.43Å
164	G	90.7	Very high	92.2	Very high	13 Å²	13	40.7 Å²	40.7	13%	0.134	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	-1.6	-174.2	0	0	0	0	0	115.9	A162 V277	A162-G164 PolarHBondContact O-N 3.05Å; G164-V277 PolarHBondContact N-O 2.83Å
165	D	92.1	Very high	92.2	Very high	17 Å²	17	37 Å²	37	9%	0.091	21%	0.206	C	C	.	.			trans	-63.5	138.5	164.3	-80.2	-44.9	0	0	0	110.1	R149 V161 A162 V167 V277	R149-D165 IonicContact CZ-OD1 3.31Å; R149-D165 VanDerWaalsContact CZ-OD1 3.31Å; R149-D165 IonicContact CZ-OD2 3.64Å; R149-D165 IonicContact NE-OD1 2.88Å; R149-D165 PolarHBondContact NE-OD1 3.38Å; R149-D165 IonicContact NE-OD2 2.8Å; R149-D165 IonicContact NH2-OD1 2.79Å; R149-D165 PolarHBondContact NH2-OD1 3.44Å; R149-D165 IonicContact NH2-OD2 2.89Å; R149-D165 PolarHBondContact NH2-OD2 2.99Å; V161-D165 WeakPolarHBondContact CA-OD2 3.47Å; A162-D165 PolarHBondContact N-OD2 3.33Å; A162-D165 WeakPolarHBondContact O-CB 3.47Å; A162-D165 PolarHBondContact O-N 3.22Å; A162-D165 VanDerWaalsContact O-N 3.14Å; D165-V167 HydrophobicContact CB-CG2 4.38Å; D165-V277 PolarHBondContact O-N 3Å
166	I	93.1	Very high	92.2	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.026	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	127.4	163.9	-65.9	174.4	0	0	0	108.1	N52 V147 L148 W153 L225 V274 G275 I276	N52-I166 WeakPolarHBondContact OD1-CD1 3.31Å; V147-I166 CarbonylContact C-O 3.57Å; V147-I166 VanDerWaalsContact CA-O 3.3Å; V147-I166 WeakPolarHBondContact CA-O 3.14Å; L148-I166 HydrophobicContact CB-CB 4.14Å; L148-I166 HydrophobicContact CB-CG2 4.19Å; L148-I166 HydrophobicContact CD2-CD1 4.45Å; L148-I166 HydrophobicContact CD2-CG2 4.4Å; L148-I166 PolarHBondContact N-O 3.14Å; W153-I166 HydrophobicContact CH2-CG2 4.34Å; I166-L225 HydrophobicContact CD1-CD2 4.34Å; I166-V274 HydrophobicContact CG2-CG1 3.5Å; I166-G275 WeakPolarHBondContact CA-O 3.41Å; I166-I276 HydrophobicContact CG1-CG1 3.99Å
167	V	93.8	Very high	92.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	133	-173.3	-172.3	0	0	0	0	109.9	T145 T146 V147 D165 V169 P176 M179 V274 G275 V277	T145-V167 WeakPolarHBondContact OG1-CG1 3.31Å; T146-V167 CarbonylContact O-C 3.56Å; T146-V167 WeakPolarHBondContact O-CA 3.37Å; T146-V167 WeakPolarHBondContact O-CG1 3.23Å; V147-V167 HydrophobicContact CG1-CG2 4.12Å; D165-V167 HydrophobicContact CB-CG2 4.38Å; V167-V169 HydrophobicContact CG1-CG2 3.79Å; V167-P176 HydrophobicContact CG1-CG 4.17Å; V167-M179 HydrophobicContact CB-CE 3.7Å; V167-M179 HydrophobicContact CG1-CE 4.02Å; V167-M179 HydrophobicContact CG2-CE 4.03Å; V167-V274 WeakPolarHBondContact O-CA 3.38Å; V167-G275 PolarHBondContact N-O 2.81Å; V167-G275 PolarHBondContact O-N 3.08Å; V167-V277 HydrophobicContact CG2-CG2 3.5Å; V167-V277 VanDerWaalsContact CG2-CG2 3.5Å
168	K	93.5	Very high	92.1	Very high	32 Å²	32	29.1 Å²	29.1	14%	0.139	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	120.2	165.9	-176.5	172.7	179.7	176.6	0	108.7	T146 W153 W272 V273 V274 L1179	T146-K168 PolarHBondContact O-N 3.38Å; W153-K168 HydrophobicContact CE3-CB 4.04Å; W153-K168 HydrophobicContact CH2-CB 3.7Å; W153-K168 HydrophobicContact CZ2-CB 4.29Å; W153-K168 HydrophobicContact CZ2-CD 4.37Å; W153-K168 HydrophobicContact CZ3-CB 3.55Å; K168-W272 HydrophobicContact CG-CB 4.29Å; K168-V273 WeakPolarHBondContact CA-O 3.4Å; K168-V274 HydrophobicContact CB-CG2 4.25Å; K168-V274 HydrophobicContact CG-CG2 4.29Å; K168-L1179 PolarHBondContact NZ-O 2.63Å
169	V	93.6	Very high	92.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	134.6	176.2	-177.2	0	0	0	0	107.8	V167 Q173 L175 M179 L267 W272 V273	V167-V169 HydrophobicContact CG1-CG2 3.79Å; V169-Q173 HydrophobicContact CG1-CB 3.7Å; V169-L175 HydrophobicContact CG1-CD2 4.4Å; V169-L175 HydrophobicContact CG2-CD2 4.26Å; V169-M179 HydrophobicContact CG2-CE 4.23Å; V169-L267 HydrophobicContact CG1-CB 4.35Å; V169-L267 WeakPolarHBondContact O-CD2 3.43Å; V169-W272 CarbonylContact O-C 3.55Å; V169-W272 VanDerWaalsContact O-CA 3.25Å; V169-W272 WeakPolarHBondContact O-CA 3.46Å; V169-V273 HydrophobicContact CB-CG1 4.18Å; V169-V273 PolarHBondContact N-O 3.06Å; V169-V273 PolarHBondContact O-N 2.79Å
170	T	92.8	Very high	92.2	Very high	50 Å²	50	24.6 Å²	24.6	31%	0.307	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	166.2	-178	69.4	0	0	0	0	112.2	G172 Q173 Q271	T170-G172 PolarHBondContact O-N 2.89Å; T170-Q173 WeakPolarHBondContact O-CB 3.35Å; T170-Q173 PolarHBondContact O-N 2.96Å; T170-Q173 VanDerWaalsContact OG1-CD 3.25Å; T170-Q173 PolarHBondContact OG1-NE2 2.96Å; T170-Q271 CarbonylContact C-O 3.6Å; T170-Q271 VanDerWaalsContact CA-O 3.31Å; T170-Q271 WeakPolarHBondContact CA-O 3.45Å
171	N	87.8	Confident	92.3	Very high	83 Å²	83	19.6 Å²	19.6	44%	0.444	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47	138	175.9	-161.4	14.3	0	0	0	111.8	Q173 R268 N269 T270 Q271	N171-Q173 VanDerWaalsContact C-N 3.25Å; N171-Q173 PolarHBondContact O-N 2.91Å; N171-R268 WeakPolarHBondContact OD1-CA 3.29Å; N171-N269 PolarHBondContact OD1-N 3.36Å; N171-T270 WeakPolarHBondContact CA-O 3.47Å; N171-T270 WeakPolarHBondContact CB-O 3.21Å; N171-T270 PolarHBondContact N-O 2.69Å; N171-Q271 PolarHBondContact N-O 3.18Å
172	G	84.6	Confident	92.2	Very high	32 Å²	32	19.5 Å²	19.5	33%	0.33	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	-2.2	-178.6	0	0	0	0	0	115.8	T170 Q266 L267	T170-G172 PolarHBondContact O-N 2.89Å; G172-Q266 PolarHBondContact O-NE2 2.86Å; G172-L267 WeakPolarHBondContact CA-O 3.14Å; G172-L267 PolarHBondContact N-O 3.02Å
173	Q	89.6	Confident	92.2	Very high	66 Å²	66	17.4 Å²	17.4	31%	0.308	10%	0.101	S	C	.	.	P	Polyproline II helix	trans	-89.7	145.4	176.4	-63.2	-172.2	3.6	0	0	112.6	V169 T170 N171 L267	V169-Q173 HydrophobicContact CG1-CB 3.7Å; T170-Q173 WeakPolarHBondContact O-CB 3.35Å; T170-Q173 PolarHBondContact O-N 2.96Å; T170-Q173 VanDerWaalsContact OG1-CD 3.25Å; T170-Q173 PolarHBondContact OG1-NE2 2.96Å; N171-Q173 VanDerWaalsContact C-N 3.25Å; N171-Q173 PolarHBondContact O-N 2.91Å; Q173-L267 PolarHBondContact O-N 3.08Å
174	H	89.5	Confident	92.1	Very high	49 Å²	49	17.1 Å²	17.1	23%	0.227	10%	0.099	C	C	.	.	B	Isolated β-bridge	trans	-79.7	147.9	168.9	-64.6	-90.2	0	0	0	111.7	W158 G264 A265	W158-H174 HydrophobicContact CH2-CB 3.83Å; W158-H174 HydrophobicContact CZ2-CB 4.05Å; W158-H174 WeakPolarHBondContact CZ2-O 3.29Å; H174-G264 PolarHBondContact ND1-O 3.44Å; H174-A265 WeakPolarHBondContact CA-O 3.13Å
175	L	92.6	Very high	91.9	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.103	C	C	.	.	P	Polyproline II helix	trans	-73	130.8	177.2	-62.3	155.1	0	0	0	111.1	W158 V169 M179 I193 L261 L262 A265	W158-L175 WeakPolarHBondContact CH2-O 3.49Å; V169-L175 HydrophobicContact CG1-CD2 4.4Å; V169-L175 HydrophobicContact CG2-CD2 4.26Å; L175-M179 HydrophobicContact CD2-CE 4.39Å; L175-M179 HydrophobicContact CD2-CG 4.46Å; L175-M179 HydrophobicContact CD2-SD 3.84Å; L175-I193 HydrophobicContact CD1-CG2 4.41Å; L175-L261 HydrophobicContact CD1-CB 3.61Å; L175-L261 HydrophobicContact CD2-CB 4Å; L175-L261 HydrophobicContact CD2-CD1 3.92Å; L175-L261 HydrophobicContact CG-CB 4.44Å; L175-L262 VanDerWaalsContact CD1-O 3.24Å; L175-L262 WeakPolarHBondContact CD1-O 3.39Å; L175-A265 HydrophobicContact CD1-CB 3.85Å; L175-A265 PolarHBondContact N-O 3.24Å
176	P	92.6	Very high	91.5	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	-80.8	-20.1	-172.4	32.1	-36.9	0	0	0	114.5	N62 T145 W158 V161 V167 M179 R263	N62-P176 PolarHBondContact ND2-O 3.47Å; N62-P176 PolarHBondContact OD1-O 3.46Å; T145-P176 HydrophobicContact CG2-CB 4.18Å; T145-P176 HydrophobicContact CG2-CG 4.17Å; W158-P176 HydrophobicContact CD2-CB 3.84Å; W158-P176 HydrophobicContact CE3-CB 4.45Å; W158-P176 HydrophobicContact CG-CB 3.96Å; W158-P176 HydrophobicContact CZ2-CB 4.23Å; V161-P176 HydrophobicContact CG2-CB 4.41Å; V167-P176 HydrophobicContact CG1-CG 4.17Å; P176-M179 HydrophobicContact CG-CE 4.45Å; P176-R263 PolarHBondContact O-NH1 2.86Å
177	A	94.4	Very high	90.7	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.12	C	C	.	.	S	Bend	trans	-162.8	168	-173.1	0	0	0	0	0	108.3	V161 V277 T280	V161-A177 HydrophobicContact CG1-CB 4.36Å; A177-V277 HydrophobicContact CB-CG1 3.57Å; A177-V277 HydrophobicContact CB-CG2 4.2Å; A177-T280 HydrophobicContact CB-CG2 4.24Å
178	D	94.7	Very high	90	Very high	1 Å²	1	26 Å²	26	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	131.2	175.1	-55.8	-16.6	0	0	0	109	L261 L262 R263 V278 Y279 S284 K285	D178-L261 WeakPolarHBondContact CA-O 3.48Å; D178-L262 HydrophobicContact CB-CD2 4.29Å; D178-R263 VanDerWaalsContact OD1-CB 3.29Å; D178-R263 WeakPolarHBondContact OD1-CB 3.5Å; D178-R263 PolarHBondContact OD1-N 2.77Å; D178-V278 PolarHBondContact O-N 3.21Å; D178-Y279 HydrophobicContact CB-CD2 3.98Å; D178-Y279 HydrophobicContact CB-CG 4.43Å; D178-Y279 PolarHBondContact N-O 3.13Å; D178-Y279 PolarHBondContact O-N 3.34Å; D178-S284 WeakPolarHBondContact OD2-CA 3.37Å; D178-S284 WeakPolarHBondContact OD2-CB 3.35Å; D178-K285 PolarHBondContact OD2-N 3.18Å
179	M	94.4	Very high	89.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	151.5	-171.6	59.8	168.9	57.5	0	0	113.7	V167 V169 L175 P176 V260 L261 I276 V277	V167-M179 HydrophobicContact CB-CE 3.7Å; V167-M179 HydrophobicContact CG1-CE 4.02Å; V167-M179 HydrophobicContact CG2-CE 4.03Å; V169-M179 HydrophobicContact CG2-CE 4.23Å; L175-M179 HydrophobicContact CD2-CE 4.39Å; L175-M179 HydrophobicContact CD2-CG 4.46Å; L175-M179 HydrophobicContact CD2-SD 3.84Å; P176-M179 HydrophobicContact CG-CE 4.45Å; M179-V260 WeakPolarHBondContact O-CA 3.47Å; M179-L261 HydrophobicContact CG-CB 3.91Å; M179-L261 HydrophobicContact CG-CG 4.5Å; M179-L261 PolarHBondContact N-O 2.84Å; M179-L261 PolarHBondContact O-N 2.9Å; M179-L261 HydrophobicContact SD-CD1 4.28Å; M179-I276 CarbonylContact C-O 3.58Å; M179-I276 WeakPolarHBondContact CA-O 3.35Å; M179-I276 VanDerWaalsContact CB-O 3.29Å; M179-I276 WeakPolarHBondContact CB-O 3.25Å; M179-V277 HydrophobicContact CE-CG2 4.46Å
180	V	94.8	Very high	89.3	Confident	5 Å²	5	24.7 Å²	24.7	3%	0.03	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	132.9	170.6	170.8	0	0	0	0	109.7	L229 F241 L255 Q259 V260 G275 I276 V278	V180-L229 HydrophobicContact CG2-CD2 4.15Å; V180-F241 HydrophobicContact CG2-CZ 4.43Å; V180-L255 HydrophobicContact CG1-CD1 4.02Å; V180-L255 HydrophobicContact CG1-CD2 3.99Å; V180-L255 HydrophobicContact CG2-CD1 4.21Å; V180-Q259 CarbonylContact C-O 3.59Å; V180-Q259 WeakPolarHBondContact CA-O 3.33Å; V180-V260 HydrophobicContact CG2-CG2 4.13Å; V180-G275 CarbonylContact O-C 3.48Å; V180-G275 WeakPolarHBondContact O-CA 3.35Å; V180-I276 PolarHBondContact N-O 3.39Å; V180-I276 PolarHBondContact O-N 2.98Å; V180-V278 HydrophobicContact CG2-CG2 3.85Å
181	I	94.4	Very high	89	Confident	3 Å²	3	22.3 Å²	22.3	2%	0.015	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	129.9	178.2	-54.8	163	0	0	0	110.3	R207 Q259 L261 V273	I181-R207 HydrophobicContact CD1-CB 3.81Å; I181-Q259 WeakPolarHBondContact CG1-O 3.15Å; I181-Q259 PolarHBondContact N-O 3.31Å; I181-L261 HydrophobicContact CD1-CD2 3.8Å; I181-L261 HydrophobicContact CD1-CG 4.17Å; I181-L261 HydrophobicContact CG1-CD1 4.02Å; I181-L261 HydrophobicContact CG1-CD2 3.94Å; I181-L261 HydrophobicContact CG1-CG 3.71Å; I181-V273 HydrophobicContact CG2-CG2 4.04Å
182	V	91.6	Very high	88.9	Confident	2 Å²	2	19.1 Å²	19.1	1%	0.012	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	-58.7	168.8	-178.5	0	0	0	0	109.5	T213 F216 L222 L225 V274 I276	V182-T213 CarbonylContact O-C 3.54Å; V182-T213 WeakPolarHBondContact O-CB 3.48Å; V182-T213 PolarHBondContact O-OG1 3.34Å; V182-F216 HydrophobicContact CG1-CB 4.33Å; V182-F216 HydrophobicContact CG1-CD2 4.43Å; V182-L222 HydrophobicContact CG1-CD2 3.9Å; V182-L225 HydrophobicContact CG1-CD2 4.47Å; V182-V274 HydrophobicContact CB-CG1 4.46Å; V182-V274 PolarHBondContact N-O 3Å; V182-I276 HydrophobicContact CG2-CD1 3.45Å; V182-I276 VanDerWaalsContact CG2-CD1 3.45Å; V182-I276 HydrophobicContact CG2-CG1 3.67Å
183	S	91.9	Very high	89	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	163.7	-176.6	56.8	0	0	0	0	111.1	F216 V273 V274	S183-F216 VanDerWaalsContact CB-O 3.29Å; S183-F216 WeakPolarHBondContact CB-O 3.27Å; S183-F216 PolarHBondContact OG-O 2.85Å; S183-V273 WeakPolarHBondContact O-CG2 3.39Å; S183-V274 PolarHBondContact N-O 3.31Å; S183-V274 PolarHBondContact O-N 3.14Å
184	S	91.3	Very high	88.6	Confident	1 Å²	1	15.8 Å²	15.8	1%	0.007	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	165.4	-174.2	-170.3	0	0	0	0	110.4	E186 M190 T270 W272	S184-E186 VanDerWaalsContact C-N 3.34Å; S184-M190 WeakPolarHBondContact CB-O 3.21Å; S184-M190 PolarHBondContact OG-O 3.18Å; S184-T270 VanDerWaalsContact OG-CG2 3.25Å; S184-T270 WeakPolarHBondContact OG-CG2 3.42Å; S184-W272 WeakPolarHBondContact O-CH2 3.5Å; S184-W272 PolarHBondContact OG-O 2.97Å
185	S	86.8	Confident	87.8	Confident	31 Å²	31	13.7 Å²	13.7	22%	0.217	7%	0.074	C	C	.	.	S	Bend	trans	-68.1	-29.7	174.5	59.5	0	0	0	0	113.9	Q271 W272	S185-Q271 PolarHBondContact OG-N 2.98Å; S185-W272 PolarHBondContact N-O 3.12Å
186	E	84.2	Confident	86.5	Confident	12 Å²	12	13.8 Å²	13.8	6%	0.056	8%	0.075	C	C	.	.	S	Bend	trans	-86.9	157.2	-178	-45.5	-48.9	105	0	0	111.8	S184 A189 M190 T270 R1176	S184-E186 VanDerWaalsContact C-N 3.34Å; E186-A189 PolarHBondContact O-N 3.23Å; E186-M190 HydrophobicContact CB-CB 4.37Å; E186-T270 HydrophobicContact CG-CG2 4.3Å; E186-R1176 IonicContact OE2-CZ 3.09Å; E186-R1176 IonicContact OE2-NE 2.77Å; E186-R1176 IonicContact OE2-NH2 3.91Å; E186-R1176 PolarHBondContact OE2-NH2 3.29Å
187	P	76.7	Confident	85.1	Confident	65 Å²	65	15.6 Å²	15.6	42%	0.422	8%	0.084	S	C	.	.	G	3₁₀ helix	trans	-52.8	152.5	-178.8	-27.7	36.1	0	0	0	113.7	A189 M190	P187-A189 PolarHBondContact O-N 2.88Å; P187-M190 HydrophobicContact CB-CE 4.1Å; P187-M190 WeakPolarHBondContact O-CE 3.44Å; P187-M190 WeakPolarHBondContact O-CG 3.42Å; P187-M190 PolarHBondContact O-N 2.88Å; P187-M190 VanDerWaalsContact O-N 3.1Å
188	Q	78.8	Confident	83.8	Confident	115 Å²	115	16.4 Å²	16.4	54%	0.537	9%	0.089	S	C	.	.	G	3₁₀ helix	trans	54.2	24.4	179.3	-50	-174.6	4	0	0	115	M190	Q188-M190 VanDerWaalsContact C-N 3.26Å; Q188-M190 PolarHBondContact O-N 2.94Å
189	A	84.7	Confident	82.3	Confident	3 Å²	3	16.7 Å²	16.7	3%	0.025	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	55.1	36.2	-173.8	0	0	0	0	0	114.3	E186 P187 G209 A214	E186-A189 PolarHBondContact O-N 3.23Å; P187-A189 PolarHBondContact O-N 2.88Å; A189-G209 PolarHBondContact O-N 3.26Å; A189-A214 HydrophobicContact CB-CB 3.58Å
190	M	86.4	Confident	80.4	Confident	1 Å²	1	16.8 Å²	16.8	1%	0.005	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	150	169.7	-65	-179.3	-69.7	0	0	111.5	S184 E186 P187 Q188 R207 Q208 V1161	S184-M190 WeakPolarHBondContact CB-O 3.21Å; S184-M190 PolarHBondContact OG-O 3.18Å; E186-M190 HydrophobicContact CB-CB 4.37Å; P187-M190 HydrophobicContact CB-CE 4.1Å; P187-M190 WeakPolarHBondContact O-CE 3.44Å; P187-M190 WeakPolarHBondContact O-CG 3.42Å; P187-M190 PolarHBondContact O-N 2.88Å; P187-M190 VanDerWaalsContact O-N 3.1Å; Q188-M190 VanDerWaalsContact C-N 3.26Å; Q188-M190 PolarHBondContact O-N 2.94Å; M190-R207 CarbonylContact C-O 3.55Å; M190-R207 WeakPolarHBondContact CA-O 3.29Å; M190-Q208 HydrophobicContact CG-CG 4.16Å; M190-V1161 HydrophobicContact CG-CG2 4.12Å; M190-V1161 HydrophobicContact SD-CB 4.36Å; M190-V1161 HydrophobicContact SD-CG1 3.97Å; M190-V1161 HydrophobicContact SD-CG2 3.76Å
191	C	88.3	Confident	78.9	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	153.3	167.7	59.7	0	0	0	0	111	R207 L267 T270 V273	C191-R207 PolarHBondContact N-O 3.14Å; C191-R207 PolarHBondContact O-N 2.97Å; C191-L267 HydrophobicContact CB-CD1 4.04Å; C191-T270 HydrophobicContact CB-CG2 3.75Å; C191-V273 HydrophobicContact CB-CG2 4.32Å
192	Y	85.7	Confident	77	Confident	15 Å²	15	21.5 Å²	21.5	6%	0.059	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	132.4	176	-58.1	-101.2	0	0	0	110.2	L204 I206 R268 N269 T270 Y1170	Y192-L204 HydrophobicContact CD1-CB 4.2Å; Y192-I206 HydrophobicContact CD1-CG1 3.9Å; Y192-I206 HydrophobicContact CE1-CD1 3.86Å; Y192-I206 HydrophobicContact CE1-CG1 3.6Å; Y192-R268 WeakPolarHBondContact CB-O 3.47Å; Y192-R268 PolarHBondContact O-N 2.82Å; Y192-R268 VanDerWaalsContact O-O 3.06Å; Y192-N269 HydrophobicContact CD2-CB 4.19Å; Y192-N269 HydrophobicContact CG-CB 4.37Å; Y192-T270 PolarHBondContact N-OG1 2.73Å; Y192-Y1170 WeakPolarHBondContact CE2-OH 3.36Å; Y192-Y1170 WeakPolarHBondContact OH-CE2 3.44Å; Y192-Y1170 PolarHBondContact OH-OH 3.28Å
193	I	85.6	Confident	75.7	Confident	4 Å²	4	23.9 Å²	23.9	2%	0.021	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.3	173.7	55.4	168.1	0	0	0	111.5	L175 T195 K205 R207 L261 A265 Q266 L267	L175-I193 HydrophobicContact CD1-CG2 4.41Å; I193-T195 HydrophobicContact CD1-CG2 3.99Å; I193-T195 HydrophobicContact CG1-CG2 4.23Å; I193-K205 HydrophobicContact CG1-CB 4.32Å; I193-K205 WeakPolarHBondContact CG1-O 3.48Å; I193-K205 PolarHBondContact N-O 3.12Å; I193-K205 PolarHBondContact O-N 3.26Å; I193-R207 HydrophobicContact CD1-CG 3.85Å; I193-R207 HydrophobicContact CG1-CG 4.08Å; I193-L261 HydrophobicContact CD1-CD2 4.19Å; I193-L261 HydrophobicContact CG2-CD2 3.99Å; I193-A265 HydrophobicContact CB-CB 4.22Å; I193-A265 HydrophobicContact CD1-CB 4.29Å; I193-Q266 WeakPolarHBondContact CA-O 3.45Å; I193-L267 HydrophobicContact CG2-CD1 4.34Å
194	E	80.8	Confident	74.7	Confident	24 Å²	24	26.5 Å²	26.5	11%	0.112	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	121.2	169.1	-172.6	-162	132.7	0	0	108.5	S196 L204 A265 Q266 R268	E194-S196 WeakPolarHBondContact OE1-CB 3.43Å; E194-S196 PolarHBondContact OE1-OG 2.84Å; E194-L204 HydrophobicContact CB-CD2 3.95Å; E194-L204 HydrophobicContact CG-CD2 4.44Å; E194-A265 VanDerWaalsContact O-CA 3.23Å; E194-A265 WeakPolarHBondContact O-CA 3.34Å; E194-A265 VanDerWaalsContact O-CB 3.26Å; E194-A265 WeakPolarHBondContact O-CB 3.44Å; E194-Q266 HydrophobicContact CB-CB 4.33Å; E194-Q266 PolarHBondContact N-O 3.16Å; E194-Q266 PolarHBondContact O-N 3.34Å; E194-Q266 VanDerWaalsContact O-N 3.08Å; E194-Q266 PolarHBondContact OE2-OE1 2.87Å; E194-R268 HydrophobicContact CB-CG 3.91Å; E194-R268 IonicContact OE2-CZ 2.73Å; E194-R268 IonicContact OE2-NE 3.16Å; E194-R268 PolarHBondContact OE2-NE 3.2Å; E194-R268 IonicContact OE2-NH2 3.6Å; E194-R268 PolarHBondContact OE2-NH2 3Å
195	T	73.5	Confident	74	Confident	6 Å²	6	27.5 Å²	27.5	4%	0.037	15%	0.146	C	C	.	.			trans	-103.4	11.9	-175.1	57.7	0	0	0	0	114.4	I193 N197 L198 D199 G200 E201 K205 A265	I193-T195 HydrophobicContact CD1-CG2 3.99Å; I193-T195 HydrophobicContact CG1-CG2 4.23Å; T195-N197 PolarHBondContact O-N 3.37Å; T195-L198 HydrophobicContact CG2-CD1 4.37Å; T195-L198 PolarHBondContact O-N 3.37Å; T195-D199 VanDerWaalsContact C-OD1 3.31Å; T195-D199 VanDerWaalsContact CB-OD1 3.23Å; T195-D199 WeakPolarHBondContact CB-OD1 3.28Å; T195-D199 WeakPolarHBondContact CB-OD2 3.46Å; T195-D199 PolarHBondContact O-N 3.41Å; T195-D199 VanDerWaalsContact OG1-CG 3.26Å; T195-D199 PolarHBondContact OG1-OD1 2.88Å; T195-D199 PolarHBondContact OG1-OD2 3.47Å; T195-G200 PolarHBondContact O-N 2.79Å; T195-E201 CarbonylContact C-O 3.47Å; T195-K205 HydrophobicContact CG2-CD 3.93Å; T195-K205 HydrophobicContact CG2-CG 4.45Å; T195-K205 WeakPolarHBondContact OG1-CD 3.27Å; T195-K205 WeakPolarHBondContact OG1-CE 3.21Å; T195-K205 PolarHBondContact OG1-NZ 3.21Å; T195-A265 HydrophobicContact CG2-CB 4.27Å
196	S	64.9	Low	73.9	Confident	1 Å²	1	26.9 Å²	26.9	1%	0.007	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-39.7	-31.4	169.9	60.8	0	0	0	0	115.1	E194 G200 E201	E194-S196 WeakPolarHBondContact OE1-CB 3.43Å; E194-S196 PolarHBondContact OE1-OG 2.84Å; S196-G200 WeakPolarHBondContact O-CA 3.48Å; S196-G200 PolarHBondContact O-N 3.46Å; S196-E201 PolarHBondContact N-O 2.94Å; S196-E201 VanDerWaalsContact N-O 3.12Å
197	N	63.7	Low	74	Confident	38 Å²	38	27.7 Å²	27.7	20%	0.203	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	16.3	179.9	-75.7	-89.6	0	0	0	115.4	T195 G264 L286 Q837	T195-N197 PolarHBondContact O-N 3.37Å; N197-G264 WeakPolarHBondContact CB-O 3.23Å; N197-L286 WeakPolarHBondContact O-CD1 3.34Å; N197-Q837 VanDerWaalsContact C-NE2 3.26Å; N197-Q837 PolarHBondContact O-NE2 2.9Å; N197-Q837 PolarHBondContact OD1-NE2 2.86Å
198	L	67.3	Low	74.5	Confident	18 Å²	18	26 Å²	26	9%	0.094	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135.6	-50.2	179.7	-77.4	151.5	0	0	0	111.7	T195 L238 L262 A265 L286	T195-L198 HydrophobicContact CG2-CD1 4.37Å; T195-L198 PolarHBondContact O-N 3.37Å; L198-L238 HydrophobicContact CD2-CD2 3.88Å; L198-L262 HydrophobicContact CD1-CB 3.76Å; L198-L262 HydrophobicContact CD1-CD1 4.49Å; L198-L262 HydrophobicContact CD2-CB 4.01Å; L198-L262 HydrophobicContact CD2-CD1 4.29Å; L198-A265 HydrophobicContact CD1-CB 3.64Å; L198-L286 HydrophobicContact CD2-CB 4.03Å; L198-L286 HydrophobicContact CD2-CD1 4.11Å
199	D	63	Low	75	Confident	7 Å²	7	20.5 Å²	20.5	4%	0.037	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-26.8	176.7	43.9	45.6	0	0	0	111.6	T195 E201 K205 Y239 A815 N816	T195-D199 VanDerWaalsContact C-OD1 3.31Å; T195-D199 VanDerWaalsContact CB-OD1 3.23Å; T195-D199 WeakPolarHBondContact CB-OD1 3.28Å; T195-D199 WeakPolarHBondContact CB-OD2 3.46Å; T195-D199 PolarHBondContact O-N 3.41Å; T195-D199 VanDerWaalsContact OG1-CG 3.26Å; T195-D199 PolarHBondContact OG1-OD1 2.88Å; T195-D199 PolarHBondContact OG1-OD2 3.47Å; D199-E201 WeakPolarHBondContact OD1-CB 3.34Å; D199-E201 PolarHBondContact OD1-N 3.11Å; D199-K205 IonicContact OD1-NZ 2.84Å; D199-K205 IonicContact OD2-NZ 2.77Å; D199-K205 PolarHBondContact OD2-NZ 2.83Å; D199-Y239 PolarHBondContact OD2-OH 3.3Å; D199-A815 CarbonylContact O-C 3.51Å; D199-A815 PolarHBondContact O-N 2.7Å; D199-N816 WeakPolarHBondContact O-CB 3.43Å; D199-N816 PolarHBondContact O-N 3.29Å; D199-N816 PolarHBondContact O-ND2 3.15Å; D199-N816 VanDerWaalsContact O-ND2 3.09Å; D199-N816 PolarHBondContact O-OD1 3.5Å
200	G	54	Low	75.1	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.01	11%	0.108	C	C	.	.			trans	99.8	-6.4	-175.8	0	0	0	0	0	112.7	T195 S196 T202	T195-G200 PolarHBondContact O-N 2.79Å; S196-G200 WeakPolarHBondContact O-CA 3.48Å; S196-G200 PolarHBondContact O-N 3.46Å; G200-T202 PolarHBondContact O-N 2.68Å
201	E	63.7	Low	75	Confident	63 Å²	63	26.2 Å²	26.2	29%	0.294	14%	0.14	S	C	.	.			trans	-72.9	120.2	-179.5	-65.1	161.3	-130.3	0	0	109.6	T195 S196 D199 N203 K205 Y239	T195-E201 CarbonylContact C-O 3.47Å; S196-E201 PolarHBondContact N-O 2.94Å; S196-E201 VanDerWaalsContact N-O 3.12Å; D199-E201 WeakPolarHBondContact OD1-CB 3.34Å; D199-E201 PolarHBondContact OD1-N 3.11Å; E201-N203 PolarHBondContact O-N 2.9Å; E201-K205 IonicContact OE1-NZ 4Å; E201-K205 PolarHBondContact OE1-NZ 3.36Å; E201-K205 WeakPolarHBondContact OE2-CE 3.48Å; E201-K205 IonicContact OE2-NZ 2.75Å; E201-K205 PolarHBondContact OE2-NZ 2.86Å; E201-Y239 PolarHBondContact OE1-OH 3.35Å
202	T	53.6	Low	74.8	Confident	45 Å²	45	29.6 Å²	29.6	28%	0.276	16%	0.158	S	C	.	.			trans	-75.8	-11.1	177	52.1	0	0	0	0	113.4	G200 N428 E834	G200-T202 PolarHBondContact O-N 2.68Å; T202-N428 PolarHBondContact OG1-ND2 2.92Å; T202-E834 HydrophobicContact CG2-CB 3.99Å; T202-E834 HydrophobicContact CG2-CG 3.68Å
203	N	64.1	Low	74.8	Confident	51 Å²	51	29 Å²	29	27%	0.273	16%	0.156	S	C	.	.	S	Bend	trans	-62.4	143.8	176.5	-74.2	4	0	0	0	110.9	E201 K205 E1156	E201-N203 PolarHBondContact O-N 2.9Å; N203-K205 PolarHBondContact O-N 2.76Å; N203-E1156 PolarHBondContact ND2-OE1 2.68Å
204	L	71.9	Confident	74.8	Confident	56 Å²	56	29.6 Å²	29.6	29%	0.293	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	96.6	178.8	-63	-173.7	0	0	0	110.1	Y192 E194 I206 R268 N269	Y192-L204 HydrophobicContact CD1-CB 4.2Å; E194-L204 HydrophobicContact CB-CD2 3.95Å; E194-L204 HydrophobicContact CG-CD2 4.44Å; L204-I206 PolarHBondContact O-N 2.9Å; L204-R268 HydrophobicContact CD1-CB 4.23Å; L204-R268 HydrophobicContact CD2-CB 3.76Å; L204-R268 HydrophobicContact CD2-CG 3.79Å; L204-N269 WeakPolarHBondContact CD1-ND2 3.2Å
205	K	76.8	Confident	74.8	Confident	21 Å²	21	31.1 Å²	31.1	9%	0.091	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	124.4	-179.1	-60.9	-172	-177.3	178.7	0	109.9	I193 T195 D199 E201 N203 Y239	I193-K205 HydrophobicContact CG1-CB 4.32Å; I193-K205 WeakPolarHBondContact CG1-O 3.48Å; I193-K205 PolarHBondContact N-O 3.12Å; I193-K205 PolarHBondContact O-N 3.26Å; T195-K205 HydrophobicContact CG2-CD 3.93Å; T195-K205 HydrophobicContact CG2-CG 4.45Å; T195-K205 WeakPolarHBondContact OG1-CD 3.27Å; T195-K205 WeakPolarHBondContact OG1-CE 3.21Å; T195-K205 PolarHBondContact OG1-NZ 3.21Å; D199-K205 IonicContact OD1-NZ 2.84Å; D199-K205 IonicContact OD2-NZ 2.77Å; D199-K205 PolarHBondContact OD2-NZ 2.83Å; E201-K205 IonicContact OE1-NZ 4Å; E201-K205 PolarHBondContact OE1-NZ 3.36Å; E201-K205 WeakPolarHBondContact OE2-CE 3.48Å; E201-K205 IonicContact OE2-NZ 2.75Å; E201-K205 PolarHBondContact OE2-NZ 2.86Å; N203-K205 PolarHBondContact O-N 2.76Å; K205-Y239 PolarHBondContact NZ-OH 2.69Å; K205-Y239 VanDerWaalsContact NZ-OH 3.11Å
206	I	83.4	Confident	75.3	Confident	19 Å²	19	33 Å²	33	10%	0.097	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	131.5	175.5	-51.7	-175.5	0	0	0	108.7	Y192 L204 V1160 V1161 V1166	Y192-I206 HydrophobicContact CD1-CG1 3.9Å; Y192-I206 HydrophobicContact CE1-CD1 3.86Å; Y192-I206 HydrophobicContact CE1-CG1 3.6Å; L204-I206 PolarHBondContact O-N 2.9Å; I206-V1160 VanDerWaalsContact O-CG2 3.23Å; I206-V1160 WeakPolarHBondContact O-CG2 3.26Å; I206-V1161 HydrophobicContact CG2-CB 4.29Å; I206-V1161 HydrophobicContact CG2-CG2 3.85Å; I206-V1166 HydrophobicContact CD1-CG2 3.65Å
207	R	87.3	Confident	76.1	Confident	28 Å²	28	37.3 Å²	37.3	11%	0.106	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	152	168.7	-66.5	-64.4	-164.7	-160.4	1.8	109.5	I181 M190 C191 I193 D258 L261	I181-R207 HydrophobicContact CD1-CB 3.81Å; M190-R207 CarbonylContact C-O 3.55Å; M190-R207 WeakPolarHBondContact CA-O 3.29Å; C191-R207 PolarHBondContact N-O 3.14Å; C191-R207 PolarHBondContact O-N 2.97Å; I193-R207 HydrophobicContact CD1-CG 3.85Å; I193-R207 HydrophobicContact CG1-CG 4.08Å; R207-D258 WeakPolarHBondContact CB-O 3.37Å; R207-D258 WeakPolarHBondContact CD-O 3.43Å; R207-D258 IonicContact CZ-OD1 2.72Å; R207-D258 IonicContact NH1-OD1 3.13Å; R207-D258 PolarHBondContact NH1-OD1 2.81Å; R207-L261 HydrophobicContact CB-CD2 3.8Å; R207-L261 HydrophobicContact CG-CD2 3.88Å
208	Q	87.8	Confident	77.1	Confident	29 Å²	29	38.8 Å²	38.8	14%	0.136	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	119.6	-173.5	-169.7	176.6	19.4	0	0	110.8	M190 D258 Q259 V1160 V1161	M190-Q208 HydrophobicContact CG-CG 4.16Å; Q208-D258 PolarHBondContact N-O 3.13Å; Q208-Q259 WeakPolarHBondContact O-CG 3.47Å; Q208-Q259 PolarHBondContact O-NE2 3.12Å; Q208-V1160 HydrophobicContact CB-CG1 3.78Å; Q208-V1161 HydrophobicContact CB-CG2 4.43Å
209	G	87.8	Confident	77.8	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.01	23%	0.232	C	C	.	.			trans	-67.4	169.8	172	0	0	0	0	0	113	A189	A189-G209 PolarHBondContact O-N 3.26Å
210	L	87.8	Confident	78.8	Confident	20 Å²	20	46.7 Å²	46.7	11%	0.105	26%	0.263	C	S	.	.			trans	-67.4	135.2	178.3	-69.8	176.2	0	0	0	110.7	L212 T213 A214 L245 A253 L255 Q259	L210-L212 HydrophobicContact CB-CB 4.3Å; L210-L212 PolarHBondContact O-N 3.31Å; L210-L212 VanDerWaalsContact O-N 3.07Å; L210-T213 PolarHBondContact O-N 3.45Å; L210-T213 PolarHBondContact O-OG1 2.94Å; L210-T213 VanDerWaalsContact O-OG1 3.09Å; L210-A214 PolarHBondContact O-N 2.72Å; L210-L245 HydrophobicContact CD1-CB 4.2Å; L210-L245 HydrophobicContact CD1-CD2 3.74Å; L210-A253 HydrophobicContact CD1-CB 3.67Å; L210-A253 HydrophobicContact CD2-CB 4.41Å; L210-L255 HydrophobicContact CD1-CD2 3.62Å; L210-L255 HydrophobicContact CD2-CD2 4.18Å; L210-L255 HydrophobicContact CG-CD2 3.81Å; L210-Q259 HydrophobicContact CD2-CG 4.18Å; L210-Q259 HydrophobicContact CG-CG 4.24Å
211	P	84	Confident	80.2	Confident	103 Å²	103	49.2 Å²	49.2	67%	0.669	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-27.1	170.5	-26.8	35.3	0	0	0	113	T213	P211-T213 VanDerWaalsContact C-N 3.3Å; P211-T213 PolarHBondContact O-N 3.1Å
212	L	84.8	Confident	81.2	Confident	72 Å²	72	46.3 Å²	46.3	38%	0.377	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-29.2	174.7	-168.7	65.1	0	0	0	113.4	L210 L247 A253	L210-L212 HydrophobicContact CB-CB 4.3Å; L210-L212 PolarHBondContact O-N 3.31Å; L210-L212 VanDerWaalsContact O-N 3.07Å; L212-L247 HydrophobicContact CD2-CD1 4.18Å; L212-L247 HydrophobicContact CG-CD1 4.35Å; L212-A253 HydrophobicContact CD2-CB 4.2Å
213	T	85.3	Confident	82.6	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.018	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-15.6	-177.7	56.5	0	0	0	0	114	V182 L210 P211 G215 F216 L245 L247	V182-T213 CarbonylContact O-C 3.54Å; V182-T213 WeakPolarHBondContact O-CB 3.48Å; V182-T213 PolarHBondContact O-OG1 3.34Å; L210-T213 PolarHBondContact O-N 3.45Å; L210-T213 PolarHBondContact O-OG1 2.94Å; L210-T213 VanDerWaalsContact O-OG1 3.09Å; P211-T213 VanDerWaalsContact C-N 3.3Å; P211-T213 PolarHBondContact O-N 3.1Å; T213-G215 PolarHBondContact O-N 3.47Å; T213-F216 HydrophobicContact CG2-CD2 4.2Å; T213-F216 HydrophobicContact CG2-CE2 4.12Å; T213-F216 WeakPolarHBondContact O-CD2 3.16Å; T213-F216 PolarHBondContact O-N 2.66Å; T213-L245 HydrophobicContact CG2-CD2 3.82Å; T213-L247 HydrophobicContact CG2-CD1 4.08Å
214	A	84.6	Confident	83.6	Confident	15 Å²	15	49.1 Å²	49.1	12%	0.124	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-22.3	-177	0	0	0	0	0	115.1	A189 L210 Q217	A189-A214 HydrophobicContact CB-CB 3.58Å; L210-A214 PolarHBondContact O-N 2.72Å; A214-Q217 PolarHBondContact O-NE2 2.87Å; A214-Q217 VanDerWaalsContact O-NE2 3.15Å
215	G	82.3	Confident	84.2	Confident	57 Å²	57	46.7 Å²	46.7	59%	0.588	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-18.5	175.2	0	0	0	0	0	115.1	T213 Q217	T213-G215 PolarHBondContact O-N 3.47Å; G215-Q217 VanDerWaalsContact C-N 3.31Å; G215-Q217 PolarHBondContact O-N 2.89Å
216	F	83.6	Confident	84.6	Confident	44 Å²	44	48.1 Å²	48.1	19%	0.193	28%	0.284	C	S	.	.			trans	-78.5	79.6	-178.9	-57.3	-60.5	0	0	0	110.8	V182 S183 T213 D221 L222 L225 L247	V182-F216 HydrophobicContact CG1-CB 4.33Å; V182-F216 HydrophobicContact CG1-CD2 4.43Å; S183-F216 VanDerWaalsContact CB-O 3.29Å; S183-F216 WeakPolarHBondContact CB-O 3.27Å; S183-F216 PolarHBondContact OG-O 2.85Å; T213-F216 HydrophobicContact CG2-CD2 4.2Å; T213-F216 HydrophobicContact CG2-CE2 4.12Å; T213-F216 WeakPolarHBondContact O-CD2 3.16Å; T213-F216 PolarHBondContact O-N 2.66Å; F216-D221 HydrophobicContact CB-CB 3.96Å; F216-D221 HydrophobicContact CD1-CB 3.89Å; F216-D221 HydrophobicContact CG-CB 4.41Å; F216-L222 HydrophobicContact CB-CD2 4.19Å; F216-L225 HydrophobicContact CD2-CD1 3.63Å; F216-L225 HydrophobicContact CE2-CD1 3.48Å; F216-L225 VanDerWaalsContact CE2-CD1 3.48Å; F216-L225 HydrophobicContact CG-CD1 4.31Å; F216-L225 HydrophobicContact CZ-CD1 4.01Å; F216-L247 HydrophobicContact CE2-CD1 4.27Å
217	Q	82	Confident	84.8	Confident	93 Å²	93	47.9 Å²	47.9	44%	0.435	29%	0.287	S	S	.	.			trans	-107.7	-23.7	-175.2	-58.9	-172.5	4.5	0	0	113.2	A214 G215 W272	A214-Q217 PolarHBondContact O-NE2 2.87Å; A214-Q217 VanDerWaalsContact O-NE2 3.15Å; G215-Q217 VanDerWaalsContact C-N 3.31Å; G215-Q217 PolarHBondContact O-N 2.89Å; Q217-W272 HydrophobicContact CB-CH2 4.39Å; Q217-W272 HydrophobicContact CG-CH2 4.27Å
218	T	83.4	Confident	84.9	Confident	68 Å²	68	50.2 Å²	50.2	42%	0.417	30%	0.299	S	S	.	.	S	Bend	trans	-85.1	167.8	177.9	74.1	0	0	0	0	112.2	D221 L222	T218-D221 VanDerWaalsContact CB-OD2 3.31Å; T218-D221 WeakPolarHBondContact CB-OD2 3.47Å; T218-D221 WeakPolarHBondContact CG2-OD2 3.47Å; T218-D221 PolarHBondContact N-OD2 2.82Å; T218-D221 VanDerWaalsContact N-OD2 3.12Å; T218-D221 WeakPolarHBondContact OG1-CB 3.45Å; T218-D221 PolarHBondContact OG1-N 2.88Å; T218-D221 VanDerWaalsContact OG1-N 3.15Å; T218-D221 PolarHBondContact OG1-OD2 3.27Å; T218-L222 WeakPolarHBondContact O-CG 3.39Å; T218-L222 PolarHBondContact O-N 3.15Å
219	L	83.6	Confident	85.1	Confident	63 Å²	63	49 Å²	49	33%	0.33	29%	0.293	S	S	.	.	H	α-helix	trans	-65.2	-40.6	175	-177.1	62.8	0	0	0	111.8	L148 L222 M223	L148-L219 HydrophobicContact CD1-CD1 3.46Å; L148-L219 VanDerWaalsContact CD1-CD1 3.46Å; L148-L219 HydrophobicContact CD2-CD1 4.44Å; L219-L222 PolarHBondContact O-N 3.03Å; L219-M223 VanDerWaalsContact O-CG 3.26Å; L219-M223 WeakPolarHBondContact O-CG 3.35Å; L219-M223 PolarHBondContact O-N 3.33Å; L219-M223 VanDerWaalsContact O-N 3.09Å
220	D	82.4	Confident	85.2	Confident	129 Å²	129	51.1 Å²	51.1	69%	0.69	30%	0.303	S	S	*	.	H	α-helix	trans	-70	-39.1	-178.9	-60.2	-55.5	0	0	0	111.5	L222 M223 A224	D220-L222 PolarHBondContact O-N 3Å; D220-M223 PolarHBondContact O-N 2.9Å; D220-A224 WeakPolarHBondContact O-CB 3.5Å; D220-A224 PolarHBondContact O-N 2.89Å
221	D	83.8	Confident	85.3	Confident	54 Å²	54	50.5 Å²	50.5	29%	0.289	30%	0.3	S	S	.	.	H	α-helix	trans	-55.1	-50.5	171.4	-74.9	-42.4	0	0	0	112.2	F216 T218 M223 A224 L225	F216-D221 HydrophobicContact CB-CB 3.96Å; F216-D221 HydrophobicContact CD1-CB 3.89Å; F216-D221 HydrophobicContact CG-CB 4.41Å; T218-D221 VanDerWaalsContact CB-OD2 3.31Å; T218-D221 WeakPolarHBondContact CB-OD2 3.47Å; T218-D221 WeakPolarHBondContact CG2-OD2 3.47Å; T218-D221 PolarHBondContact N-OD2 2.82Å; T218-D221 VanDerWaalsContact N-OD2 3.12Å; T218-D221 WeakPolarHBondContact OG1-CB 3.45Å; T218-D221 PolarHBondContact OG1-N 2.88Å; T218-D221 VanDerWaalsContact OG1-N 3.15Å; T218-D221 PolarHBondContact OG1-OD2 3.27Å; D221-M223 VanDerWaalsContact C-N 3.27Å; D221-M223 PolarHBondContact O-N 2.75Å; D221-A224 PolarHBondContact O-N 2.79Å; D221-L225 PolarHBondContact O-N 3.09Å; D221-L225 VanDerWaalsContact O-N 3.11Å
222	L	84.4	Confident	85.7	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-68.3	-26.5	-179.2	-69.5	170.2	0	0	0	112.5	N52 L148 W153 V182 F216 T218 L219 D220 L225 V274	N52-L222 PolarHBondContact ND2-O 2.71Å; L148-L222 HydrophobicContact CD2-CB 3.74Å; W153-L222 HydrophobicContact CH2-CD1 4.09Å; W153-L222 HydrophobicContact CZ2-CD1 3.82Å; V182-L222 HydrophobicContact CG1-CD2 3.9Å; F216-L222 HydrophobicContact CB-CD2 4.19Å; T218-L222 WeakPolarHBondContact O-CG 3.39Å; T218-L222 PolarHBondContact O-N 3.15Å; L219-L222 PolarHBondContact O-N 3.03Å; D220-L222 PolarHBondContact O-N 3Å; L222-L225 WeakPolarHBondContact O-CB 3.18Å; L222-V274 HydrophobicContact CD1-CG1 4.02Å; L222-V274 HydrophobicContact CD1-CG2 4.35Å; L222-V274 HydrophobicContact CD2-CG1 3.89Å
223	M	83.8	Confident	85.9	Confident	84 Å²	84	44.8 Å²	44.8	41%	0.414	27%	0.267	S	S	.	.	H	α-helix	trans	-79.7	-31.6	173	-73	-71.4	-66.9	0	0	112.8	L148 L219 D220 D221 L225	L148-M223 HydrophobicContact CD1-SD 4.06Å; L148-M223 HydrophobicContact CD2-CG 4.28Å; L148-M223 HydrophobicContact CD2-SD 4.14Å; L148-M223 HydrophobicContact CG-SD 4.16Å; L219-M223 VanDerWaalsContact O-CG 3.26Å; L219-M223 WeakPolarHBondContact O-CG 3.35Å; L219-M223 PolarHBondContact O-N 3.33Å; L219-M223 VanDerWaalsContact O-N 3.09Å; D220-M223 PolarHBondContact O-N 2.9Å; D221-M223 VanDerWaalsContact C-N 3.27Å; D221-M223 PolarHBondContact O-N 2.75Å; M223-L225 VanDerWaalsContact C-N 3.31Å
224	A	84	Confident	86	Confident	70 Å²	70	46.4 Å²	46.4	58%	0.579	28%	0.277	S	S	*	.	H	α-helix	trans	-73.8	-22.1	175.2	0	0	0	0	0	113.1	D220 D221 S226	D220-A224 WeakPolarHBondContact O-CB 3.5Å; D220-A224 PolarHBondContact O-N 2.89Å; D221-A224 PolarHBondContact O-N 2.79Å; A224-S226 PolarHBondContact O-N 3.02Å; A224-S226 VanDerWaalsContact O-N 3.12Å; A224-S226 PolarHBondContact O-OG 3.4Å
225	L	84.4	Confident	86.1	Confident	6 Å²	6	47.3 Å²	47.3	3%	0.031	28%	0.28	C	S	.	.			trans	-52.3	116	176.9	-165.9	78.4	0	0	0	111	L51 N52 I166 V182 F216 D221 L222 M223 L247 I276	L51-L225 HydrophobicContact CD1-CD2 4.2Å; L51-L225 HydrophobicContact CD1-CG 4.21Å; N52-L225 PolarHBondContact ND2-O 2.87Å; I166-L225 HydrophobicContact CD1-CD2 4.34Å; V182-L225 HydrophobicContact CG1-CD2 4.47Å; F216-L225 HydrophobicContact CD2-CD1 3.63Å; F216-L225 HydrophobicContact CE2-CD1 3.48Å; F216-L225 VanDerWaalsContact CE2-CD1 3.48Å; F216-L225 HydrophobicContact CG-CD1 4.31Å; F216-L225 HydrophobicContact CZ-CD1 4.01Å; D221-L225 PolarHBondContact O-N 3.09Å; D221-L225 VanDerWaalsContact O-N 3.11Å; L222-L225 WeakPolarHBondContact O-CB 3.18Å; M223-L225 VanDerWaalsContact C-N 3.31Å; L225-L247 HydrophobicContact CD1-CD1 4.32Å; L225-L247 HydrophobicContact CD1-CD2 3.73Å; L225-L247 HydrophobicContact CG-CD2 4.17Å; L225-I276 HydrophobicContact CD2-CD1 4.16Å
226	S	85.6	Confident	85.9	Confident	50 Å²	50	52.6 Å²	52.6	35%	0.35	28%	0.282	S	S	.	.			trans	-144.8	142	-176.9	53.2	0	0	0	0	111.7	A224 V248	A224-S226 PolarHBondContact O-N 3.02Å; A224-S226 VanDerWaalsContact O-N 3.12Å; A224-S226 PolarHBondContact O-OG 3.4Å; S226-V248 PolarHBondContact O-N 2.62Å
227	G	87.9	Confident	85.7	Confident	15 Å²	15	55.2 Å²	55.2	16%	0.155	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146.6	-159.4	-169.9	0	0	0	0	0	111.3	L51 R246	L51-G227 WeakPolarHBondContact CB-O 3.4Å; L51-G227 WeakPolarHBondContact CG-O 3.39Å; L51-G227 PolarHBondContact N-O 3.27Å; G227-R246 CarbonylContact C-O 3.42Å; G227-R246 WeakPolarHBondContact CA-O 3.45Å
228	H	90.1	Very high	85.4	Confident	77 Å²	77	52.6 Å²	52.6	36%	0.356	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	155.9	175.8	65.1	-81.1	0	0	0	112.1	T48 V49 E230 R246	T48-H228 HydrophobicContact CG2-CB 4.25Å; V49-H228 WeakPolarHBondContact O-CA 3.26Å; H228-E230 IonicContact CD2-OE1 3.18Å; H228-E230 PolarHBondContact CD2-OE1 3.48Å; H228-E230 VanDerWaalsContact CD2-OE1 3.28Å; H228-E230 IonicContact NE2-OE1 3.69Å; H228-E230 PolarHBondContact NE2-OE1 2.91Å; H228-E230 IonicContact NE2-OE2 3.87Å; H228-R246 PolarHBondContact N-O 2.76Å; H228-R246 WeakPolarHBondContact NE2-CD 3.25Å; H228-R246 PolarHBondContact NE2-NH1 3.16Å; H228-R246 VanDerWaalsContact NE2-NH1 3.18Å; H228-R246 PolarHBondContact O-N 2.9Å
229	L	90.7	Very high	85.2	Confident	2 Å²	2	55 Å²	55	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.1	177.7	166.1	62.2	0	0	0	108.1	T48 V49 V180 L245 L255 V278	T48-L229 CarbonylContact C-O 3.55Å; T48-L229 VanDerWaalsContact CA-O 3.3Å; T48-L229 WeakPolarHBondContact CA-O 3.46Å; V49-L229 HydrophobicContact CB-CB 4.31Å; V49-L229 PolarHBondContact N-O 2.8Å; V49-L229 PolarHBondContact O-N 3.01Å; V180-L229 HydrophobicContact CG2-CD2 4.15Å; L229-L245 HydrophobicContact CB-CD1 4.39Å; L229-L255 HydrophobicContact CD1-CD1 3.28Å; L229-V278 HydrophobicContact CD2-CG1 4.49Å; L229-V278 HydrophobicContact CD2-CG2 3.61Å
230	E	91.2	Very high	85.2	Confident	46 Å²	46	56.3 Å²	56.3	22%	0.215	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	130.5	169	-75.9	162.9	-148.4	0	0	108.4	T48 H228 G243 T244 R246	T48-E230 HydrophobicContact CG2-CG 4.26Å; H228-E230 IonicContact CD2-OE1 3.18Å; H228-E230 PolarHBondContact CD2-OE1 3.48Å; H228-E230 VanDerWaalsContact CD2-OE1 3.28Å; H228-E230 IonicContact NE2-OE1 3.69Å; H228-E230 PolarHBondContact NE2-OE1 2.91Å; H228-E230 IonicContact NE2-OE2 3.87Å; E230-G243 CarbonylContact O-C 3.59Å; E230-G243 WeakPolarHBondContact O-CA 3.38Å; E230-T244 PolarHBondContact N-O 2.99Å; E230-T244 PolarHBondContact O-N 3.08Å; E230-R246 VanDerWaalsContact CD-CZ 3.45Å; E230-R246 IonicContact OE1-CZ 2.68Å; E230-R246 VanDerWaalsContact OE1-CZ 3.28Å; E230-R246 IonicContact OE1-NE 2.67Å; E230-R246 IonicContact OE1-NH1 3.84Å; E230-R246 PolarHBondContact OE1-NH1 2.91Å; E230-R246 IonicContact OE1-NH2 3.28Å; E230-R246 IonicContact OE2-CZ 3.28Å; E230-R246 IonicContact OE2-NE 2.99Å; E230-R246 IonicContact OE2-NH1 2.73Å; E230-R246 PolarHBondContact OE2-NH1 3.31Å; E230-R246 IonicContact OE2-NH2 2.98Å; E230-R246 PolarHBondContact OE2-NH2 3.13Å
231	C	90.5	Very high	85.5	Confident	7 Å²	7	50.7 Å²	50.7	5%	0.047	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	169.1	175.8	62.6	0	0	0	0	111.6	A46 R47 F241 T242 V278	A46-C231 CarbonylContact C-O 3.55Å; A46-C231 WeakPolarHBondContact CA-O 3.44Å; R47-C231 PolarHBondContact N-O 3.21Å; R47-C231 PolarHBondContact O-N 3.42Å; R47-C231 PolarHBondContact O-SG 2.84Å; R47-C231 VanDerWaalsContact O-SG 3.35Å; C231-F241 HydrophobicContact CB-CE2 4.12Å; C231-F241 HydrophobicContact CB-CZ 3.76Å; C231-T242 WeakPolarHBondContact CA-O 3.34Å; C231-V278 VanDerWaalsContact SG-CG1 3.52Å
232	E	90.9	Very high	85.8	Confident	40 Å²	40	52.7 Å²	52.7	19%	0.187	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-58.9	173.6	171.9	63.4	-168.4	-156.5	0	0	114.1	N235 F241 T242 Y279	E232-N235 PolarHBondContact OE1-ND2 3.26Å; E232-F241 WeakPolarHBondContact OE1-CA 3.41Å; E232-T242 VanDerWaalsContact CD-N 3.34Å; E232-T242 PolarHBondContact N-O 2.96Å; E232-T242 VanDerWaalsContact N-O 3.12Å; E232-T242 VanDerWaalsContact OE2-CB 3.25Å; E232-T242 WeakPolarHBondContact OE2-CB 3.23Å; E232-T242 PolarHBondContact OE2-N 2.96Å; E232-T242 PolarHBondContact OE2-OG1 3.26Å; E232-Y279 PolarHBondContact O-OH 3.25Å
233	G	89.4	Confident	86.1	Confident	16 Å²	16	52.9 Å²	52.9	17%	0.165	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-72.5	149.6	169	0	0	0	0	0	111.9	N235	G233-N235 PolarHBondContact O-N 2.81Å; G233-N235 PolarHBondContact O-ND2 2.94Å; G233-N235 VanDerWaalsContact O-ND2 3.12Å
234	P	88.4	Confident	86.5	Confident	36 Å²	36	50.9 Å²	50.9	23%	0.234	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-62.2	125.5	179.4	28.4	-35.8	0	0	0	110.3	Y279 D283 Q288	P234-Y279 HydrophobicContact CB-CD1 3.77Å; P234-Y279 HydrophobicContact CB-CE1 3.77Å; P234-Y279 HydrophobicContact CB-CG 4.29Å; P234-Y279 HydrophobicContact CG-CE1 4.5Å; P234-D283 HydrophobicContact CB-CB 4.09Å; P234-D283 WeakPolarHBondContact CB-O 3.39Å; P234-D283 HydrophobicContact CG-CB 4.32Å; P234-Q288 VanDerWaalsContact C-NE2 3.26Å; P234-Q288 PolarHBondContact O-NE2 3.33Å; P234-Q288 PolarHBondContact O-OE1 3.15Å
235	N	86.5	Confident	86.8	Confident	34 Å²	34	48 Å²	48	18%	0.182	25%	0.247	C	C	.	.			trans	-135.8	170.7	-171.6	66.6	73.4	0	0	0	111.9	E232 G233 H237	E232-N235 PolarHBondContact OE1-ND2 3.26Å; G233-N235 PolarHBondContact O-N 2.81Å; G233-N235 PolarHBondContact O-ND2 2.94Å; G233-N235 VanDerWaalsContact O-ND2 3.12Å; N235-H237 WeakPolarHBondContact OD1-CB 3.26Å; N235-H237 PolarHBondContact OD1-N 3.13Å
236	R	77.6	Confident	87.1	Confident	169 Å²	169	52 Å²	52	64%	0.638	26%	0.262	S	S	*	.	S	Bend	trans	-83.7	-5.7	-176.7	71.9	-178.3	70.1	167.9	4.4	114.9	L238 N289	R236-L238 PolarHBondContact O-N 3.28Å; R236-N289 PolarHBondContact O-ND2 2.93Å; R236-N289 PolarHBondContact O-OD1 2.94Å
237	H	79.1	Confident	87.1	Confident	99 Å²	99	50.3 Å²	50.3	46%	0.458	25%	0.249	S	C	.	.			trans	-84.5	103	-170.2	-67.7	-111.2	0	0	0	109.7	N235 Y239 D240 K285	N235-H237 WeakPolarHBondContact OD1-CB 3.26Å; N235-H237 PolarHBondContact OD1-N 3.13Å; H237-Y239 VanDerWaalsContact C-N 3.28Å; H237-Y239 PolarHBondContact O-N 2.95Å; H237-D240 HydrophobicContact CB-CB 3.79Å; H237-D240 VanDerWaalsContact CB-OD2 3.25Å; H237-D240 WeakPolarHBondContact CB-OD2 3.23Å; H237-D240 IonicContact CG-OD2 2.78Å; H237-D240 IonicContact ND1-OD2 3.74Å; H237-D240 PolarHBondContact ND1-OD2 3.08Å; H237-D240 PolarHBondContact O-N 2.9Å; H237-K285 WeakPolarHBondContact O-CD 3.41Å; H237-K285 WeakPolarHBondContact O-CE 3.17Å; H237-K285 PolarHBondContact O-NZ 3.09Å
238	L	76.1	Confident	86.8	Confident	38 Å²	38	53.5 Å²	53.5	20%	0.199	27%	0.265	C	S	.	.	S	Bend	trans	-54.4	-45.3	-176.3	-70	172.1	0	0	0	112.1	L198 R236 L262 K285	L198-L238 HydrophobicContact CD2-CD2 3.88Å; R236-L238 PolarHBondContact O-N 3.28Å; L238-L262 HydrophobicContact CD2-CD1 3.98Å; L238-K285 HydrophobicContact CD2-CB 4.2Å; L238-K285 PolarHBondContact O-NZ 2.95Å
239	Y	79.4	Confident	86	Confident	117 Å²	117	57.7 Å²	57.7	46%	0.459	29%	0.29	S	S	.	.	S	Bend	trans	-89.3	-16	-172.1	-62	-63.9	0	0	0	115.4	D199 E201 K205 H237 P257	D199-Y239 PolarHBondContact OD2-OH 3.3Å; E201-Y239 PolarHBondContact OE1-OH 3.35Å; K205-Y239 PolarHBondContact NZ-OH 2.69Å; K205-Y239 VanDerWaalsContact NZ-OH 3.11Å; H237-Y239 VanDerWaalsContact C-N 3.28Å; H237-Y239 PolarHBondContact O-N 2.95Å; Y239-P257 WeakPolarHBondContact O-CB 3.41Å; Y239-P257 VanDerWaalsContact O-CG 3.27Å; Y239-P257 WeakPolarHBondContact O-CG 3.24Å
240	D	83.9	Confident	85.4	Confident	92 Å²	92	61.5 Å²	61.5	49%	0.492	31%	0.308	S	S	.	.			trans	-95.1	122	-179.6	-55.2	-44.2	0	0	0	109.7	H237 K285	H237-D240 HydrophobicContact CB-CB 3.79Å; H237-D240 VanDerWaalsContact CB-OD2 3.25Å; H237-D240 WeakPolarHBondContact CB-OD2 3.23Å; H237-D240 IonicContact CG-OD2 2.78Å; H237-D240 IonicContact ND1-OD2 3.74Å; H237-D240 PolarHBondContact ND1-OD2 3.08Å; H237-D240 PolarHBondContact O-N 2.9Å; D240-K285 PolarHBondContact O-NZ 3.34Å
241	F	88.8	Confident	85	Confident	10 Å²	10	66.1 Å²	66.1	4%	0.044	33%	0.334	C	S	.	.			trans	-147	127.5	168.7	179.3	-93.1	0	0	0	111.3	V180 C231 E232 L255 G256 P257 V260 Y279	V180-F241 HydrophobicContact CG2-CZ 4.43Å; C231-F241 HydrophobicContact CB-CE2 4.12Å; C231-F241 HydrophobicContact CB-CZ 3.76Å; E232-F241 WeakPolarHBondContact OE1-CA 3.41Å; F241-L255 HydrophobicContact CE1-CB 4.1Å; F241-G256 CarbonylContact O-C 3.53Å; F241-G256 WeakPolarHBondContact O-CA 3.49Å; F241-P257 HydrophobicContact CB-CB 4.3Å; F241-V260 HydrophobicContact CB-CG2 4.41Å; F241-V260 HydrophobicContact CD1-CG2 3.47Å; F241-V260 VanDerWaalsContact CD1-CG2 3.47Å; F241-V260 HydrophobicContact CD2-CG2 4.19Å; F241-V260 HydrophobicContact CE1-CG2 3.61Å; F241-V260 HydrophobicContact CE2-CG2 4.31Å; F241-V260 HydrophobicContact CG-CG2 3.76Å; F241-V260 HydrophobicContact CZ-CG2 4.03Å; F241-Y279 HydrophobicContact CD2-CE2 4.28Å; F241-Y279 AromaticContact CE2-CE2 3.96Å; F241-Y279 HydrophobicContact CE2-CE2 3.96Å
242	T	89.9	Confident	84.7	Confident	96 Å²	96	69.6 Å²	69.6	59%	0.589	36%	0.356	S	S	*	.			trans	-117.2	122.6	177.3	-37.5	0	0	0	0	110.8	C231 E232	C231-T242 WeakPolarHBondContact CA-O 3.34Å; E232-T242 VanDerWaalsContact CD-N 3.34Å; E232-T242 PolarHBondContact N-O 2.96Å; E232-T242 VanDerWaalsContact N-O 3.12Å; E232-T242 VanDerWaalsContact OE2-CB 3.25Å; E232-T242 WeakPolarHBondContact OE2-CB 3.23Å; E232-T242 PolarHBondContact OE2-N 2.96Å; E232-T242 PolarHBondContact OE2-OG1 3.26Å
243	G	90.3	Very high	84.4	Confident	7 Å²	7	68.3 Å²	68.3	7%	0.072	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	176.4	173	0	0	0	0	0	114.4	E230 L255	E230-G243 CarbonylContact O-C 3.59Å; E230-G243 WeakPolarHBondContact O-CA 3.38Å; G243-L255 PolarHBondContact N-O 2.95Å; G243-L255 PolarHBondContact O-N 3.36Å
244	T	91.6	Very high	84.5	Confident	42 Å²	42	72.3 Å²	72.3	26%	0.258	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	122.3	176.1	-63.6	0	0	0	0	109.5	E230 R246 P252 A253	E230-T244 PolarHBondContact N-O 2.99Å; E230-T244 PolarHBondContact O-N 3.08Å; T244-R246 HydrophobicContact CG2-CG 4.15Å; T244-P252 HydrophobicContact CG2-CB 3.73Å; T244-A253 CarbonylContact C-O 3.53Å; T244-A253 WeakPolarHBondContact CA-O 3.29Å
245	L	91	Very high	84.5	Confident	9 Å²	9	70.9 Å²	70.9	5%	0.047	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	127.8	172.4	-173.6	66.3	0	0	0	109.7	L51 L210 T213 L229 L247 P252 A253 L255	L51-L245 HydrophobicContact CD1-CD1 4.09Å; L210-L245 HydrophobicContact CD1-CB 4.2Å; L210-L245 HydrophobicContact CD1-CD2 3.74Å; T213-L245 HydrophobicContact CG2-CD2 3.82Å; L229-L245 HydrophobicContact CB-CD1 4.39Å; L245-L247 HydrophobicContact CD1-CD2 4.44Å; L245-L247 HydrophobicContact CD2-CD1 4.04Å; L245-L247 HydrophobicContact CD2-CD2 4.4Å; L245-L247 HydrophobicContact CD2-CG 4.03Å; L245-L247 HydrophobicContact CG-CD2 4.41Å; L245-L247 HydrophobicContact CG-CG 4.08Å; L245-P252 WeakPolarHBondContact O-CA 3.49Å; L245-A253 PolarHBondContact N-O 2.83Å; L245-A253 PolarHBondContact O-N 3.34Å; L245-L255 HydrophobicContact CB-CD1 4.14Å; L245-L255 HydrophobicContact CB-CG 4.43Å
246	R	89.8	Confident	84.6	Confident	89 Å²	89	70.2 Å²	70.2	34%	0.336	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	94.4	174.6	-63.4	-173.2	-173.5	154	8.4	109.6	G227 H228 E230 T244 P252	G227-R246 CarbonylContact C-O 3.42Å; G227-R246 WeakPolarHBondContact CA-O 3.45Å; H228-R246 PolarHBondContact N-O 2.76Å; H228-R246 WeakPolarHBondContact NE2-CD 3.25Å; H228-R246 PolarHBondContact NE2-NH1 3.16Å; H228-R246 VanDerWaalsContact NE2-NH1 3.18Å; H228-R246 PolarHBondContact O-N 2.9Å; E230-R246 VanDerWaalsContact CD-CZ 3.45Å; E230-R246 IonicContact OE1-CZ 2.68Å; E230-R246 VanDerWaalsContact OE1-CZ 3.28Å; E230-R246 IonicContact OE1-NE 2.67Å; E230-R246 IonicContact OE1-NH1 3.84Å; E230-R246 PolarHBondContact OE1-NH1 2.91Å; E230-R246 IonicContact OE1-NH2 3.28Å; E230-R246 IonicContact OE2-CZ 3.28Å; E230-R246 IonicContact OE2-NE 2.99Å; E230-R246 IonicContact OE2-NH1 2.73Å; E230-R246 PolarHBondContact OE2-NH1 3.31Å; E230-R246 IonicContact OE2-NH2 2.98Å; E230-R246 PolarHBondContact OE2-NH2 3.13Å; T244-R246 HydrophobicContact CG2-CG 4.15Å; R246-P252 HydrophobicContact CG-CB 4.1Å; R246-P252 HydrophobicContact CG-CG 4.28Å
247	L	86.3	Confident	85	Confident	15 Å²	15	63.9 Å²	63.9	8%	0.079	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	149.6	172.3	-65.1	174.2	0	0	0	110.6	L51 L212 T213 F216 L225 L245 N249 Q250	L51-L247 HydrophobicContact CD1-CD2 3.67Å; L212-L247 HydrophobicContact CD2-CD1 4.18Å; L212-L247 HydrophobicContact CG-CD1 4.35Å; T213-L247 HydrophobicContact CG2-CD1 4.08Å; F216-L247 HydrophobicContact CE2-CD1 4.27Å; L225-L247 HydrophobicContact CD1-CD1 4.32Å; L225-L247 HydrophobicContact CD1-CD2 3.73Å; L225-L247 HydrophobicContact CG-CD2 4.17Å; L245-L247 HydrophobicContact CD1-CD2 4.44Å; L245-L247 HydrophobicContact CD2-CD1 4.04Å; L245-L247 HydrophobicContact CD2-CD2 4.4Å; L245-L247 HydrophobicContact CD2-CG 4.03Å; L245-L247 HydrophobicContact CG-CD2 4.41Å; L245-L247 HydrophobicContact CG-CG 4.08Å; L247-N249 PolarHBondContact O-N 2.59Å; L247-Q250 HydrophobicContact CB-CB 4.27Å; L247-Q250 VanDerWaalsContact CD1-OE1 3.26Å; L247-Q250 PolarHBondContact O-N 2.83Å
248	V	80.4	Confident	85.3	Confident	82 Å²	82	61.8 Å²	61.8	50%	0.497	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	132	-179.9	173.4	0	0	0	0	110.4	S226 Q250	S226-V248 PolarHBondContact O-N 2.62Å; V248-Q250 PolarHBondContact O-N 3.1Å
249	N	74.5	Confident	86.1	Confident	166 Å²	166	61.3 Å²	61.3	89%	0.888	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	21.7	-179	-55.5	-22.8	0	0	0	115.6	L247	L247-N249 PolarHBondContact O-N 2.59Å
250	Q	78.6	Confident	86.7	Confident	81 Å²	81	56 Å²	56	38%	0.379	32%	0.317	S	S	.	.	S	Bend	trans	-126.2	158.3	175.5	-65.5	-178.1	-16	0	0	111.4	L247 V248	L247-Q250 HydrophobicContact CB-CB 4.27Å; L247-Q250 VanDerWaalsContact CD1-OE1 3.26Å; L247-Q250 PolarHBondContact O-N 2.83Å; V248-Q250 PolarHBondContact O-N 3.1Å
251	N	81.1	Confident	87.1	Confident	143 Å²	143	51.7 Å²	51.7	77%	0.765	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-67.6	146.1	175.9	-73.7	-16.5	0	0	0	110.8	A253	N251-A253 PolarHBondContact O-N 3.38Å
252	P	84.8	Confident	87.3	Confident	80 Å²	80	51.8 Å²	51.8	52%	0.519	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-57.9	128	173.3	-23	33.7	0	0	0	111.5	T244 L245 R246	T244-P252 HydrophobicContact CG2-CB 3.73Å; L245-P252 WeakPolarHBondContact O-CA 3.49Å; R246-P252 HydrophobicContact CG-CB 4.1Å; R246-P252 HydrophobicContact CG-CG 4.28Å
253	A	86.1	Confident	87.3	Confident	13 Å²	13	47.6 Å²	47.6	11%	0.107	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	128.1	176.1	0	0	0	0	0	109.9	L210 L212 T244 L245 N251	L210-A253 HydrophobicContact CD1-CB 3.67Å; L210-A253 HydrophobicContact CD2-CB 4.41Å; L212-A253 HydrophobicContact CD2-CB 4.2Å; T244-A253 CarbonylContact C-O 3.53Å; T244-A253 WeakPolarHBondContact CA-O 3.29Å; L245-A253 PolarHBondContact N-O 2.83Å; L245-A253 PolarHBondContact O-N 3.34Å; N251-A253 PolarHBondContact O-N 3.38Å
254	P	90.4	Very high	86.8	Confident	101 Å²	101	47.8 Å²	47.8	66%	0.656	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	150.6	173.5	30.4	-34.7	0	0	0	110.5
255	L	88.9	Confident	86.6	Confident	6 Å²	6	45.8 Å²	45.8	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	124.3	172.8	-67.3	169.7	0	0	0	109	V180 L210 L229 F241 G243 L245 Q259	V180-L255 HydrophobicContact CG1-CD1 4.02Å; V180-L255 HydrophobicContact CG1-CD2 3.99Å; V180-L255 HydrophobicContact CG2-CD1 4.21Å; L210-L255 HydrophobicContact CD1-CD2 3.62Å; L210-L255 HydrophobicContact CD2-CD2 4.18Å; L210-L255 HydrophobicContact CG-CD2 3.81Å; L229-L255 HydrophobicContact CD1-CD1 3.28Å; F241-L255 HydrophobicContact CE1-CB 4.1Å; G243-L255 PolarHBondContact N-O 2.95Å; G243-L255 PolarHBondContact O-N 3.36Å; L245-L255 HydrophobicContact CB-CD1 4.14Å; L245-L255 HydrophobicContact CB-CG 4.43Å; L255-Q259 HydrophobicContact CD2-CB 3.72Å; L255-Q259 HydrophobicContact CD2-CG 3.74Å
256	G	87.7	Confident	86.5	Confident	19 Å²	19	46.7 Å²	46.7	20%	0.196	26%	0.262	C	S	.	.			trans	-101	-172.6	170.1	0	0	0	0	0	112.2	F241 D258 Q259	F241-G256 CarbonylContact O-C 3.53Å; F241-G256 WeakPolarHBondContact O-CA 3.49Å; G256-D258 PolarHBondContact O-N 3.02Å; G256-Q259 PolarHBondContact O-N 3.27Å
257	P	86.5	Confident	86.5	Confident	36 Å²	36	42.4 Å²	42.4	23%	0.234	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-62.6	-21.6	174.6	28.8	-37.3	0	0	0	113.3	Y239 F241 Q259 V260	Y239-P257 WeakPolarHBondContact O-CB 3.41Å; Y239-P257 VanDerWaalsContact O-CG 3.27Å; Y239-P257 WeakPolarHBondContact O-CG 3.24Å; F241-P257 HydrophobicContact CB-CB 4.3Å; P257-Q259 VanDerWaalsContact C-N 3.27Å; P257-Q259 PolarHBondContact O-N 3.43Å; P257-V260 PolarHBondContact O-N 2.75Å; P257-V260 VanDerWaalsContact O-N 3.13Å
258	D	85.8	Confident	86.3	Confident	55 Å²	55	45.8 Å²	45.8	29%	0.294	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-74.8	-17.2	-175.1	-57.5	-39.5	0	0	0	114.1	R207 Q208 G256 V1160	R207-D258 WeakPolarHBondContact CB-O 3.37Å; R207-D258 WeakPolarHBondContact CD-O 3.43Å; R207-D258 IonicContact CZ-OD1 2.72Å; R207-D258 IonicContact NH1-OD1 3.13Å; R207-D258 PolarHBondContact NH1-OD1 2.81Å; Q208-D258 PolarHBondContact N-O 3.13Å; G256-D258 PolarHBondContact O-N 3.02Å; D258-V1160 HydrophobicContact CB-CB 4.43Å; D258-V1160 HydrophobicContact CB-CG1 3.74Å; D258-V1160 HydrophobicContact CB-CG2 3.77Å; D258-V1160 VanDerWaalsContact CG-CG2 3.47Å; D258-V1160 VanDerWaalsContact OD1-CG2 3.23Å; D258-V1160 WeakPolarHBondContact OD1-CG2 3.29Å
259	Q	92	Very high	86.1	Confident	28 Å²	28	43.6 Å²	43.6	13%	0.131	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-93.2	1.1	173.1	-69.7	68.5	65.6	0	0	112.1	V180 I181 Q208 L210 L255 G256 P257	V180-Q259 CarbonylContact C-O 3.59Å; V180-Q259 WeakPolarHBondContact CA-O 3.33Å; I181-Q259 WeakPolarHBondContact CG1-O 3.15Å; I181-Q259 PolarHBondContact N-O 3.31Å; Q208-Q259 WeakPolarHBondContact O-CG 3.47Å; Q208-Q259 PolarHBondContact O-NE2 3.12Å; L210-Q259 HydrophobicContact CD2-CG 4.18Å; L210-Q259 HydrophobicContact CG-CG 4.24Å; L255-Q259 HydrophobicContact CD2-CB 3.72Å; L255-Q259 HydrophobicContact CD2-CG 3.74Å; G256-Q259 PolarHBondContact O-N 3.27Å; P257-Q259 VanDerWaalsContact C-N 3.27Å; P257-Q259 PolarHBondContact O-N 3.43Å
260	V	92.3	Very high	86.5	Confident	7 Å²	7	35.7 Å²	35.7	4%	0.042	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.1	-173	-179	0	0	0	0	112	M179 V180 F241 P257 L262	M179-V260 WeakPolarHBondContact O-CA 3.47Å; V180-V260 HydrophobicContact CG2-CG2 4.13Å; F241-V260 HydrophobicContact CB-CG2 4.41Å; F241-V260 HydrophobicContact CD1-CG2 3.47Å; F241-V260 VanDerWaalsContact CD1-CG2 3.47Å; F241-V260 HydrophobicContact CD2-CG2 4.19Å; F241-V260 HydrophobicContact CE1-CG2 3.61Å; F241-V260 HydrophobicContact CE2-CG2 4.31Å; F241-V260 HydrophobicContact CG-CG2 3.76Å; F241-V260 HydrophobicContact CZ-CG2 4.03Å; P257-V260 PolarHBondContact O-N 2.75Å; P257-V260 VanDerWaalsContact O-N 3.13Å; V260-L262 HydrophobicContact CG1-CD2 3.79Å
261	L	93.6	Very high	86.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	128.6	170	-47.5	-176.7	0	0	0	109.1	L175 D178 M179 I181 I193 R207 V273	L175-L261 HydrophobicContact CD1-CB 3.61Å; L175-L261 HydrophobicContact CD2-CB 4Å; L175-L261 HydrophobicContact CD2-CD1 3.92Å; L175-L261 HydrophobicContact CG-CB 4.44Å; D178-L261 WeakPolarHBondContact CA-O 3.48Å; M179-L261 HydrophobicContact CG-CB 3.91Å; M179-L261 HydrophobicContact CG-CG 4.5Å; M179-L261 PolarHBondContact N-O 2.84Å; M179-L261 PolarHBondContact O-N 2.9Å; M179-L261 HydrophobicContact SD-CD1 4.28Å; I181-L261 HydrophobicContact CD1-CD2 3.8Å; I181-L261 HydrophobicContact CD1-CG 4.17Å; I181-L261 HydrophobicContact CG1-CD1 4.02Å; I181-L261 HydrophobicContact CG1-CD2 3.94Å; I181-L261 HydrophobicContact CG1-CG 3.71Å; I193-L261 HydrophobicContact CD1-CD2 4.19Å; I193-L261 HydrophobicContact CG2-CD2 3.99Å; R207-L261 HydrophobicContact CB-CD2 3.8Å; R207-L261 HydrophobicContact CG-CD2 3.88Å; L261-V273 HydrophobicContact CD1-CG1 3.83Å; L261-V273 HydrophobicContact CD1-CG2 4.11Å
262	L	92.1	Very high	87.4	Confident	13 Å²	13	29.1 Å²	29.1	7%	0.068	16%	0.164	C	C	.	.			trans	-98.1	143	-173.6	-60.5	178.9	0	0	0	112.4	L175 D178 L198 L238 V260 G264 A265 K285	L175-L262 VanDerWaalsContact CD1-O 3.24Å; L175-L262 WeakPolarHBondContact CD1-O 3.39Å; D178-L262 HydrophobicContact CB-CD2 4.29Å; L198-L262 HydrophobicContact CD1-CB 3.76Å; L198-L262 HydrophobicContact CD1-CD1 4.49Å; L198-L262 HydrophobicContact CD2-CB 4.01Å; L198-L262 HydrophobicContact CD2-CD1 4.29Å; L238-L262 HydrophobicContact CD2-CD1 3.98Å; V260-L262 HydrophobicContact CG1-CD2 3.79Å; L262-G264 PolarHBondContact O-N 2.78Å; L262-A265 PolarHBondContact O-N 2.68Å; L262-K285 HydrophobicContact CD1-CD 4.34Å; L262-K285 HydrophobicContact CD2-CB 4.37Å; L262-K285 HydrophobicContact CD2-CD 3.83Å; L262-K285 HydrophobicContact CD2-CG 4.11Å
263	R	88.9	Confident	87.8	Confident	7 Å²	7	25.3 Å²	25.3	3%	0.026	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	127.6	174.5	-176.8	178.6	172.2	133.8	-1.6	110.1	N62 P176 D178 L286	N62-R263 VanDerWaalsContact CG-NH1 3.26Å; N62-R263 PolarHBondContact ND2-NH1 3.09Å; N62-R263 PolarHBondContact O-NH1 2.83Å; N62-R263 PolarHBondContact OD1-NH1 3.39Å; P176-R263 PolarHBondContact O-NH1 2.86Å; D178-R263 VanDerWaalsContact OD1-CB 3.29Å; D178-R263 WeakPolarHBondContact OD1-CB 3.5Å; D178-R263 PolarHBondContact OD1-N 2.77Å; R263-L286 WeakPolarHBondContact O-CB 3.38Å; R263-L286 WeakPolarHBondContact O-CD2 3.27Å
264	G	80.9	Confident	88.2	Confident	11 Å²	11	24.8 Å²	24.8	11%	0.113	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	112.4	-41.5	-178.7	0	0	0	0	0	112.8	H174 N197 L262	H174-G264 PolarHBondContact ND1-O 3.44Å; N197-G264 WeakPolarHBondContact CB-O 3.23Å; L262-G264 PolarHBondContact O-N 2.78Å
265	A	87.9	Confident	88.4	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.			trans	-60.1	152.8	174.2	0	0	0	0	0	111.6	H174 L175 I193 E194 T195 L198 L262	H174-A265 WeakPolarHBondContact CA-O 3.13Å; L175-A265 HydrophobicContact CD1-CB 3.85Å; L175-A265 PolarHBondContact N-O 3.24Å; I193-A265 HydrophobicContact CB-CB 4.22Å; I193-A265 HydrophobicContact CD1-CB 4.29Å; E194-A265 VanDerWaalsContact O-CA 3.23Å; E194-A265 WeakPolarHBondContact O-CA 3.34Å; E194-A265 VanDerWaalsContact O-CB 3.26Å; E194-A265 WeakPolarHBondContact O-CB 3.44Å; T195-A265 HydrophobicContact CG2-CB 4.27Å; L198-A265 HydrophobicContact CD1-CB 3.64Å; L262-A265 PolarHBondContact O-N 2.68Å
266	Q	88.1	Confident	88.6	Confident	28 Å²	28	20 Å²	20	13%	0.131	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	132.4	-178.4	-168.3	174.6	4.4	0	0	109.6	G172 I193 E194 R268	G172-Q266 PolarHBondContact O-NE2 2.86Å; I193-Q266 WeakPolarHBondContact CA-O 3.45Å; E194-Q266 HydrophobicContact CB-CB 4.33Å; E194-Q266 PolarHBondContact N-O 3.16Å; E194-Q266 PolarHBondContact O-N 3.34Å; E194-Q266 VanDerWaalsContact O-N 3.08Å; E194-Q266 PolarHBondContact OE2-OE1 2.87Å; Q266-R268 PolarHBondContact O-N 3.13Å
267	L	89	Confident	88.9	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	128.2	173.4	-167.4	72.3	0	0	0	108.9	V169 G172 Q173 C191 I193 T270 V273	V169-L267 HydrophobicContact CG1-CB 4.35Å; V169-L267 WeakPolarHBondContact O-CD2 3.43Å; G172-L267 WeakPolarHBondContact CA-O 3.14Å; G172-L267 PolarHBondContact N-O 3.02Å; Q173-L267 PolarHBondContact O-N 3.08Å; C191-L267 HydrophobicContact CB-CD1 4.04Å; I193-L267 HydrophobicContact CG2-CD1 4.34Å; L267-T270 HydrophobicContact CD1-CG2 4.17Å; L267-T270 HydrophobicContact CD2-CG2 4.26Å; L267-T270 HydrophobicContact CG-CG2 4.45Å; L267-V273 HydrophobicContact CD1-CB 4.19Å; L267-V273 HydrophobicContact CD1-CG1 3.83Å; L267-V273 HydrophobicContact CD2-CB 4.27Å; L267-V273 HydrophobicContact CD2-CG1 3.93Å
268	R	82.5	Confident	89.3	Confident	86 Å²	86	17.5 Å²	17.5	33%	0.325	8%	0.084	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	159.6	176.8	-65	-63.1	-166.4	158.8	7.2	109.7	N171 Y192 E194 L204 Q266 T270	N171-R268 WeakPolarHBondContact OD1-CA 3.29Å; Y192-R268 WeakPolarHBondContact CB-O 3.47Å; Y192-R268 PolarHBondContact O-N 2.82Å; Y192-R268 VanDerWaalsContact O-O 3.06Å; E194-R268 HydrophobicContact CB-CG 3.91Å; E194-R268 IonicContact OE2-CZ 2.73Å; E194-R268 IonicContact OE2-NE 3.16Å; E194-R268 PolarHBondContact OE2-NE 3.2Å; E194-R268 IonicContact OE2-NH2 3.6Å; E194-R268 PolarHBondContact OE2-NH2 3Å; L204-R268 HydrophobicContact CD1-CB 4.23Å; L204-R268 HydrophobicContact CD2-CB 3.76Å; L204-R268 HydrophobicContact CD2-CG 3.79Å; Q266-R268 PolarHBondContact O-N 3.13Å; R268-T270 VanDerWaalsContact O-CB 3.28Å; R268-T270 WeakPolarHBondContact O-CB 3.39Å; R268-T270 PolarHBondContact O-N 2.7Å; R268-T270 PolarHBondContact O-OG1 2.83Å
269	N	75.8	Confident	89.7	Confident	35 Å²	35	15 Å²	15	19%	0.187	7%	0.071	C	C	.	.	S	Bend	trans	46.4	26.9	170.4	-50.9	10.6	0	0	0	114.8	N171 Y192 L204 Q514	N171-N269 PolarHBondContact OD1-N 3.36Å; Y192-N269 HydrophobicContact CD2-CB 4.19Å; Y192-N269 HydrophobicContact CG-CB 4.37Å; L204-N269 WeakPolarHBondContact CD1-ND2 3.2Å; N269-Q514 PolarHBondContact ND2-NE2 2.9Å; N269-Q514 PolarHBondContact ND2-OE1 3.17Å
270	T	84.4	Confident	89.8	Confident	1 Å²	1	13.6 Å²	13.6	1%	0.006	7%	0.065	C	C	.	.			trans	-146.6	117.8	-171.6	-49.6	0	0	0	0	105	N171 S184 E186 C191 Y192 L267 R268 W272	N171-T270 WeakPolarHBondContact CA-O 3.47Å; N171-T270 WeakPolarHBondContact CB-O 3.21Å; N171-T270 PolarHBondContact N-O 2.69Å; S184-T270 VanDerWaalsContact OG-CG2 3.25Å; S184-T270 WeakPolarHBondContact OG-CG2 3.42Å; E186-T270 HydrophobicContact CG-CG2 4.3Å; C191-T270 HydrophobicContact CB-CG2 3.75Å; Y192-T270 PolarHBondContact N-OG1 2.73Å; L267-T270 HydrophobicContact CD1-CG2 4.17Å; L267-T270 HydrophobicContact CD2-CG2 4.26Å; L267-T270 HydrophobicContact CG-CG2 4.45Å; R268-T270 VanDerWaalsContact O-CB 3.28Å; R268-T270 WeakPolarHBondContact O-CB 3.39Å; R268-T270 PolarHBondContact O-N 2.7Å; R268-T270 PolarHBondContact O-OG1 2.83Å; T270-W272 VanDerWaalsContact C-N 3.33Å; T270-W272 PolarHBondContact O-N 2.83Å
271	Q	85.8	Confident	89.6	Confident	72 Å²	72	13.3 Å²	13.3	34%	0.336	6%	0.062	S	C	.	.	S	Bend	trans	-62.9	-43.1	-174.5	-68.5	-167.5	-14.8	0	0	111.7	T170 N171 S185	T170-Q271 CarbonylContact C-O 3.6Å; T170-Q271 VanDerWaalsContact CA-O 3.31Å; T170-Q271 WeakPolarHBondContact CA-O 3.45Å; N171-Q271 PolarHBondContact N-O 3.18Å; S185-Q271 PolarHBondContact OG-N 2.98Å
272	W	91.1	Very high	89.3	Confident	13 Å²	13	17.3 Å²	17.3	5%	0.049	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	151.9	176.2	57.5	-94.7	0	0	0	111.7	K168 V169 S184 S185 Q217 T270 V274 L1179	K168-W272 HydrophobicContact CG-CB 4.29Å; V169-W272 CarbonylContact O-C 3.55Å; V169-W272 VanDerWaalsContact O-CA 3.25Å; V169-W272 WeakPolarHBondContact O-CA 3.46Å; S184-W272 WeakPolarHBondContact O-CH2 3.5Å; S184-W272 PolarHBondContact OG-O 2.97Å; S185-W272 PolarHBondContact N-O 3.12Å; Q217-W272 HydrophobicContact CB-CH2 4.39Å; Q217-W272 HydrophobicContact CG-CH2 4.27Å; T270-W272 VanDerWaalsContact C-N 3.33Å; T270-W272 PolarHBondContact O-N 2.83Å; W272-V274 HydrophobicContact CE3-CG2 3.88Å; W272-V274 HydrophobicContact CZ3-CG2 3.9Å; W272-L1179 HydrophobicContact CH2-CD1 4.48Å; W272-L1179 HydrophobicContact CZ2-CD1 3.61Å
273	V	94.1	Very high	89.3	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	144.8	166.3	73.3	0	0	0	0	109.5	K168 V169 I181 S183 C191 L261 L267	K168-V273 WeakPolarHBondContact CA-O 3.4Å; V169-V273 HydrophobicContact CB-CG1 4.18Å; V169-V273 PolarHBondContact N-O 3.06Å; V169-V273 PolarHBondContact O-N 2.79Å; I181-V273 HydrophobicContact CG2-CG2 4.04Å; S183-V273 WeakPolarHBondContact O-CG2 3.39Å; C191-V273 HydrophobicContact CB-CG2 4.32Å; L261-V273 HydrophobicContact CD1-CG1 3.83Å; L261-V273 HydrophobicContact CD1-CG2 4.11Å; L267-V273 HydrophobicContact CD1-CB 4.19Å; L267-V273 HydrophobicContact CD1-CG1 3.83Å; L267-V273 HydrophobicContact CD2-CB 4.27Å; L267-V273 HydrophobicContact CD2-CG1 3.93Å
274	V	94.3	Very high	89.3	Confident	3 Å²	3	17.8 Å²	17.8	2%	0.018	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	128	173.8	177.3	0	0	0	0	109.1	W153 I166 V167 K168 V182 S183 L222 W272	W153-V274 HydrophobicContact CH2-CG1 4.39Å; W153-V274 HydrophobicContact CH2-CG2 4.2Å; I166-V274 HydrophobicContact CG2-CG1 3.5Å; V167-V274 WeakPolarHBondContact O-CA 3.38Å; K168-V274 HydrophobicContact CB-CG2 4.25Å; K168-V274 HydrophobicContact CG-CG2 4.29Å; V182-V274 HydrophobicContact CB-CG1 4.46Å; V182-V274 PolarHBondContact N-O 3Å; S183-V274 PolarHBondContact N-O 3.31Å; S183-V274 PolarHBondContact O-N 3.14Å; L222-V274 HydrophobicContact CD1-CG1 4.02Å; L222-V274 HydrophobicContact CD1-CG2 4.35Å; L222-V274 HydrophobicContact CD2-CG1 3.89Å; W272-V274 HydrophobicContact CE3-CG2 3.88Å; W272-V274 HydrophobicContact CZ3-CG2 3.9Å
275	G	93.8	Very high	89.5	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	155.5	-178.8	0	0	0	0	0	114.4	I166 V167 V180	I166-G275 WeakPolarHBondContact CA-O 3.41Å; V167-G275 PolarHBondContact N-O 2.81Å; V167-G275 PolarHBondContact O-N 3.08Å; V180-G275 CarbonylContact O-C 3.48Å; V180-G275 WeakPolarHBondContact O-CA 3.35Å
276	I	93.9	Very high	89.3	Confident	5 Å²	5	19.1 Å²	19.1	3%	0.026	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	126.8	178.1	-61.3	147.8	0	0	0	109.1	L51 I166 M179 V180 V182 L225	L51-I276 HydrophobicContact CD2-CD1 3.72Å; L51-I276 HydrophobicContact CD2-CG1 4.33Å; L51-I276 HydrophobicContact CD2-CG2 4.07Å; I166-I276 HydrophobicContact CG1-CG1 3.99Å; M179-I276 CarbonylContact C-O 3.58Å; M179-I276 WeakPolarHBondContact CA-O 3.35Å; M179-I276 VanDerWaalsContact CB-O 3.29Å; M179-I276 WeakPolarHBondContact CB-O 3.25Å; V180-I276 PolarHBondContact N-O 3.39Å; V180-I276 PolarHBondContact O-N 2.98Å; V182-I276 HydrophobicContact CG2-CD1 3.45Å; V182-I276 VanDerWaalsContact CG2-CD1 3.45Å; V182-I276 HydrophobicContact CG2-CG1 3.67Å; L225-I276 HydrophobicContact CD2-CD1 4.16Å
277	V	94.9	Very high	89	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	133	-178.3	176.8	0	0	0	0	112.3	V161 G164 D165 V167 A177 M179 T280	V161-V277 HydrophobicContact CG1-CG1 4.29Å; V161-V277 HydrophobicContact CG1-CG2 3.87Å; G164-V277 PolarHBondContact N-O 2.83Å; D165-V277 PolarHBondContact O-N 3Å; V167-V277 HydrophobicContact CG2-CG2 3.5Å; V167-V277 VanDerWaalsContact CG2-CG2 3.5Å; A177-V277 HydrophobicContact CB-CG1 3.57Å; A177-V277 HydrophobicContact CB-CG2 4.2Å; M179-V277 HydrophobicContact CE-CG2 4.46Å; V277-T280 HydrophobicContact CG1-CG2 3.54Å
278	V	93.8	Very high	88.5	Confident	3 Å²	3	22.2 Å²	22.2	2%	0.018	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	-43.9	-176.3	-170.9	0	0	0	0	112.7	R47 V163 D178 V180 L229 C231	R47-V278 PolarHBondContact NH1-O 3.38Å; R47-V278 VanDerWaalsContact NH1-O 3.11Å; V163-V278 WeakPolarHBondContact CG2-O 3.4Å; D178-V278 PolarHBondContact O-N 3.21Å; V180-V278 HydrophobicContact CG2-CG2 3.85Å; L229-V278 HydrophobicContact CD2-CG1 4.49Å; L229-V278 HydrophobicContact CD2-CG2 3.61Å; C231-V278 VanDerWaalsContact SG-CG1 3.52Å
279	Y	93.9	Very high	88	Confident	2 Å²	2	21.3 Å²	21.3	1%	0.008	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.5	178.7	-49.1	-53.3	0	0	0	111.5	D178 E232 P234 F241	D178-Y279 HydrophobicContact CB-CD2 3.98Å; D178-Y279 HydrophobicContact CB-CG 4.43Å; D178-Y279 PolarHBondContact N-O 3.13Å; D178-Y279 PolarHBondContact O-N 3.34Å; E232-Y279 PolarHBondContact O-OH 3.25Å; P234-Y279 HydrophobicContact CB-CD1 3.77Å; P234-Y279 HydrophobicContact CB-CE1 3.77Å; P234-Y279 HydrophobicContact CB-CG 4.29Å; P234-Y279 HydrophobicContact CG-CE1 4.5Å; F241-Y279 HydrophobicContact CD2-CE2 4.28Å; F241-Y279 AromaticContact CE2-CE2 3.96Å; F241-Y279 HydrophobicContact CE2-CE2 3.96Å
280	T	93.9	Very high	87.5	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.116	C	C	.	.			trans	-118.4	146.9	-174.9	40.3	0	0	0	0	111.9	C60 N62 V163 A177 V277 H282 D283	C60-T280 PolarHBondContact O-OG1 3.21Å; N62-T280 HydrophobicContact CB-CG2 3.94Å; N62-T280 WeakPolarHBondContact OD1-CA 3.49Å; V163-T280 HydrophobicContact CG2-CG2 3.96Å; V163-T280 WeakPolarHBondContact CG2-OG1 3.43Å; A177-T280 HydrophobicContact CB-CG2 4.24Å; V277-T280 HydrophobicContact CG1-CG2 3.54Å; T280-H282 PolarHBondContact O-N 3.3Å; T280-D283 WeakPolarHBondContact O-CB 3.5Å; T280-D283 PolarHBondContact O-N 3.23Å
281	G	89.9	Confident	86.3	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	57.1	-124.9	172.3	0	0	0	0	0	111.7	D61 N62 D283 S284 M287	D61-G281 WeakPolarHBondContact O-CA 3.36Å; N62-G281 PolarHBondContact OD1-N 2.95Å; G281-D283 VanDerWaalsContact C-N 3.26Å; G281-D283 PolarHBondContact O-N 3.35Å; G281-S284 PolarHBondContact O-N 3.02Å; G281-S284 PolarHBondContact O-OG 3.25Å; G281-M287 WeakPolarHBondContact O-CB 3.37Å; G281-M287 VanDerWaalsContact O-CG 3.26Å; G281-M287 WeakPolarHBondContact O-CG 3.37Å
282	H	86.4	Confident	85.3	Confident	84 Å²	84	32.6 Å²	32.6	39%	0.389	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-73.6	-9.7	179.5	-73.4	-87	0	0	0	114.8	S65 T280 S284	S65-H282 PolarHBondContact N-NE2 3.26Å; T280-H282 PolarHBondContact O-N 3.3Å; H282-S284 VanDerWaalsContact C-N 3.32Å
283	D	91.3	Very high	83.9	Confident	30 Å²	30	35.9 Å²	35.9	16%	0.16	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-74.2	-24.1	169.1	-69.8	-9.2	0	0	0	112	R47 C60 P234 T280 G281	R47-D283 IonicContact CZ-OD2 2.92Å; R47-D283 VanDerWaalsContact CZ-OD2 3.25Å; R47-D283 IonicContact NH1-OD2 2.73Å; R47-D283 PolarHBondContact NH1-OD2 3.45Å; R47-D283 IonicContact NH2-OD2 3.85Å; R47-D283 PolarHBondContact NH2-OD2 3.3Å; C60-D283 HydrophobicContact CB-CB 4.5Å; P234-D283 HydrophobicContact CB-CB 4.09Å; P234-D283 WeakPolarHBondContact CB-O 3.39Å; P234-D283 HydrophobicContact CG-CB 4.32Å; T280-D283 WeakPolarHBondContact O-CB 3.5Å; T280-D283 PolarHBondContact O-N 3.23Å; G281-D283 VanDerWaalsContact C-N 3.26Å; G281-D283 PolarHBondContact O-N 3.35Å
284	S	89.2	Confident	82.7	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.205	C	C	.	.	S	Bend	trans	-66.7	144.5	-174.4	63.8	0	0	0	0	112.7	D178 G281 H282 L286 M287 Q288	D178-S284 WeakPolarHBondContact OD2-CA 3.37Å; D178-S284 WeakPolarHBondContact OD2-CB 3.35Å; G281-S284 PolarHBondContact O-N 3.02Å; G281-S284 PolarHBondContact O-OG 3.25Å; H282-S284 VanDerWaalsContact C-N 3.32Å; S284-L286 VanDerWaalsContact C-N 3.25Å; S284-L286 PolarHBondContact O-N 3.5Å; S284-M287 WeakPolarHBondContact O-CA 3.3Å; S284-M287 PolarHBondContact O-N 3.41Å; S284-M287 WeakPolarHBondContact OG-CG 3.45Å; S284-Q288 PolarHBondContact O-N 3.47Å
285	K	86.3	Confident	81.5	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.009	24%	0.236	C	C	.	.	H	α-helix	trans	-58.4	-35.7	-173.5	-61.8	-160.5	180	-178	0	113.1	D178 H237 L238 D240 L262 Q288 N289	D178-K285 PolarHBondContact OD2-N 3.18Å; H237-K285 WeakPolarHBondContact O-CD 3.41Å; H237-K285 WeakPolarHBondContact O-CE 3.17Å; H237-K285 PolarHBondContact O-NZ 3.09Å; L238-K285 HydrophobicContact CD2-CB 4.2Å; L238-K285 PolarHBondContact O-NZ 2.95Å; D240-K285 PolarHBondContact O-NZ 3.34Å; L262-K285 HydrophobicContact CD1-CD 4.34Å; L262-K285 HydrophobicContact CD2-CB 4.37Å; L262-K285 HydrophobicContact CD2-CD 3.83Å; L262-K285 HydrophobicContact CD2-CG 4.11Å; K285-Q288 PolarHBondContact O-N 2.95Å; K285-N289 PolarHBondContact O-N 3.03Å; K285-N289 VanDerWaalsContact O-N 3.08Å; K285-N289 PolarHBondContact O-ND2 3.33Å
286	L	82.9	Confident	80.8	Confident	37 Å²	37	46 Å²	46	19%	0.194	24%	0.242	C	C	.	.	H	α-helix	trans	-59.9	-44.8	173.1	179.1	66.6	0	0	0	111.6	N197 L198 R263 S284 N289 S290	N197-L286 WeakPolarHBondContact O-CD1 3.34Å; L198-L286 HydrophobicContact CD2-CB 4.03Å; L198-L286 HydrophobicContact CD2-CD1 4.11Å; R263-L286 WeakPolarHBondContact O-CB 3.38Å; R263-L286 WeakPolarHBondContact O-CD2 3.27Å; S284-L286 VanDerWaalsContact C-N 3.25Å; S284-L286 PolarHBondContact O-N 3.5Å; L286-N289 PolarHBondContact O-N 2.98Å; L286-S290 PolarHBondContact O-N 3.45Å; L286-S290 VanDerWaalsContact O-N 3.11Å
287	M	81.4	Confident	80.2	Confident	20 Å²	20	53.1 Å²	53.1	10%	0.099	27%	0.269	C	S	.	.	H	α-helix	trans	-76	-30.7	-178.7	-66.9	-55.3	-51.9	0	0	112.7	V64 G281 S284 N289 S290	V64-M287 HydrophobicContact CB-CE 4.46Å; V64-M287 HydrophobicContact CB-SD 4.35Å; V64-M287 HydrophobicContact CG1-CE 3.65Å; V64-M287 HydrophobicContact CG1-SD 3.69Å; V64-M287 HydrophobicContact CG2-CE 4.15Å; V64-M287 HydrophobicContact CG2-CG 3.8Å; V64-M287 HydrophobicContact CG2-SD 3.67Å; G281-M287 WeakPolarHBondContact O-CB 3.37Å; G281-M287 VanDerWaalsContact O-CG 3.26Å; G281-M287 WeakPolarHBondContact O-CG 3.37Å; S284-M287 WeakPolarHBondContact O-CA 3.3Å; S284-M287 PolarHBondContact O-N 3.41Å; S284-M287 WeakPolarHBondContact OG-CG 3.45Å; M287-N289 VanDerWaalsContact C-N 3.32Å; M287-S290 WeakPolarHBondContact CE-OG 3.33Å; M287-S290 WeakPolarHBondContact O-CB 3.4Å; M287-S290 PolarHBondContact O-N 2.71Å; M287-S290 PolarHBondContact O-OG 3.13Å
288	Q	79.4	Confident	79.7	Confident	74 Å²	74	53.1 Å²	53.1	35%	0.346	27%	0.269	S	S	.	.	H	α-helix	trans	-66.3	-33.3	170.3	-70.1	-147.6	3.2	0	0	113	P234 S284 K285 S290	P234-Q288 VanDerWaalsContact C-NE2 3.26Å; P234-Q288 PolarHBondContact O-NE2 3.33Å; P234-Q288 PolarHBondContact O-OE1 3.15Å; S284-Q288 PolarHBondContact O-N 3.47Å; K285-Q288 PolarHBondContact O-N 2.95Å; Q288-S290 VanDerWaalsContact C-N 3.32Å
289	N	71.3	Confident	79.4	Confident	66 Å²	66	56.1 Å²	56.1	35%	0.353	29%	0.285	S	S	.	.	S	Bend	trans	-82	-6.8	173	-74.9	-68.1	0	0	0	113.9	R236 K285 L286 M287 T291	R236-N289 PolarHBondContact O-ND2 2.93Å; R236-N289 PolarHBondContact O-OD1 2.94Å; K285-N289 PolarHBondContact O-N 3.03Å; K285-N289 VanDerWaalsContact O-N 3.08Å; K285-N289 PolarHBondContact O-ND2 3.33Å; L286-N289 PolarHBondContact O-N 2.98Å; M287-N289 VanDerWaalsContact C-N 3.32Å; N289-T291 PolarHBondContact O-N 3.43Å
290	S	64.9	Low	79.1	Confident	62 Å²	62	56.2 Å²	56.2	43%	0.434	29%	0.285	S	S	.	.			trans	-71.5	88.7	179.1	72.9	0	0	0	0	111.7	L286 M287 Q288	L286-S290 PolarHBondContact O-N 3.45Å; L286-S290 VanDerWaalsContact O-N 3.11Å; M287-S290 WeakPolarHBondContact CE-OG 3.33Å; M287-S290 WeakPolarHBondContact O-CB 3.4Å; M287-S290 PolarHBondContact O-N 2.71Å; M287-S290 PolarHBondContact O-OG 3.13Å; Q288-S290 VanDerWaalsContact C-N 3.32Å
291	T	60.9	Low	78.7	Confident	84 Å²	84	58.6 Å²	58.6	52%	0.515	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-66.7	136.7	175	52.4	0	0	0	0	110.7	N289 V293 Q822	N289-T291 PolarHBondContact O-N 3.43Å; T291-V293 PolarHBondContact O-N 3.05Å; T291-Q822 VanDerWaalsContact OG1-CD 3.26Å; T291-Q822 PolarHBondContact OG1-NE2 3.41Å; T291-Q822 PolarHBondContact OG1-OE1 3.38Å
292	K	62.8	Low	78.5	Confident	200 Å²	200	67.1 Å²	67.1	87%	0.87	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-68.7	120.3	170	-70.6	175.4	-177.6	166.6	0	108.6
293	V	62.5	Low	78.5	Confident	82 Å²	82	65 Å²	65	50%	0.497	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-50.3	122.5	178.9	-178	0	0	0	0	109.7	T291	T291-V293 PolarHBondContact O-N 3.05Å
294	P	68.1	Low	78.4	Confident	57 Å²	57	64 Å²	64	37%	0.37	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-69.6	145.8	-174.5	27	-34.3	0	0	0	111.6	K296 Q822	P294-K296 VanDerWaalsContact C-N 3.29Å; P294-K296 PolarHBondContact O-N 2.99Å; P294-Q822 HydrophobicContact CG-CB 4.24Å
295	L	69.4	Low	78.2	Confident	126 Å²	126	66 Å²	66	66%	0.66	33%	0.327	S	S	*	.			trans	-72.6	81.9	174.6	-72.1	174.4	0	0	0	110.9
296	K	79.9	Confident	78.2	Confident	33 Å²	33	71.3 Å²	71.3	14%	0.143	35%	0.354	C	S	.	.			trans	-61.3	140.3	172	-63.9	-177.8	-178.3	-165.5	0	110.5	P294 L407 I821 Q822 A824 D843	P294-K296 VanDerWaalsContact C-N 3.29Å; P294-K296 PolarHBondContact O-N 2.99Å; K296-L407 HydrophobicContact CB-CD1 3.94Å; K296-L407 HydrophobicContact CB-CD2 4.18Å; K296-L407 HydrophobicContact CD-CD1 3.97Å; K296-I821 PolarHBondContact NZ-O 3.02Å; K296-Q822 WeakPolarHBondContact CE-O 3.16Å; K296-A824 VanDerWaalsContact CE-O 3.24Å; K296-A824 WeakPolarHBondContact CE-O 3.49Å; K296-A824 PolarHBondContact NZ-O 2.88Å; K296-D843 VanDerWaalsContact CD-OD2 3.3Å; K296-D843 WeakPolarHBondContact CD-OD2 3.37Å; K296-D843 WeakPolarHBondContact CE-OD2 2.98Å; K296-D843 IonicContact NZ-OD2 3.23Å; K296-D843 PolarHBondContact NZ-OD2 3.27Å
297	R	80.5	Confident	78.4	Confident	153 Å²	153	70 Å²	70	58%	0.577	35%	0.347	S	S	*	.			trans	-131.9	144.7	177.1	-63.6	-173.1	-172.5	177.8	-0.6	109.5
298	S	85.9	Confident	78.7	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.007	35%	0.345	C	S	.	.			trans	-70.6	147.6	177.3	164.3	0	0	0	0	111.9	V300 E301 R302 E409 E410	S298-V300 VanDerWaalsContact C-N 3.33Å; S298-V300 WeakPolarHBondContact OG-CB 3.23Å; S298-V300 PolarHBondContact OG-N 2.76Å; S298-E301 WeakPolarHBondContact O-CB 3.1Å; S298-E301 PolarHBondContact O-N 3.07Å; S298-E301 PolarHBondContact OG-N 3.24Å; S298-R302 PolarHBondContact O-N 2.85Å; S298-E409 WeakPolarHBondContact OG-CG 3.49Å; S298-E409 PolarHBondContact OG-OE1 2.86Å; S298-E410 WeakPolarHBondContact CA-OE1 3.22Å; S298-E410 WeakPolarHBondContact CB-OE1 3.29Å; S298-E410 PolarHBondContact OG-OE1 2.86Å
299	N	86.9	Confident	79	Confident	66 Å²	66	71.3 Å²	71.3	35%	0.353	36%	0.355	S	S	.	.	H	α-helix	trans	-63	-38.8	167.9	-173	30.2	0	0	0	111.6	E301 R302 V303 E410 I807	N299-E301 VanDerWaalsContact C-N 3.33Å; N299-E301 PolarHBondContact O-N 3.34Å; N299-R302 WeakPolarHBondContact O-CB 3.32Å; N299-R302 PolarHBondContact O-N 2.94Å; N299-V303 WeakPolarHBondContact O-CG2 3.33Å; N299-V303 PolarHBondContact O-N 2.91Å; N299-E410 PolarHBondContact N-OE1 3.02Å; N299-I807 HydrophobicContact CB-CD1 4.16Å
300	V	87.4	Confident	79.9	Confident	3 Å²	3	71.3 Å²	71.3	2%	0.018	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-39.9	174	179.4	0	0	0	0	111	S298 T304 E409 Y864 V867 T868 I871 F948	S298-V300 VanDerWaalsContact C-N 3.33Å; S298-V300 WeakPolarHBondContact OG-CB 3.23Å; S298-V300 PolarHBondContact OG-N 2.76Å; V300-T304 VanDerWaalsContact O-CB 3.29Å; V300-T304 WeakPolarHBondContact O-CB 3.4Å; V300-T304 PolarHBondContact O-N 2.64Å; V300-T304 PolarHBondContact O-OG1 2.89Å; V300-E409 HydrophobicContact CB-CG 3.94Å; V300-E409 HydrophobicContact CG2-CG 3.85Å; V300-Y864 HydrophobicContact CG2-CD2 4.31Å; V300-Y864 HydrophobicContact CG2-CE2 3.99Å; V300-V867 HydrophobicContact CG1-CG1 4.23Å; V300-T868 HydrophobicContact CG1-CG2 4.42Å; V300-I871 HydrophobicContact CG1-CD1 3.47Å; V300-I871 VanDerWaalsContact CG1-CD1 3.47Å; V300-F948 HydrophobicContact CG1-CD1 4.01Å; V300-F948 HydrophobicContact CG1-CE1 3.93Å
301	E	85.5	Confident	81	Confident	51 Å²	51	68.6 Å²	68.6	24%	0.238	34%	0.339	C	S	.	.	H	α-helix	trans	-63.3	-43.1	171.9	-166.5	-150.9	131.1	0	0	111.5	S298 N299 T304 N305	S298-E301 WeakPolarHBondContact O-CB 3.1Å; S298-E301 PolarHBondContact O-N 3.07Å; S298-E301 PolarHBondContact OG-N 3.24Å; N299-E301 VanDerWaalsContact C-N 3.33Å; N299-E301 PolarHBondContact O-N 3.34Å; E301-T304 PolarHBondContact O-N 3.39Å; E301-N305 WeakPolarHBondContact O-CB 3.34Å; E301-N305 PolarHBondContact O-N 2.74Å; E301-N305 PolarHBondContact O-ND2 2.58Å
302	R	85.6	Confident	82.3	Confident	178 Å²	178	67.5 Å²	67.5	67%	0.672	33%	0.327	S	S	*	.	H	α-helix	trans	-62.1	-45	177.2	-171.8	-180	-174.5	167.3	4.4	112.2	S298 N299 M306	S298-R302 PolarHBondContact O-N 2.85Å; N299-R302 WeakPolarHBondContact O-CB 3.32Å; N299-R302 PolarHBondContact O-N 2.94Å; R302-M306 WeakPolarHBondContact O-CG 3.41Å; R302-M306 PolarHBondContact O-N 3.04Å
303	V	87	Confident	83.6	Confident	41 Å²	41	59.7 Å²	59.7	25%	0.248	30%	0.302	C	S	.	.	H	α-helix	trans	-64.7	-43.4	175.6	172.8	0	0	0	0	110.5	N299 N305 M306 Q307 F948	N299-V303 WeakPolarHBondContact O-CG2 3.33Å; N299-V303 PolarHBondContact O-N 2.91Å; V303-N305 PolarHBondContact O-N 3.25Å; V303-M306 WeakPolarHBondContact O-CB 3.36Å; V303-M306 PolarHBondContact O-N 2.97Å; V303-M306 VanDerWaalsContact O-N 3.15Å; V303-Q307 WeakPolarHBondContact O-CG 3.37Å; V303-Q307 PolarHBondContact O-N 3.44Å; V303-F948 HydrophobicContact CB-CE1 4.05Å; V303-F948 HydrophobicContact CG1-CD1 4.32Å; V303-F948 HydrophobicContact CG1-CE1 3.64Å; V303-F948 HydrophobicContact CG1-CZ 4.31Å
304	T	87.6	Confident	84.9	Confident	8 Å²	8	58.8 Å²	58.8	5%	0.049	29%	0.294	C	S	.	.	H	α-helix	trans	-61.1	-45.3	178.6	-60.3	0	0	0	0	111.9	V300 E301 M306 Q307 I308 L370 I871 F875	V300-T304 VanDerWaalsContact O-CB 3.29Å; V300-T304 WeakPolarHBondContact O-CB 3.4Å; V300-T304 PolarHBondContact O-N 2.64Å; V300-T304 PolarHBondContact O-OG1 2.89Å; E301-T304 PolarHBondContact O-N 3.39Å; T304-M306 VanDerWaalsContact C-N 3.28Å; T304-M306 PolarHBondContact O-N 2.66Å; T304-Q307 PolarHBondContact O-N 2.79Å; T304-I308 HydrophobicContact CG2-CD1 4.2Å; T304-I308 WeakPolarHBondContact O-CG1 3.23Å; T304-I308 PolarHBondContact O-N 3.03Å; T304-L370 HydrophobicContact CG2-CD2 4.11Å; T304-I871 HydrophobicContact CG2-CG2 4.37Å; T304-F875 HydrophobicContact CG2-CE2 4.14Å; T304-F875 HydrophobicContact CG2-CZ 4.32Å
305	N	85.3	Confident	86	Confident	41 Å²	41	56 Å²	56	22%	0.219	28%	0.277	C	S	.	.	H	α-helix	trans	-59.9	-36.5	174.7	-80	-63.8	0	0	0	112.5	E301 V303 I308 L309	E301-N305 WeakPolarHBondContact O-CB 3.34Å; E301-N305 PolarHBondContact O-N 2.74Å; E301-N305 PolarHBondContact O-ND2 2.58Å; V303-N305 PolarHBondContact O-N 3.25Å; N305-I308 PolarHBondContact O-N 2.61Å; N305-L309 PolarHBondContact O-N 2.73Å; N305-L309 VanDerWaalsContact O-N 3.16Å
306	M	86	Confident	87.1	Confident	114 Å²	114	53.4 Å²	53.4	56%	0.562	26%	0.263	S	S	*	.	H	α-helix	trans	-67.9	-41.2	174.2	-72.5	-66.8	-173.6	0	0	112.3	R302 V303 T304 I308 L309 V310	R302-M306 WeakPolarHBondContact O-CG 3.41Å; R302-M306 PolarHBondContact O-N 3.04Å; V303-M306 WeakPolarHBondContact O-CB 3.36Å; V303-M306 PolarHBondContact O-N 2.97Å; V303-M306 VanDerWaalsContact O-N 3.15Å; T304-M306 VanDerWaalsContact C-N 3.28Å; T304-M306 PolarHBondContact O-N 2.66Å; M306-I308 VanDerWaalsContact C-N 3.33Å; M306-I308 PolarHBondContact O-N 3.12Å; M306-L309 PolarHBondContact O-N 3.15Å; M306-V310 WeakPolarHBondContact O-CG2 3.19Å; M306-V310 PolarHBondContact O-N 3.04Å
307	Q	87.9	Confident	87.8	Confident	11 Å²	11	56 Å²	56	5%	0.051	28%	0.281	C	S	.	.	H	α-helix	trans	-65.8	-35.7	175.5	-56.4	-51.6	-22.4	0	0	112.2	V303 T304 L309 V310 L311 T950 F953	V303-Q307 WeakPolarHBondContact O-CG 3.37Å; V303-Q307 PolarHBondContact O-N 3.44Å; T304-Q307 PolarHBondContact O-N 2.79Å; Q307-L309 VanDerWaalsContact C-N 3.33Å; Q307-L309 PolarHBondContact O-N 3.11Å; Q307-V310 PolarHBondContact O-N 2.93Å; Q307-L311 WeakPolarHBondContact O-CB 3.01Å; Q307-L311 WeakPolarHBondContact O-CG 3.46Å; Q307-L311 PolarHBondContact O-N 3.04Å; Q307-T950 PolarHBondContact NE2-OG1 3.33Å; Q307-F953 HydrophobicContact CB-CD1 4.36Å; Q307-F953 HydrophobicContact CB-CD2 4.41Å; Q307-F953 HydrophobicContact CB-CE1 3.88Å; Q307-F953 HydrophobicContact CB-CE2 3.93Å; Q307-F953 HydrophobicContact CB-CZ 3.65Å; Q307-F953 HydrophobicContact CG-CD1 3.98Å; Q307-F953 HydrophobicContact CG-CD2 4.13Å; Q307-F953 HydrophobicContact CG-CE1 4.02Å; Q307-F953 HydrophobicContact CG-CE2 4.16Å; Q307-F953 HydrophobicContact CG-CG 4.05Å; Q307-F953 HydrophobicContact CG-CZ 4.11Å
308	I	87.1	Confident	88.3	Confident	13 Å²	13	49.9 Å²	49.9	7%	0.067	26%	0.26	C	S	.	.	H	α-helix	trans	-58.8	-44.4	172.4	-71.7	170.3	0	0	0	110.8	A87 T304 N305 M306 L311 F312 I366 F875	A87-I308 HydrophobicContact CB-CD1 4.34Å; A87-I308 HydrophobicContact CB-CG2 4.38Å; T304-I308 HydrophobicContact CG2-CD1 4.2Å; T304-I308 WeakPolarHBondContact O-CG1 3.23Å; T304-I308 PolarHBondContact O-N 3.03Å; N305-I308 PolarHBondContact O-N 2.61Å; M306-I308 VanDerWaalsContact C-N 3.33Å; M306-I308 PolarHBondContact O-N 3.12Å; I308-L311 PolarHBondContact O-N 3.23Å; I308-F312 PolarHBondContact O-N 3Å; I308-I366 HydrophobicContact CG1-CG2 4.35Å; I308-I366 HydrophobicContact CG2-CD1 4.41Å; I308-I366 HydrophobicContact CG2-CG2 3.81Å; I308-F875 HydrophobicContact CD1-CZ 4.43Å; I308-F875 HydrophobicContact CG1-CE1 4.21Å; I308-F875 HydrophobicContact CG1-CZ 3.79Å
309	L	86.6	Confident	88.6	Confident	107 Å²	107	49.9 Å²	49.9	56%	0.56	26%	0.259	S	S	*	.	H	α-helix	trans	-65.8	-38.6	178.3	-170	152	0	0	0	112.2	N305 M306 Q307 F312 G313	N305-L309 PolarHBondContact O-N 2.73Å; N305-L309 VanDerWaalsContact O-N 3.16Å; M306-L309 PolarHBondContact O-N 3.15Å; Q307-L309 VanDerWaalsContact C-N 3.33Å; Q307-L309 PolarHBondContact O-N 3.11Å; L309-F312 WeakPolarHBondContact O-CB 3.31Å; L309-F312 PolarHBondContact O-N 3.02Å; L309-G313 PolarHBondContact O-N 2.85Å; L309-G313 VanDerWaalsContact O-N 3.09Å
310	V	89.1	Confident	89	Confident	66 Å²	66	50.8 Å²	50.8	40%	0.4	26%	0.264	S	S	.	.	H	α-helix	trans	-68.8	-40.5	175	179.4	0	0	0	0	111.6	M306 Q307 F312 G313 I314 W954	M306-V310 WeakPolarHBondContact O-CG2 3.19Å; M306-V310 PolarHBondContact O-N 3.04Å; Q307-V310 PolarHBondContact O-N 2.93Å; V310-F312 VanDerWaalsContact C-N 3.3Å; V310-F312 PolarHBondContact O-N 3.04Å; V310-G313 WeakPolarHBondContact O-CA 3.34Å; V310-G313 PolarHBondContact O-N 3.36Å; V310-G313 VanDerWaalsContact O-N 3.13Å; V310-I314 PolarHBondContact O-N 3.22Å; V310-W954 HydrophobicContact CG1-CH2 4.2Å; V310-W954 HydrophobicContact CG1-CZ2 3.71Å
311	L	88.3	Confident	89.2	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.031	29%	0.285	C	S	.	.	H	α-helix	trans	-62.3	-36	172.9	-78.5	175.4	0	0	0	112.4	Q307 I308 G313 I314 L315 L365 I366 F875 F953 W954	Q307-L311 WeakPolarHBondContact O-CB 3.01Å; Q307-L311 WeakPolarHBondContact O-CG 3.46Å; Q307-L311 PolarHBondContact O-N 3.04Å; I308-L311 PolarHBondContact O-N 3.23Å; L311-G313 VanDerWaalsContact C-N 3.35Å; L311-I314 PolarHBondContact O-N 3.36Å; L311-L315 WeakPolarHBondContact O-CB 3.45Å; L311-L315 PolarHBondContact O-N 2.86Å; L311-L365 HydrophobicContact CD2-CD2 4.41Å; L311-I366 HydrophobicContact CB-CD1 4.5Å; L311-I366 HydrophobicContact CB-CG1 4.25Å; L311-F875 HydrophobicContact CD1-CD1 3.52Å; L311-F875 HydrophobicContact CD1-CE1 3.47Å; L311-F875 VanDerWaalsContact CD1-CE1 3.47Å; L311-F953 HydrophobicContact CD1-CZ 3.97Å; L311-F953 HydrophobicContact CG-CZ 4.27Å; L311-W954 HydrophobicContact CD2-CH2 4.24Å
312	F	88.2	Confident	89.5	Confident	61 Å²	61	51.9 Å²	51.9	27%	0.268	27%	0.274	S	S	.	.	H	α-helix	trans	-63.1	-40.5	171.8	175.2	-118.9	0	0	0	111.9	F90 I308 L309 V310 I314 L315 L316 I366	F90-F312 AromaticContact CD2-CD2 3.65Å; F90-F312 HydrophobicContact CD2-CD2 3.65Å; F90-F312 AromaticContact CD2-CE2 3.71Å; F90-F312 HydrophobicContact CD2-CE2 3.71Å; F90-F312 HydrophobicContact CD2-CG 4.37Å; F90-F312 HydrophobicContact CD2-CZ 4.46Å; F90-F312 AromaticContact CE2-CD2 3.39Å; F90-F312 HydrophobicContact CE2-CD2 3.39Å; F90-F312 AromaticContact CE2-CE2 3.52Å; F90-F312 HydrophobicContact CE2-CE2 3.52Å; F90-F312 HydrophobicContact CE2-CG 4.43Å; F90-F312 HydrophobicContact CZ-CD2 4.27Å; I308-F312 PolarHBondContact O-N 3Å; L309-F312 WeakPolarHBondContact O-CB 3.31Å; L309-F312 PolarHBondContact O-N 3.02Å; V310-F312 VanDerWaalsContact C-N 3.3Å; V310-F312 PolarHBondContact O-N 3.04Å; F312-I314 PolarHBondContact O-N 2.83Å; F312-L315 WeakPolarHBondContact O-CB 3.42Å; F312-L315 PolarHBondContact O-N 3.4Å; F312-L316 HydrophobicContact CD1-CD1 4.44Å; F312-L316 HydrophobicContact CD2-CG 4.48Å; F312-L316 HydrophobicContact CE1-CD1 3.88Å; F312-L316 HydrophobicContact CE2-CD1 4.21Å; F312-L316 HydrophobicContact CE2-CD2 4.08Å; F312-L316 HydrophobicContact CE2-CG 4.05Å; F312-L316 HydrophobicContact CZ-CD1 3.76Å; F312-L316 HydrophobicContact CZ-CD2 4.19Å; F312-L316 HydrophobicContact CZ-CG 4.11Å; F312-L316 WeakPolarHBondContact O-CG 3.19Å; F312-L316 PolarHBondContact O-N 2.86Å; F312-I366 HydrophobicContact CB-CD1 3.78Å
313	G	90.5	Very high	89.8	Confident	35 Å²	35	43.4 Å²	43.4	36%	0.361	24%	0.242	S	C	.	.	H	α-helix	trans	-58.1	-44.1	171.1	0	0	0	0	0	113	L309 V310 L311 L316 V317	L309-G313 PolarHBondContact O-N 2.85Å; L309-G313 VanDerWaalsContact O-N 3.09Å; V310-G313 WeakPolarHBondContact O-CA 3.34Å; V310-G313 PolarHBondContact O-N 3.36Å; V310-G313 VanDerWaalsContact O-N 3.13Å; L311-G313 VanDerWaalsContact C-N 3.35Å; G313-L316 PolarHBondContact O-N 3.19Å; G313-V317 WeakPolarHBondContact O-CG2 3.44Å; G313-V317 PolarHBondContact O-N 2.86Å
314	I	90.4	Very high	90	Very high	63 Å²	63	44.5 Å²	44.5	32%	0.323	25%	0.249	S	C	.	.	H	α-helix	trans	-66.6	-40.6	176.3	-65.8	179.1	0	0	0	111.5	V310 L311 F312 L316 V317 M318 W954	V310-I314 PolarHBondContact O-N 3.22Å; L311-I314 PolarHBondContact O-N 3.36Å; F312-I314 PolarHBondContact O-N 2.83Å; I314-L316 VanDerWaalsContact C-N 3.32Å; I314-L316 PolarHBondContact O-N 3.32Å; I314-V317 PolarHBondContact O-N 3.26Å; I314-V317 VanDerWaalsContact O-N 3.1Å; I314-M318 HydrophobicContact CG2-CE 4.34Å; I314-M318 HydrophobicContact CG2-CG 4.16Å; I314-M318 HydrophobicContact CG2-SD 4.13Å; I314-M318 WeakPolarHBondContact O-CG 3.32Å; I314-M318 PolarHBondContact O-N 2.79Å; I314-W954 HydrophobicContact CD1-CH2 3.47Å; I314-W954 VanDerWaalsContact CD1-CH2 3.47Å; I314-W954 HydrophobicContact CD1-CZ2 4.47Å; I314-W954 HydrophobicContact CD1-CZ3 3.86Å
315	L	91.8	Very high	90.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-56	-46.1	175.4	178.7	160.4	0	0	0	111.4	F90 L311 F312 V317 M318 A319 I359 Y362 L365	F90-L315 HydrophobicContact CZ-CD1 4.26Å; L311-L315 WeakPolarHBondContact O-CB 3.45Å; L311-L315 PolarHBondContact O-N 2.86Å; F312-L315 WeakPolarHBondContact O-CB 3.42Å; F312-L315 PolarHBondContact O-N 3.4Å; L315-V317 VanDerWaalsContact C-N 3.32Å; L315-V317 PolarHBondContact O-N 3.03Å; L315-M318 PolarHBondContact O-N 2.71Å; L315-A319 WeakPolarHBondContact O-CB 3.37Å; L315-A319 PolarHBondContact O-N 3.47Å; L315-I359 HydrophobicContact CD2-CB 4.45Å; L315-I359 HydrophobicContact CD2-CG1 4.28Å; L315-I359 HydrophobicContact CD2-CG2 4.22Å; L315-Y362 WeakPolarHBondContact CD1-O 3.22Å; L315-L365 HydrophobicContact CB-CD2 4.4Å
316	L	91.9	Very high	90.2	Very high	70 Å²	70	42.8 Å²	42.8	37%	0.366	24%	0.242	S	C	.	.	H	α-helix	trans	-62.1	-38.6	176.3	-66.8	176.4	0	0	0	112.1	F312 G313 I314 L320 I359	F312-L316 HydrophobicContact CD1-CD1 4.44Å; F312-L316 HydrophobicContact CD2-CG 4.48Å; F312-L316 HydrophobicContact CE1-CD1 3.88Å; F312-L316 HydrophobicContact CE2-CD1 4.21Å; F312-L316 HydrophobicContact CE2-CD2 4.08Å; F312-L316 HydrophobicContact CE2-CG 4.05Å; F312-L316 HydrophobicContact CZ-CD1 3.76Å; F312-L316 HydrophobicContact CZ-CD2 4.19Å; F312-L316 HydrophobicContact CZ-CG 4.11Å; F312-L316 WeakPolarHBondContact O-CG 3.19Å; F312-L316 PolarHBondContact O-N 2.86Å; G313-L316 PolarHBondContact O-N 3.19Å; I314-L316 VanDerWaalsContact C-N 3.32Å; I314-L316 PolarHBondContact O-N 3.32Å; L316-L320 VanDerWaalsContact O-CB 3.28Å; L316-L320 WeakPolarHBondContact O-CB 3.45Å; L316-L320 PolarHBondContact O-N 3.3Å; L316-I359 HydrophobicContact CD2-CD1 3.87Å; L316-I359 HydrophobicContact CD2-CG1 4.16Å
317	V	93.5	Very high	90.2	Very high	87 Å²	87	39.5 Å²	39.5	53%	0.527	23%	0.233	S	C	.	.	H	α-helix	trans	-66.8	-43.8	175.1	173.6	0	0	0	0	111.7	G313 I314 L315 L320 V321	G313-V317 WeakPolarHBondContact O-CG2 3.44Å; G313-V317 PolarHBondContact O-N 2.86Å; I314-V317 PolarHBondContact O-N 3.26Å; I314-V317 VanDerWaalsContact O-N 3.1Å; L315-V317 VanDerWaalsContact C-N 3.32Å; L315-V317 PolarHBondContact O-N 3.03Å; V317-L320 PolarHBondContact O-N 2.91Å; V317-V321 HydrophobicContact CG1-CG2 4.48Å; V317-V321 WeakPolarHBondContact O-CG2 3.28Å; V317-V321 PolarHBondContact O-N 3.36Å
318	M	92.2	Very high	90.2	Very high	26 Å²	26	43 Å²	43	13%	0.128	25%	0.251	C	S	.	.	H	α-helix	trans	-65.5	-39.1	177.7	-65.7	-170.8	-50.4	0	0	112	I314 L315 S322 Y362 L365 L886	I314-M318 HydrophobicContact CG2-CE 4.34Å; I314-M318 HydrophobicContact CG2-CG 4.16Å; I314-M318 HydrophobicContact CG2-SD 4.13Å; I314-M318 WeakPolarHBondContact O-CG 3.32Å; I314-M318 PolarHBondContact O-N 2.79Å; L315-M318 PolarHBondContact O-N 2.71Å; M318-S322 WeakPolarHBondContact O-CB 3.47Å; M318-S322 PolarHBondContact O-N 2.68Å; M318-S322 PolarHBondContact O-OG 3.23Å; M318-Y362 HydrophobicContact CB-CD2 4.2Å; M318-Y362 HydrophobicContact CB-CE2 4.23Å; M318-L365 HydrophobicContact CE-CD1 4.45Å; M318-L365 HydrophobicContact CE-CD2 3.64Å; M318-L886 HydrophobicContact CG-CD2 4.4Å; M318-L886 HydrophobicContact SD-CD2 3.83Å
319	A	92.8	Very high	90.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-66.6	-39.2	174	0	0	0	0	0	112.2	L315 S322 S323 L355 F358 I359 Y362	L315-A319 WeakPolarHBondContact O-CB 3.37Å; L315-A319 PolarHBondContact O-N 3.47Å; A319-S322 PolarHBondContact O-N 2.97Å; A319-S323 WeakPolarHBondContact O-CB 3.38Å; A319-S323 PolarHBondContact O-N 2.9Å; A319-L355 HydrophobicContact CB-CD1 4.05Å; A319-F358 HydrophobicContact CB-CB 3.74Å; A319-I359 HydrophobicContact CB-CG1 3.7Å; A319-Y362 HydrophobicContact CB-CD2 4.37Å
320	L	93.5	Very high	89.8	Confident	85 Å²	85	44.7 Å²	44.7	45%	0.445	25%	0.252	S	S	.	.	H	α-helix	trans	-62.7	-48.2	174.1	-174.8	70.4	0	0	0	111.7	L316 V317 S322 S323 V324 F351 L355	L316-L320 VanDerWaalsContact O-CB 3.28Å; L316-L320 WeakPolarHBondContact O-CB 3.45Å; L316-L320 PolarHBondContact O-N 3.3Å; V317-L320 PolarHBondContact O-N 2.91Å; L320-S322 VanDerWaalsContact C-N 3.32Å; L320-S322 PolarHBondContact O-N 3.08Å; L320-S323 PolarHBondContact O-N 3.38Å; L320-V324 WeakPolarHBondContact O-CG2 3.42Å; L320-V324 PolarHBondContact O-N 3.04Å; L320-F351 HydrophobicContact CD1-CE1 4.37Å; L320-F351 HydrophobicContact CD1-CZ 3.84Å; L320-L355 HydrophobicContact CB-CD1 4.49Å
321	V	92.8	Very high	89.4	Confident	78 Å²	78	51.6 Å²	51.6	47%	0.473	27%	0.271	S	S	.	.	H	α-helix	trans	-59.8	-43	176.3	169.4	0	0	0	0	111	V317 V324 G325	V317-V321 HydrophobicContact CG1-CG2 4.48Å; V317-V321 WeakPolarHBondContact O-CG2 3.28Å; V317-V321 PolarHBondContact O-N 3.36Å; V321-V324 PolarHBondContact O-N 2.93Å; V321-G325 PolarHBondContact O-N 3.49Å
322	S	91.9	Very high	89	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66.5	-40.5	178.5	-54	0	0	0	0	112.2	M318 A319 L320 G325 A326 F358 Y362	M318-S322 WeakPolarHBondContact O-CB 3.47Å; M318-S322 PolarHBondContact O-N 2.68Å; M318-S322 PolarHBondContact O-OG 3.23Å; A319-S322 PolarHBondContact O-N 2.97Å; L320-S322 VanDerWaalsContact C-N 3.32Å; L320-S322 PolarHBondContact O-N 3.08Å; S322-G325 PolarHBondContact O-N 2.9Å; S322-A326 PolarHBondContact O-N 3.23Å; S322-F358 VanDerWaalsContact C-CE2 3.5Å; S322-F358 VanDerWaalsContact CB-CD1 3.5Å; S322-F358 VanDerWaalsContact CB-CG 3.5Å; S322-F358 WeakPolarHBondContact O-CE2 3.2Å; S322-Y362 WeakPolarHBondContact OG-CE2 3.48Å; S322-Y362 PolarHBondContact OG-OH 3.45Å
323	S	91.4	Very high	88.3	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-68.4	-34.8	176.3	-167	0	0	0	0	112.7	A319 L320 A327 F351 L355	A319-S323 WeakPolarHBondContact O-CB 3.38Å; A319-S323 PolarHBondContact O-N 2.9Å; L320-S323 PolarHBondContact O-N 3.38Å; S323-A327 WeakPolarHBondContact O-CB 3.46Å; S323-A327 PolarHBondContact O-N 3.37Å; S323-F351 VanDerWaalsContact OG-CD2 3.29Å; S323-F351 WeakPolarHBondContact OG-CD2 3.24Å; S323-F351 VanDerWaalsContact OG-CE2 3.31Å; S323-F351 WeakPolarHBondContact OG-CE2 3.49Å; S323-F351 PolarHBondContact OG-O 3.46Å; S323-L355 PolarHBondContact OG-N 2.85Å
324	V	91.3	Very high	87.1	Confident	64 Å²	64	59.8 Å²	59.8	39%	0.388	31%	0.306	S	S	.	.	H	α-helix	trans	-68.1	-41.2	171.1	170.8	0	0	0	0	110.8	L320 V321 A326 A327 I328 F351	L320-V324 WeakPolarHBondContact O-CG2 3.42Å; L320-V324 PolarHBondContact O-N 3.04Å; V321-V324 PolarHBondContact O-N 2.93Å; V324-A326 PolarHBondContact O-N 3.23Å; V324-A327 PolarHBondContact O-N 3.19Å; V324-I328 HydrophobicContact CG1-CD1 3.87Å; V324-I328 HydrophobicContact CG1-CG1 4.47Å; V324-I328 WeakPolarHBondContact O-CG1 3.33Å; V324-I328 PolarHBondContact O-N 2.61Å; V324-F351 HydrophobicContact CG2-CE2 3.87Å; V324-F351 HydrophobicContact CG2-CZ 4.16Å
325	G	89.9	Confident	85.6	Confident	11 Å²	11	61.8 Å²	61.8	11%	0.113	32%	0.318	C	S	.	.	H	α-helix	trans	-57.2	-47.3	172.4	0	0	0	0	0	112.3	V321 S322 A327 I328 W329	V321-G325 PolarHBondContact O-N 3.49Å; S322-G325 PolarHBondContact O-N 2.9Å; G325-A327 VanDerWaalsContact C-N 3.33Å; G325-A327 PolarHBondContact O-N 2.93Å; G325-I328 PolarHBondContact O-N 3.34Å; G325-W329 WeakPolarHBondContact O-CB 3.46Å; G325-W329 PolarHBondContact O-N 2.7Å
326	A	87.4	Confident	84.1	Confident	2 Å²	2	70.7 Å²	70.7	2%	0.017	36%	0.359	C	S	.	.	H	α-helix	trans	-61.3	-38.5	174.7	0	0	0	0	0	112.8	S322 V324 N330 F358 F894	S322-A326 PolarHBondContact O-N 3.23Å; V324-A326 PolarHBondContact O-N 3.23Å; A326-N330 VanDerWaalsContact O-CB 3.31Å; A326-N330 WeakPolarHBondContact O-CB 3.4Å; A326-N330 PolarHBondContact O-N 2.87Å; A326-N330 PolarHBondContact O-ND2 2.95Å; A326-F358 HydrophobicContact CB-CE2 4.28Å; A326-F894 HydrophobicContact CB-CB 3.8Å; A326-F894 WeakPolarHBondContact CB-O 3.5Å
327	A	86.7	Confident	82.6	Confident	45 Å²	45	70.4 Å²	70.4	37%	0.372	37%	0.367	S	S	.	.	H	α-helix	trans	-70	-36.2	177.6	0	0	0	0	0	112.9	S323 V324 G325 R331 F351	S323-A327 WeakPolarHBondContact O-CB 3.46Å; S323-A327 PolarHBondContact O-N 3.37Å; V324-A327 PolarHBondContact O-N 3.19Å; G325-A327 VanDerWaalsContact C-N 3.33Å; G325-A327 PolarHBondContact O-N 2.93Å; A327-R331 WeakPolarHBondContact O-CB 3.26Å; A327-R331 PolarHBondContact O-N 2.73Å; A327-F351 HydrophobicContact CB-CD2 4.32Å
328	I	87.5	Confident	81.5	Confident	85 Å²	85	66.8 Å²	66.8	44%	0.436	35%	0.345	S	S	.	.	H	α-helix	trans	-68.2	-50.6	173.3	-67.3	165.5	0	0	0	109.8	V324 G325 N330 R331 E332	V324-I328 HydrophobicContact CG1-CD1 3.87Å; V324-I328 HydrophobicContact CG1-CG1 4.47Å; V324-I328 WeakPolarHBondContact O-CG1 3.33Å; V324-I328 PolarHBondContact O-N 2.61Å; G325-I328 PolarHBondContact O-N 3.34Å; I328-N330 VanDerWaalsContact C-N 3.34Å; I328-N330 PolarHBondContact O-N 3.26Å; I328-R331 WeakPolarHBondContact O-CA 3.42Å; I328-R331 WeakPolarHBondContact O-CB 3.48Å; I328-R331 PolarHBondContact O-N 3.28Å; I328-E332 HydrophobicContact CG2-CG 4.39Å; I328-E332 PolarHBondContact O-N 3.48Å
329	W	85.6	Confident	80.5	Confident	112 Å²	112	75.7 Å²	75.7	42%	0.424	38%	0.378	S	S	.	.	H	α-helix	trans	-56.5	-45.9	179.5	-177.2	-97.9	0	0	0	112.3	G325 R331 E332 H333	G325-W329 WeakPolarHBondContact O-CB 3.46Å; G325-W329 PolarHBondContact O-N 2.7Å; W329-R331 VanDerWaalsContact C-N 3.27Å; W329-R331 PolarHBondContact O-N 3.21Å; W329-E332 PolarHBondContact O-N 3.07Å; W329-H333 AromaticContact CD2-CE1 3.91Å; W329-H333 AromaticContact CD2-ND1 3.59Å; W329-H333 AromaticContact CE2-CE1 3.94Å; W329-H333 AromaticContact CE2-ND1 3.66Å; W329-H333 AromaticContact CE3-CE1 3.59Å; W329-H333 AromaticContact CE3-ND1 3.71Å; W329-H333 AromaticContact CH2-CE1 3.4Å; W329-H333 VanDerWaalsContact CH2-CE1 3.4Å; W329-H333 WeakPolarHBondContact CH2-CE1 3.42Å; W329-H333 AromaticContact CH2-ND1 3.98Å; W329-H333 AromaticContact CH2-NE2 3.71Å; W329-H333 AromaticContact CZ2-CE1 3.72Å; W329-H333 AromaticContact CZ2-ND1 3.86Å; W329-H333 AromaticContact CZ2-NE2 3.95Å; W329-H333 AromaticContact CZ3-CE1 3.34Å; W329-H333 WeakPolarHBondContact CZ3-CE1 3.39Å; W329-H333 AromaticContact CZ3-ND1 3.91Å; W329-H333 WeakPolarHBondContact O-CB 3.14Å; W329-H333 PolarHBondContact O-N 3.12Å; W329-H333 PolarHBondContact O-ND1 2.87Å
330	N	79.4	Confident	79.6	Confident	42 Å²	42	83 Å²	83	23%	0.225	41%	0.406	C	S	.	.	H	α-helix	trans	-66.6	-24.6	176.5	-80.5	-61.1	0	0	0	113.9	A326 I328 R343	A326-N330 VanDerWaalsContact O-CB 3.31Å; A326-N330 WeakPolarHBondContact O-CB 3.4Å; A326-N330 PolarHBondContact O-N 2.87Å; A326-N330 PolarHBondContact O-ND2 2.95Å; I328-N330 VanDerWaalsContact C-N 3.34Å; I328-N330 PolarHBondContact O-N 3.26Å; N330-R343 PolarHBondContact O-NH2 2.88Å; N330-R343 PolarHBondContact OD1-NE 2.74Å; N330-R343 PolarHBondContact OD1-NH2 3.42Å
331	R	79.9	Confident	78.6	Confident	212 Å²	212	83.7 Å²	83.7	80%	0.8	41%	0.41	S	S	*	.	H	α-helix	trans	-80.6	-36.3	175.6	175.7	177.3	173.6	153.8	1.8	112.5	A327 I328 W329	A327-R331 WeakPolarHBondContact O-CB 3.26Å; A327-R331 PolarHBondContact O-N 2.73Å; I328-R331 WeakPolarHBondContact O-CA 3.42Å; I328-R331 WeakPolarHBondContact O-CB 3.48Å; I328-R331 PolarHBondContact O-N 3.28Å; W329-R331 VanDerWaalsContact C-N 3.27Å; W329-R331 PolarHBondContact O-N 3.21Å
332	E	80.8	Confident	77	Confident	136 Å²	136	85.1 Å²	85.1	64%	0.636	42%	0.424	S	S	*	.	H	α-helix	trans	-78.4	-36	179.2	-68.8	177.7	167.8	0	0	111.8	I328 W329	I328-E332 HydrophobicContact CG2-CG 4.39Å; I328-E332 PolarHBondContact O-N 3.48Å; W329-E332 PolarHBondContact O-N 3.07Å
333	H	73.4	Confident	75.5	Confident	56 Å²	56	88.3 Å²	88.3	26%	0.259	44%	0.436	S	S	.	.	S	Bend	trans	-100.4	85.7	178	-62.9	81.8	0	0	0	110.7	W329 R343	W329-H333 AromaticContact CD2-CE1 3.91Å; W329-H333 AromaticContact CD2-ND1 3.59Å; W329-H333 AromaticContact CE2-CE1 3.94Å; W329-H333 AromaticContact CE2-ND1 3.66Å; W329-H333 AromaticContact CE3-CE1 3.59Å; W329-H333 AromaticContact CE3-ND1 3.71Å; W329-H333 AromaticContact CH2-CE1 3.4Å; W329-H333 VanDerWaalsContact CH2-CE1 3.4Å; W329-H333 WeakPolarHBondContact CH2-CE1 3.42Å; W329-H333 AromaticContact CH2-ND1 3.98Å; W329-H333 AromaticContact CH2-NE2 3.71Å; W329-H333 AromaticContact CZ2-CE1 3.72Å; W329-H333 AromaticContact CZ2-ND1 3.86Å; W329-H333 AromaticContact CZ2-NE2 3.95Å; W329-H333 AromaticContact CZ3-CE1 3.34Å; W329-H333 WeakPolarHBondContact CZ3-CE1 3.39Å; W329-H333 AromaticContact CZ3-ND1 3.91Å; W329-H333 WeakPolarHBondContact O-CB 3.14Å; W329-H333 PolarHBondContact O-N 3.12Å; W329-H333 PolarHBondContact O-ND1 2.87Å; H333-R343 PolarHBondContact O-NH1 3.29Å; H333-R343 PolarHBondContact O-NH2 2.96Å
334	T	64.6	Low	73.4	Confident	81 Å²	81	92.4 Å²	92.4	50%	0.497	47%	0.47	S	S	.	.			trans	-71.7	163.6	173.2	38.5	0	0	0	0	112.7	E336 A337 C338	T334-E336 PolarHBondContact O-N 2.96Å; T334-E336 VanDerWaalsContact O-N 3.14Å; T334-A337 PolarHBondContact O-N 2.97Å; T334-C338 PolarHBondContact O-N 3.36Å
335	D	60.1	Low	71.6	Confident	106 Å²	106	91.5 Å²	91.5	57%	0.567	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-31.8	-169.5	-60.1	-20.8	0	0	0	114	A337 C338 W339 R343	D335-A337 VanDerWaalsContact C-N 3.29Å; D335-A337 PolarHBondContact O-N 3.15Å; D335-C338 CarbonylContact O-C 3.54Å; D335-C338 PolarHBondContact O-N 2.86Å; D335-W339 PolarHBondContact O-N 3.19Å; D335-W339 VanDerWaalsContact O-N 3.14Å; D335-R343 WeakPolarHBondContact OD1-CD 3.33Å; D335-R343 IonicContact OD1-CZ 3.41Å; D335-R343 IonicContact OD1-NE 3.78Å; D335-R343 IonicContact OD1-NH1 3.02Å; D335-R343 PolarHBondContact OD1-NH1 3.33Å
336	E	59.5	Low	70	Confident	187 Å²	187	96.9 Å²	96.9	87%	0.874	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-32.9	176.8	-61.6	-174.3	156	0	0	112.9	T334	T334-E336 PolarHBondContact O-N 2.96Å; T334-E336 VanDerWaalsContact O-N 3.14Å
337	A	60.8	Low	68.6	Low	63 Å²	63	100.5 Å²	100.5	52%	0.521	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-20.4	179.3	0	0	0	0	0	113.1	T334 D335	T334-A337 PolarHBondContact O-N 2.97Å; D335-A337 VanDerWaalsContact C-N 3.29Å; D335-A337 PolarHBondContact O-N 3.15Å
338	C	70.7	Confident	67.2	Low	12 Å²	12	100.4 Å²	100.4	8%	0.081	51%	0.514	C	S	.	.			trans	-129.8	34.6	-169.8	-76.2	0	0	0	0	112.9	T334 D335 Y340 L341	T334-C338 PolarHBondContact O-N 3.36Å; D335-C338 CarbonylContact O-C 3.54Å; D335-C338 PolarHBondContact O-N 2.86Å; C338-Y340 PolarHBondContact O-N 3.43Å; C338-L341 HydrophobicContact CB-CD1 4.24Å; C338-L341 WeakPolarHBondContact O-CB 3.27Å; C338-L341 PolarHBondContact O-N 3Å
339	W	70.9	Confident	66	Low	213 Å²	213	101.3 Å²	101.3	81%	0.807	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-25.1	-175.4	69.1	-93.6	0	0	0	116.3	D335	D335-W339 PolarHBondContact O-N 3.19Å; D335-W339 VanDerWaalsContact O-N 3.14Å
340	Y	73.7	Confident	65.6	Low	152 Å²	152	99.4 Å²	99.4	60%	0.596	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-20.3	178.8	60.3	-87.9	0	0	0	113.3	C338 S342	C338-Y340 PolarHBondContact O-N 3.43Å; Y340-S342 PolarHBondContact O-N 2.89Å
341	L	72.1	Confident	65.8	Low	100 Å²	100	101.5 Å²	101.5	52%	0.524	53%	0.525	S	S	.	.	S	Bend	trans	-86.4	87.3	171.2	-78.2	158.6	0	0	0	108.7	C338 R343	C338-L341 HydrophobicContact CB-CD1 4.24Å; C338-L341 WeakPolarHBondContact O-CB 3.27Å; C338-L341 PolarHBondContact O-N 3Å; L341-R343 PolarHBondContact O-N 3.36Å
342	S	59	Low	66	Low	109 Å²	109	94.1 Å²	94.1	76%	0.762	51%	0.509	S	S	*	.			trans	-62.2	99.5	174.7	-169.1	0	0	0	0	110.3	Y340 A344	Y340-S342 PolarHBondContact O-N 2.89Å; S342-A344 PolarHBondContact O-N 3.06Å
343	R	61.4	Low	66.1	Low	66 Å²	66	92 Å²	92	25%	0.249	50%	0.496	C	S	.	.			trans	-69.4	78.4	173.4	-77	-178.7	168.3	134.7	-0.1	109.9	N330 H333 D335 L341 G345	N330-R343 PolarHBondContact O-NH2 2.88Å; N330-R343 PolarHBondContact OD1-NE 2.74Å; N330-R343 PolarHBondContact OD1-NH2 3.42Å; H333-R343 PolarHBondContact O-NH1 3.29Å; H333-R343 PolarHBondContact O-NH2 2.96Å; D335-R343 WeakPolarHBondContact OD1-CD 3.33Å; D335-R343 IonicContact OD1-CZ 3.41Å; D335-R343 IonicContact OD1-NE 3.78Å; D335-R343 IonicContact OD1-NH1 3.02Å; D335-R343 PolarHBondContact OD1-NH1 3.33Å; L341-R343 PolarHBondContact O-N 3.36Å; R343-G345 VanDerWaalsContact C-N 3.28Å; R343-G345 PolarHBondContact O-N 2.95Å
344	A	46.5	Very low	66.7	Low	87 Å²	87	90.8 Å²	90.8	72%	0.719	49%	0.491	S	S	*	.			trans	-73	75	-175.2	0	0	0	0	0	112.6	S342	S342-A344 PolarHBondContact O-N 3.06Å
345	G	53.4	Low	67.9	Low	45 Å²	45	89 Å²	89	46%	0.464	48%	0.479	S	S	.	.	S	Bend	trans	90.7	169.8	172.4	0	0	0	0	0	115.2	R343 I347	R343-G345 VanDerWaalsContact C-N 3.28Å; R343-G345 PolarHBondContact O-N 2.95Å; G345-I347 PolarHBondContact O-N 2.83Å
346	D	56.8	Low	69.2	Low	123 Å²	123	86.4 Å²	86.4	66%	0.658	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-57.3	-18.9	-171.9	-60.1	-61.7	0	0	0	114.7	S348 L349 N350	D346-S348 VanDerWaalsContact C-N 3.34Å; D346-S348 PolarHBondContact O-N 3.11Å; D346-L349 PolarHBondContact O-N 2.83Å; D346-L349 VanDerWaalsContact O-N 3.08Å; D346-N350 PolarHBondContact O-N 3.48Å; D346-N350 PolarHBondContact O-ND2 3.01Å
347	I	57.3	Low	70.6	Confident	79 Å²	79	78.6 Å²	78.6	41%	0.405	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-57.3	-42.5	-172	-58.9	178.3	0	0	0	111.8	G345 L349 N350 Y353	G345-I347 PolarHBondContact O-N 2.83Å; I347-L349 VanDerWaalsContact C-N 3.34Å; I347-L349 PolarHBondContact O-N 3.49Å; I347-N350 PolarHBondContact O-N 3.23Å; I347-Y353 HydrophobicContact CG2-CD1 3.59Å; I347-Y353 HydrophobicContact CG2-CE1 4.11Å; I347-Y353 HydrophobicContact CG2-CG 3.97Å
348	S	56.9	Low	72	Confident	42 Å²	42	75.8 Å²	75.8	29%	0.294	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-75.2	-21.1	179.4	57	0	0	0	0	114.1	D346 N354	D346-S348 VanDerWaalsContact C-N 3.34Å; D346-S348 PolarHBondContact O-N 3.11Å; S348-N354 PolarHBondContact O-ND2 2.96Å
349	L	62.3	Low	73	Confident	104 Å²	104	75.9 Å²	75.9	55%	0.545	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-23.1	174.3	-62.8	176.1	0	0	0	111.9	D346 I347 F351	D346-L349 PolarHBondContact O-N 2.83Å; D346-L349 VanDerWaalsContact O-N 3.08Å; I347-L349 VanDerWaalsContact C-N 3.34Å; I347-L349 PolarHBondContact O-N 3.49Å; L349-F351 PolarHBondContact O-N 3.33Å
350	N	77.4	Confident	73.9	Confident	72 Å²	72	65.8 Å²	65.8	39%	0.385	37%	0.367	S	S	.	.			trans	-68.8	102.8	179.3	-84.4	-59.3	0	0	0	111.7	D346 I347 A352 Y353 N354	D346-N350 PolarHBondContact O-N 3.48Å; D346-N350 PolarHBondContact O-ND2 3.01Å; I347-N350 PolarHBondContact O-N 3.23Å; N350-A352 PolarHBondContact O-N 3.23Å; N350-Y353 HydrophobicContact CB-CD2 3.76Å; N350-Y353 HydrophobicContact CB-CG 4.36Å; N350-Y353 PolarHBondContact O-N 3.29Å; N350-N354 PolarHBondContact O-N 3.4Å; N350-N354 VanDerWaalsContact O-N 3.17Å
351	F	84.2	Confident	74.6	Confident	86 Å²	86	58.8 Å²	58.8	38%	0.377	34%	0.34	S	S	.	.	H	α-helix	trans	-47.5	-35.5	173.9	-179	-95	0	0	0	113.8	L320 S323 V324 A327 L349 L355	L320-F351 HydrophobicContact CD1-CE1 4.37Å; L320-F351 HydrophobicContact CD1-CZ 3.84Å; S323-F351 VanDerWaalsContact OG-CD2 3.29Å; S323-F351 WeakPolarHBondContact OG-CD2 3.24Å; S323-F351 VanDerWaalsContact OG-CE2 3.31Å; S323-F351 WeakPolarHBondContact OG-CE2 3.49Å; S323-F351 PolarHBondContact OG-O 3.46Å; V324-F351 HydrophobicContact CG2-CE2 3.87Å; V324-F351 HydrophobicContact CG2-CZ 4.16Å; A327-F351 HydrophobicContact CB-CD2 4.32Å; L349-F351 PolarHBondContact O-N 3.33Å; F351-L355 HydrophobicContact CE1-CD2 4.46Å; F351-L355 VanDerWaalsContact O-CB 3.28Å; F351-L355 WeakPolarHBondContact O-CB 3.38Å; F351-L355 PolarHBondContact O-N 2.9Å
352	A	83.9	Confident	75.4	Confident	58 Å²	58	54.1 Å²	54.1	48%	0.479	32%	0.316	S	S	.	.	H	α-helix	trans	-65	-41.1	176.2	0	0	0	0	0	112.9	N350 L355 L356	N350-A352 PolarHBondContact O-N 3.23Å; A352-L355 PolarHBondContact O-N 3.36Å; A352-L356 VanDerWaalsContact O-CG 3.28Å; A352-L356 WeakPolarHBondContact O-CG 3.44Å; A352-L356 PolarHBondContact O-N 3.3Å; A352-L356 VanDerWaalsContact O-N 3.09Å
353	Y	83.9	Confident	76.8	Confident	92 Å²	92	49 Å²	49	36%	0.361	28%	0.28	S	S	.	.	H	α-helix	trans	-67.8	-47.1	177.5	-83.4	-103	0	0	0	110.5	V103 I347 N350 L355 L356 T357	V103-Y353 HydrophobicContact CG2-CD1 3.66Å; V103-Y353 HydrophobicContact CG2-CE1 3.89Å; I347-Y353 HydrophobicContact CG2-CD1 3.59Å; I347-Y353 HydrophobicContact CG2-CE1 4.11Å; I347-Y353 HydrophobicContact CG2-CG 3.97Å; N350-Y353 HydrophobicContact CB-CD2 3.76Å; N350-Y353 HydrophobicContact CB-CG 4.36Å; N350-Y353 PolarHBondContact O-N 3.29Å; Y353-L355 VanDerWaalsContact C-N 3.31Å; Y353-L355 PolarHBondContact O-N 3.1Å; Y353-L356 PolarHBondContact O-N 3.26Å; Y353-L356 VanDerWaalsContact O-N 3.11Å; Y353-T357 PolarHBondContact O-N 2.99Å; Y353-T357 PolarHBondContact O-OG1 2.88Å
354	N	85.2	Confident	77.9	Confident	29 Å²	29	46.8 Å²	46.8	16%	0.155	27%	0.273	C	S	.	.	H	α-helix	trans	-58.1	-41.8	176	-66	-25.3	0	0	0	112	S348 N350 L356 T357 F358	S348-N354 PolarHBondContact O-ND2 2.96Å; N350-N354 PolarHBondContact O-N 3.4Å; N350-N354 VanDerWaalsContact O-N 3.17Å; N354-L356 PolarHBondContact O-N 2.95Å; N354-T357 WeakPolarHBondContact O-CB 3.22Å; N354-T357 PolarHBondContact O-N 2.79Å; N354-F358 WeakPolarHBondContact O-CD2 3.48Å; N354-F358 PolarHBondContact O-N 3.34Å
355	L	89.5	Confident	79.8	Confident	44 Å²	44	42.9 Å²	42.9	23%	0.23	24%	0.24	C	C	.	.	H	α-helix	trans	-61.1	-43.5	174.7	-178.5	63.5	0	0	0	112.5	A319 L320 S323 F351 A352 Y353 F358 I359	A319-L355 HydrophobicContact CB-CD1 4.05Å; L320-L355 HydrophobicContact CB-CD1 4.49Å; S323-L355 PolarHBondContact OG-N 2.85Å; F351-L355 HydrophobicContact CE1-CD2 4.46Å; F351-L355 VanDerWaalsContact O-CB 3.28Å; F351-L355 WeakPolarHBondContact O-CB 3.38Å; F351-L355 PolarHBondContact O-N 2.9Å; A352-L355 PolarHBondContact O-N 3.36Å; Y353-L355 VanDerWaalsContact C-N 3.31Å; Y353-L355 PolarHBondContact O-N 3.1Å; L355-F358 PolarHBondContact O-N 2.9Å; L355-I359 HydrophobicContact CD1-CD1 4.37Å; L355-I359 HydrophobicContact CG-CD1 4.1Å; L355-I359 VanDerWaalsContact O-CG1 3.28Å; L355-I359 WeakPolarHBondContact O-CG1 3.24Å; L355-I359 PolarHBondContact O-N 3.11Å
356	L	88.8	Confident	81.4	Confident	51 Å²	51	40.8 Å²	40.8	27%	0.267	22%	0.218	S	C	.	.	H	α-helix	trans	-65.1	-41.5	175.9	-64.7	169.9	0	0	0	111.4	M97 V103 A352 Y353 N354 F358 I359 I360	M97-L356 HydrophobicContact CE-CB 4.07Å; M97-L356 HydrophobicContact CE-CD2 3.47Å; M97-L356 VanDerWaalsContact CE-CD2 3.47Å; M97-L356 HydrophobicContact CE-CG 4.35Å; M97-L356 HydrophobicContact SD-CD2 4.12Å; V103-L356 HydrophobicContact CG1-CB 3.57Å; A352-L356 VanDerWaalsContact O-CG 3.28Å; A352-L356 WeakPolarHBondContact O-CG 3.44Å; A352-L356 PolarHBondContact O-N 3.3Å; A352-L356 VanDerWaalsContact O-N 3.09Å; Y353-L356 PolarHBondContact O-N 3.26Å; Y353-L356 VanDerWaalsContact O-N 3.11Å; N354-L356 PolarHBondContact O-N 2.95Å; L356-F358 PolarHBondContact O-N 3.26Å; L356-I359 PolarHBondContact O-N 3.38Å; L356-I360 WeakPolarHBondContact O-CG1 3.39Å; L356-I360 PolarHBondContact O-N 3.46Å
357	T	88.5	Confident	82.6	Confident	24 Å²	24	35.1 Å²	35.1	15%	0.147	19%	0.188	C	C	.	.	H	α-helix	trans	-56.9	-46.7	174.9	-57.4	0	0	0	0	111.3	V103 P105 Y353 N354 I360 L361	V103-T357 PolarHBondContact O-OG1 3Å; P105-T357 HydrophobicContact CG-CG2 4.29Å; Y353-T357 PolarHBondContact O-N 2.99Å; Y353-T357 PolarHBondContact O-OG1 2.88Å; N354-T357 WeakPolarHBondContact O-CB 3.22Å; N354-T357 PolarHBondContact O-N 2.79Å; T357-I360 PolarHBondContact O-N 3.44Å; T357-L361 WeakPolarHBondContact O-CB 3.11Å; T357-L361 PolarHBondContact O-N 3.13Å
358	F	90.6	Very high	83.8	Confident	3 Å²	3	32.1 Å²	32.1	1%	0.013	17%	0.172	C	C	.	.	H	α-helix	trans	-70	-33.7	177.2	-73.5	-62.1	0	0	0	113.8	A319 S322 A326 N354 L355 L356 I360 L361 Y362 F894	A319-F358 HydrophobicContact CB-CB 3.74Å; S322-F358 VanDerWaalsContact C-CE2 3.5Å; S322-F358 VanDerWaalsContact CB-CD1 3.5Å; S322-F358 VanDerWaalsContact CB-CG 3.5Å; S322-F358 WeakPolarHBondContact O-CE2 3.2Å; A326-F358 HydrophobicContact CB-CE2 4.28Å; N354-F358 WeakPolarHBondContact O-CD2 3.48Å; N354-F358 PolarHBondContact O-N 3.34Å; L355-F358 PolarHBondContact O-N 2.9Å; L356-F358 PolarHBondContact O-N 3.26Å; F358-I360 VanDerWaalsContact C-N 3.28Å; F358-I360 PolarHBondContact O-N 2.74Å; F358-L361 HydrophobicContact CD1-CD2 3.94Å; F358-L361 HydrophobicContact CE1-CD2 4.16Å; F358-L361 PolarHBondContact O-N 2.96Å; F358-Y362 HydrophobicContact CB-CD2 4.41Å; F358-Y362 HydrophobicContact CB-CE2 4.09Å; F358-Y362 AromaticContact CD1-CE2 3.98Å; F358-Y362 HydrophobicContact CD1-CE2 3.98Å; F358-Y362 AromaticContact CD1-CZ 3.99Å; F358-Y362 HydrophobicContact CG-CE2 4.4Å; F358-Y362 VanDerWaalsContact O-CD2 3.23Å; F358-Y362 WeakPolarHBondContact O-CD2 3.46Å; F358-Y362 PolarHBondContact O-N 3.2Å; F358-F894 HydrophobicContact CZ-CB 4.02Å; F358-F894 WeakPolarHBondContact CZ-O 3.38Å
359	I	90.8	Very high	85.1	Confident	15 Å²	15	31.2 Å²	31.2	8%	0.077	17%	0.166	C	C	.	.	H	α-helix	trans	-61.8	-38.4	171.7	-72.8	167.7	0	0	0	110.8	I94 M97 L315 L316 A319 L355 L356 N363	I94-I359 HydrophobicContact CD1-CG2 3.64Å; M97-I359 HydrophobicContact CE-CB 4.04Å; M97-I359 HydrophobicContact CE-CG2 3.61Å; M97-I359 HydrophobicContact SD-CG2 4.26Å; L315-I359 HydrophobicContact CD2-CB 4.45Å; L315-I359 HydrophobicContact CD2-CG1 4.28Å; L315-I359 HydrophobicContact CD2-CG2 4.22Å; L316-I359 HydrophobicContact CD2-CD1 3.87Å; L316-I359 HydrophobicContact CD2-CG1 4.16Å; A319-I359 HydrophobicContact CB-CG1 3.7Å; L355-I359 HydrophobicContact CD1-CD1 4.37Å; L355-I359 HydrophobicContact CG-CD1 4.1Å; L355-I359 VanDerWaalsContact O-CG1 3.28Å; L355-I359 WeakPolarHBondContact O-CG1 3.24Å; L355-I359 PolarHBondContact O-N 3.11Å; L356-I359 PolarHBondContact O-N 3.38Å; I359-N363 PolarHBondContact O-N 3.27Å
360	I	89	Confident	86.2	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-73.4	-40.1	175.1	-62.9	174.1	0	0	0	111.3	M97 Q98 V103 L356 T357 F358 Y362 N363	M97-I360 HydrophobicContact CB-CD1 4.29Å; M97-I360 HydrophobicContact CB-CG1 4.49Å; M97-I360 HydrophobicContact CE-CD1 4.37Å; M97-I360 HydrophobicContact CE-CG1 3.95Å; Q98-I360 HydrophobicContact CG-CD1 4.14Å; Q98-I360 HydrophobicContact CG-CG1 4.35Å; Q98-I360 HydrophobicContact CG-CG2 3.84Å; V103-I360 HydrophobicContact CG1-CD1 3.96Å; L356-I360 WeakPolarHBondContact O-CG1 3.39Å; L356-I360 PolarHBondContact O-N 3.46Å; T357-I360 PolarHBondContact O-N 3.44Å; F358-I360 VanDerWaalsContact C-N 3.28Å; F358-I360 PolarHBondContact O-N 2.74Å; I360-Y362 PolarHBondContact O-N 2.84Å; I360-N363 WeakPolarHBondContact O-CB 3.33Å; I360-N363 PolarHBondContact O-N 2.91Å; I360-N363 PolarHBondContact O-OD1 2.93Å
361	L	88.3	Confident	86.4	Confident	6 Å²	6	24.4 Å²	24.4	3%	0.031	13%	0.13	C	C	.	.	H	α-helix	trans	-59.4	-45.2	179.2	-178.1	62.3	0	0	0	112	P105 T357 F358 E885 I898	P105-L361 HydrophobicContact CG-CB 4.4Å; P105-L361 HydrophobicContact CG-CD1 4.41Å; T357-L361 WeakPolarHBondContact O-CB 3.11Å; T357-L361 PolarHBondContact O-N 3.13Å; F358-L361 HydrophobicContact CD1-CD2 3.94Å; F358-L361 HydrophobicContact CE1-CD2 4.16Å; F358-L361 PolarHBondContact O-N 2.96Å; L361-E885 HydrophobicContact CD1-CB 4.4Å; L361-E885 HydrophobicContact CD1-CG 4.49Å; L361-E885 HydrophobicContact CG-CB 4.43Å; L361-I898 HydrophobicContact CD1-CG2 3.52Å
362	Y	90.3	Very high	86.3	Confident	2 Å²	2	21.3 Å²	21.3	1%	0.008	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	4	-177.6	-53.8	-42.5	0	0	0	114	L315 M318 A319 S322 F358 I360 N364 L365 E885 L886	L315-Y362 WeakPolarHBondContact CD1-O 3.22Å; M318-Y362 HydrophobicContact CB-CD2 4.2Å; M318-Y362 HydrophobicContact CB-CE2 4.23Å; A319-Y362 HydrophobicContact CB-CD2 4.37Å; S322-Y362 WeakPolarHBondContact OG-CE2 3.48Å; S322-Y362 PolarHBondContact OG-OH 3.45Å; F358-Y362 HydrophobicContact CB-CD2 4.41Å; F358-Y362 HydrophobicContact CB-CE2 4.09Å; F358-Y362 AromaticContact CD1-CE2 3.98Å; F358-Y362 HydrophobicContact CD1-CE2 3.98Å; F358-Y362 AromaticContact CD1-CZ 3.99Å; F358-Y362 HydrophobicContact CG-CE2 4.4Å; F358-Y362 VanDerWaalsContact O-CD2 3.23Å; F358-Y362 WeakPolarHBondContact O-CD2 3.46Å; F358-Y362 PolarHBondContact O-N 3.2Å; I360-Y362 PolarHBondContact O-N 2.84Å; Y362-N364 VanDerWaalsContact C-N 3.28Å; Y362-N364 PolarHBondContact O-N 3.41Å; Y362-L365 WeakPolarHBondContact O-CB 3.48Å; Y362-L365 PolarHBondContact O-N 2.77Å; Y362-L365 VanDerWaalsContact O-N 3.08Å; Y362-E885 HydrophobicContact CE1-CB 4.45Å; Y362-L886 HydrophobicContact CE1-CB 3.99Å; Y362-L886 WeakPolarHBondContact OH-CD1 3.37Å
363	N	87.2	Confident	86.4	Confident	2 Å²	2	19 Å²	19	1%	0.011	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-55.2	-38.8	-173.2	73.2	-22.3	0	0	0	114.1	I94 T111 I359 I360 L365 I366	I94-N363 HydrophobicContact CG2-CB 3.87Å; I94-N363 WeakPolarHBondContact CG2-ND2 3.43Å; T111-N363 PolarHBondContact OG1-ND2 2.65Å; T111-N363 VanDerWaalsContact OG1-ND2 3.07Å; I359-N363 PolarHBondContact O-N 3.27Å; I360-N363 WeakPolarHBondContact O-CB 3.33Å; I360-N363 PolarHBondContact O-N 2.91Å; I360-N363 PolarHBondContact O-OD1 2.93Å; N363-L365 PolarHBondContact O-N 2.92Å; N363-I366 PolarHBondContact O-N 3.5Å
364	N	84.8	Confident	86.6	Confident	19 Å²	19	15.6 Å²	15.6	10%	0.102	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-74.5	-4.7	-176.4	-61.9	-55.6	0	0	0	113.8	Y362 I366 N878 Y882	Y362-N364 VanDerWaalsContact C-N 3.28Å; Y362-N364 PolarHBondContact O-N 3.41Å; N364-I366 PolarHBondContact O-N 2.72Å; N364-N878 PolarHBondContact O-OD1 3.19Å; N364-Y882 VanDerWaalsContact C-CD2 3.42Å; N364-Y882 HydrophobicContact CB-CD1 3.92Å; N364-Y882 HydrophobicContact CB-CD2 3.66Å; N364-Y882 HydrophobicContact CB-CE1 3.63Å; N364-Y882 HydrophobicContact CB-CE2 3.35Å; N364-Y882 HydrophobicContact CB-CG 3.94Å; N364-Y882 WeakPolarHBondContact O-CD2 3.26Å; N364-Y882 WeakPolarHBondContact O-CE2 3.38Å
365	L	86.8	Confident	86.6	Confident	4 Å²	4	15.9 Å²	15.9	2%	0.021	9%	0.086	C	C	.	.	G	3₁₀ helix	trans	-52.7	-33.9	166.7	-172.3	80.5	0	0	0	111.1	L311 L315 M318 Y362 N363 P367 V879 I883	L311-L365 HydrophobicContact CD2-CD2 4.41Å; L315-L365 HydrophobicContact CB-CD2 4.4Å; M318-L365 HydrophobicContact CE-CD1 4.45Å; M318-L365 HydrophobicContact CE-CD2 3.64Å; Y362-L365 WeakPolarHBondContact O-CB 3.48Å; Y362-L365 PolarHBondContact O-N 2.77Å; Y362-L365 VanDerWaalsContact O-N 3.08Å; N363-L365 PolarHBondContact O-N 2.92Å; L365-P367 WeakPolarHBondContact O-CD 3.48Å; L365-V879 HydrophobicContact CD1-CG2 4.08Å; L365-I883 HydrophobicContact CD1-CD1 4.41Å; L365-I883 HydrophobicContact CD1-CG1 4.01Å
366	I	86.5	Confident	86.5	Confident	1 Å²	1	16.3 Å²	16.3	1%	0.005	9%	0.091	C	C	.	.	S	Bend	trans	-92	113.3	172	-54.2	-176.5	0	0	0	108.2	F90 F91 I308 L311 F312 N363 N364 I368	F90-I366 HydrophobicContact CD1-CD1 4.21Å; F90-I366 HydrophobicContact CE1-CB 4.03Å; F90-I366 HydrophobicContact CE1-CD1 3.75Å; F90-I366 HydrophobicContact CE1-CG1 4.31Å; F90-I366 HydrophobicContact CE1-CG2 4.4Å; F90-I366 HydrophobicContact CZ-CD1 3.93Å; F91-I366 HydrophobicContact CE1-CB 4.39Å; F91-I366 HydrophobicContact CE1-CG2 4.26Å; F91-I366 HydrophobicContact CZ-CB 4.39Å; F91-I366 HydrophobicContact CZ-CG2 3.82Å; I308-I366 HydrophobicContact CG1-CG2 4.35Å; I308-I366 HydrophobicContact CG2-CD1 4.41Å; I308-I366 HydrophobicContact CG2-CG2 3.81Å; L311-I366 HydrophobicContact CB-CD1 4.5Å; L311-I366 HydrophobicContact CB-CG1 4.25Å; F312-I366 HydrophobicContact CB-CD1 3.78Å; N363-I366 PolarHBondContact O-N 3.5Å; N364-I366 PolarHBondContact O-N 2.72Å; I366-I368 PolarHBondContact O-N 2.81Å
367	P	83.3	Confident	86.7	Confident	4 Å²	4	13.9 Å²	13.9	3%	0.026	8%	0.078	C	C	.	.			trans	-72.1	101.7	-170	27.3	-35.5	0	0	0	112.9	L365 S369 L370 F875 N878	L365-P367 WeakPolarHBondContact O-CD 3.48Å; P367-S369 PolarHBondContact O-N 2.72Å; P367-L370 HydrophobicContact CB-CB 3.93Å; P367-L370 HydrophobicContact CG-CB 3.7Å; P367-L370 HydrophobicContact CG-CD2 3.94Å; P367-L370 HydrophobicContact CG-CG 4.44Å; P367-L370 VanDerWaalsContact O-CB 3.28Å; P367-L370 WeakPolarHBondContact O-CB 3.45Å; P367-L370 PolarHBondContact O-N 2.79Å; P367-F875 HydrophobicContact CG-CD1 3.91Å; P367-F875 HydrophobicContact CG-CE1 3.82Å; P367-F875 HydrophobicContact CG-CZ 4.41Å; P367-N878 HydrophobicContact CB-CB 4.45Å
368	I	82.1	Confident	86.8	Confident	17 Å²	17	13.4 Å²	13.4	9%	0.087	7%	0.074	C	C	.	.	H	α-helix	trans	-48.9	-44.8	171.5	-63.1	163	0	0	0	111.2	F91 T111 P114 I118 I366 L370	F91-I368 HydrophobicContact CD1-CD1 4.3Å; F91-I368 HydrophobicContact CD1-CG1 3.55Å; F91-I368 HydrophobicContact CD2-CG1 4.38Å; F91-I368 HydrophobicContact CE1-CB 4.28Å; F91-I368 HydrophobicContact CE1-CD1 4.29Å; F91-I368 HydrophobicContact CE1-CG1 3.25Å; F91-I368 HydrophobicContact CE2-CB 4.42Å; F91-I368 HydrophobicContact CE2-CG1 4.15Å; F91-I368 HydrophobicContact CG-CG1 4.12Å; F91-I368 HydrophobicContact CZ-CB 4.13Å; F91-I368 HydrophobicContact CZ-CG1 3.59Å; T111-I368 HydrophobicContact CG2-CD1 4.08Å; P114-I368 HydrophobicContact CB-CG2 3.97Å; I118-I368 HydrophobicContact CD1-CG2 3.63Å; I118-I368 WeakPolarHBondContact CD1-O 3.4Å; I366-I368 PolarHBondContact O-N 2.81Å; I368-L370 VanDerWaalsContact C-N 3.26Å; I368-L370 PolarHBondContact O-N 3.36Å
369	S	83.6	Confident	86.7	Confident	23 Å²	23	18.4 Å²	18.4	16%	0.161	10%	0.096	C	C	.	.	H	α-helix	trans	-68.9	-17.1	-177.4	59.6	0	0	0	0	114.6	P367 L371 V372 T373	P367-S369 PolarHBondContact O-N 2.72Å; S369-L371 VanDerWaalsContact C-N 3.32Å; S369-L371 PolarHBondContact O-N 2.85Å; S369-V372 PolarHBondContact O-N 3.06Å; S369-T373 VanDerWaalsContact O-CB 3.3Å; S369-T373 WeakPolarHBondContact O-CB 3.48Å; S369-T373 PolarHBondContact O-N 3.34Å; S369-T373 PolarHBondContact O-OG1 3.21Å
370	L	86.4	Confident	86.8	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-59.6	-42.8	-176.9	174.6	63.5	0	0	0	111.6	T304 P367 I368 T373 L374 I871 C874 F875	T304-L370 HydrophobicContact CG2-CD2 4.11Å; P367-L370 HydrophobicContact CB-CB 3.93Å; P367-L370 HydrophobicContact CG-CB 3.7Å; P367-L370 HydrophobicContact CG-CD2 3.94Å; P367-L370 HydrophobicContact CG-CG 4.44Å; P367-L370 VanDerWaalsContact O-CB 3.28Å; P367-L370 WeakPolarHBondContact O-CB 3.45Å; P367-L370 PolarHBondContact O-N 2.79Å; I368-L370 VanDerWaalsContact C-N 3.26Å; I368-L370 PolarHBondContact O-N 3.36Å; L370-T373 PolarHBondContact O-N 2.91Å; L370-L374 HydrophobicContact CD1-CD1 3.8Å; L370-L374 HydrophobicContact CD1-CD2 4.45Å; L370-L374 HydrophobicContact CD1-CG 3.88Å; L370-L374 HydrophobicContact CG-CD1 4Å; L370-L374 HydrophobicContact CG-CG 4.41Å; L370-L374 WeakPolarHBondContact O-CB 3.35Å; L370-L374 VanDerWaalsContact O-CG 3.28Å; L370-L374 WeakPolarHBondContact O-CG 3.45Å; L370-L374 PolarHBondContact O-N 2.79Å; L370-I871 HydrophobicContact CD1-CG1 4.37Å; L370-C874 HydrophobicContact CD1-CB 3.72Å; L370-F875 HydrophobicContact CD2-CD2 4.3Å; L370-F875 HydrophobicContact CD2-CE1 4.36Å; L370-F875 HydrophobicContact CD2-CE2 3.56Å; L370-F875 HydrophobicContact CD2-CZ 3.59Å
371	L	81.2	Confident	87	Confident	31 Å²	31	19.2 Å²	19.2	16%	0.162	10%	0.102	C	C	.	.	H	α-helix	trans	-62.8	-50	-176.1	-60.7	177.2	0	0	0	111.6	A87 F91 S369 L374 E375	A87-L371 HydrophobicContact CB-CD1 3.91Å; F91-L371 HydrophobicContact CE2-CD1 4.43Å; S369-L371 VanDerWaalsContact C-N 3.32Å; S369-L371 PolarHBondContact O-N 2.85Å; L371-L374 PolarHBondContact O-N 3.49Å; L371-E375 PolarHBondContact O-N 3.34Å
372	V	81.2	Confident	87.2	Confident	22 Å²	22	19.2 Å²	19.2	13%	0.133	10%	0.102	C	C	.	.	H	α-helix	trans	-70	-36.8	177	164.4	0	0	0	0	112.3	I118 S369 L374 E375 V376	I118-V372 HydrophobicContact CB-CG2 3.99Å; I118-V372 HydrophobicContact CD1-CG2 4.28Å; I118-V372 HydrophobicContact CG1-CG2 3.6Å; I118-V372 HydrophobicContact CG2-CG2 3.87Å; S369-V372 PolarHBondContact O-N 3.06Å; V372-L374 VanDerWaalsContact C-N 3.27Å; V372-L374 PolarHBondContact O-N 3.39Å; V372-E375 PolarHBondContact O-N 3.37Å; V372-V376 HydrophobicContact CG1-CG2 4.13Å; V372-V376 WeakPolarHBondContact O-CB 3.24Å; V372-V376 WeakPolarHBondContact O-CG2 3.07Å; V372-V376 PolarHBondContact O-N 3.25Å
373	T	87.6	Confident	87.2	Confident	9 Å²	9	21.2 Å²	21.2	6%	0.055	11%	0.113	C	C	.	.	H	α-helix	trans	-56.8	-46.1	173.8	-57.2	0	0	0	0	109.7	S369 L370 V377 P917 F918	S369-T373 VanDerWaalsContact O-CB 3.3Å; S369-T373 WeakPolarHBondContact O-CB 3.48Å; S369-T373 PolarHBondContact O-N 3.34Å; S369-T373 PolarHBondContact O-OG1 3.21Å; L370-T373 PolarHBondContact O-N 2.91Å; T373-V377 HydrophobicContact CG2-CG2 4.31Å; T373-V377 VanDerWaalsContact O-CB 3.22Å; T373-V377 WeakPolarHBondContact O-CB 3.41Å; T373-V377 WeakPolarHBondContact O-CG2 3.24Å; T373-V377 PolarHBondContact O-N 3.11Å; T373-P917 HydrophobicContact CG2-CB 3.85Å; T373-F918 HydrophobicContact CG2-CD1 4.11Å; T373-F918 HydrophobicContact CG2-CE1 3.86Å; T373-F918 HydrophobicContact CG2-CZ 4.21Å
374	L	88.1	Confident	87.6	Confident	21 Å²	21	24.1 Å²	24.1	11%	0.11	13%	0.126	C	C	.	.	H	α-helix	trans	-68.2	-45.3	177.2	-68.9	177.9	0	0	0	113.4	L370 L371 V372 V376 V377 K378 V867 I871	L370-L374 HydrophobicContact CD1-CD1 3.8Å; L370-L374 HydrophobicContact CD1-CD2 4.45Å; L370-L374 HydrophobicContact CD1-CG 3.88Å; L370-L374 HydrophobicContact CG-CD1 4Å; L370-L374 HydrophobicContact CG-CG 4.41Å; L370-L374 WeakPolarHBondContact O-CB 3.35Å; L370-L374 VanDerWaalsContact O-CG 3.28Å; L370-L374 WeakPolarHBondContact O-CG 3.45Å; L370-L374 PolarHBondContact O-N 2.79Å; L371-L374 PolarHBondContact O-N 3.49Å; V372-L374 VanDerWaalsContact C-N 3.27Å; V372-L374 PolarHBondContact O-N 3.39Å; L374-V376 VanDerWaalsContact C-N 3.3Å; L374-V376 PolarHBondContact O-N 3.41Å; L374-V377 PolarHBondContact O-N 3.44Å; L374-K378 VanDerWaalsContact O-CB 3.26Å; L374-K378 WeakPolarHBondContact O-CB 3.19Å; L374-K378 VanDerWaalsContact O-CG 3.26Å; L374-K378 WeakPolarHBondContact O-CG 3.35Å; L374-K378 PolarHBondContact O-N 2.92Å; L374-V867 HydrophobicContact CD2-CG1 4.17Å; L374-I871 HydrophobicContact CD1-CD1 4.36Å; L374-I871 HydrophobicContact CD1-CG1 3.94Å; L374-I871 HydrophobicContact CD2-CG1 3.95Å
375	E	84.5	Confident	88.1	Confident	34 Å²	34	23.3 Å²	23.3	16%	0.159	12%	0.121	C	C	.	.	H	α-helix	trans	-61.1	-38.7	178.8	-74.3	-173.4	167.7	0	0	111.7	R85 L371 V372 F379	R85-E375 IonicContact CZ-OE1 2.71Å; R85-E375 IonicContact NH1-OE1 2.71Å; R85-E375 PolarHBondContact NH1-OE1 2.68Å; R85-E375 IonicContact NH2-OE1 2.66Å; L371-E375 PolarHBondContact O-N 3.34Å; V372-E375 PolarHBondContact O-N 3.37Å; E375-F379 VanDerWaalsContact O-CB 3.29Å; E375-F379 WeakPolarHBondContact O-CB 3.45Å; E375-F379 PolarHBondContact O-N 3.06Å
376	V	87.6	Confident	88.4	Confident	54 Å²	54	25.5 Å²	25.5	33%	0.327	13%	0.133	S	C	.	.	H	α-helix	trans	-73	-42.3	175.3	171.2	0	0	0	0	112.6	V372 L374 F379 T380 F918	V372-V376 HydrophobicContact CG1-CG2 4.13Å; V372-V376 WeakPolarHBondContact O-CB 3.24Å; V372-V376 WeakPolarHBondContact O-CG2 3.07Å; V372-V376 PolarHBondContact O-N 3.25Å; L374-V376 VanDerWaalsContact C-N 3.3Å; L374-V376 PolarHBondContact O-N 3.41Å; V376-F379 PolarHBondContact O-N 2.74Å; V376-T380 PolarHBondContact O-N 2.52Å; V376-T380 PolarHBondContact O-OG1 3.4Å; V376-F918 HydrophobicContact CB-CE1 3.96Å; V376-F918 HydrophobicContact CG1-CD1 4.41Å; V376-F918 HydrophobicContact CG1-CE1 3.75Å; V376-F918 HydrophobicContact CG1-CZ 4.44Å
377	V	92.3	Very high	88.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-57.9	-49.9	174.7	160.7	0	0	0	0	110.3	T373 L374 T380 Q381 V867 F918 G921 I922	T373-V377 HydrophobicContact CG2-CG2 4.31Å; T373-V377 VanDerWaalsContact O-CB 3.22Å; T373-V377 WeakPolarHBondContact O-CB 3.41Å; T373-V377 WeakPolarHBondContact O-CG2 3.24Å; T373-V377 PolarHBondContact O-N 3.11Å; L374-V377 PolarHBondContact O-N 3.44Å; V377-T380 PolarHBondContact O-N 3.05Å; V377-Q381 HydrophobicContact CG1-CG 4.49Å; V377-Q381 WeakPolarHBondContact O-CG 3.31Å; V377-Q381 PolarHBondContact O-N 3.1Å; V377-V867 HydrophobicContact CG1-CG2 4.47Å; V377-F918 HydrophobicContact CG2-CD1 3.87Å; V377-F918 HydrophobicContact CG2-CE1 4.35Å; V377-G921 VanDerWaalsContact CG1-O 3.29Å; V377-G921 WeakPolarHBondContact CG1-O 3.36Å; V377-I922 HydrophobicContact CG2-CD1 4.46Å; V377-I922 HydrophobicContact CG2-CG1 4.08Å
378	K	90.4	Very high	89.3	Confident	13 Å²	13	34.6 Å²	34.6	6%	0.057	17%	0.168	C	C	.	.	H	α-helix	trans	-64.4	-39.7	179	-74.6	-172.9	-177.6	-160.4	0	112.6	L374 Q381 A382 S405 N406 N408 E409 V867	L374-K378 VanDerWaalsContact O-CB 3.26Å; L374-K378 WeakPolarHBondContact O-CB 3.19Å; L374-K378 VanDerWaalsContact O-CG 3.26Å; L374-K378 WeakPolarHBondContact O-CG 3.35Å; L374-K378 PolarHBondContact O-N 2.92Å; K378-Q381 PolarHBondContact O-N 3.17Å; K378-A382 WeakPolarHBondContact O-CB 3.46Å; K378-A382 PolarHBondContact O-N 3.22Å; K378-S405 WeakPolarHBondContact CB-O 3.42Å; K378-N406 PolarHBondContact NZ-O 3.09Å; K378-N408 PolarHBondContact O-ND2 3.27Å; K378-E409 VanDerWaalsContact CE-CD 3.47Å; K378-E409 WeakPolarHBondContact CE-OE1 3.41Å; K378-E409 WeakPolarHBondContact CE-OE2 3.48Å; K378-E409 IonicContact NZ-OE1 2.76Å; K378-E409 PolarHBondContact NZ-OE1 2.73Å; K378-E409 IonicContact NZ-OE2 3.1Å; K378-E409 PolarHBondContact NZ-OE2 2.88Å; K378-V867 HydrophobicContact CG-CG2 4.45Å
379	F	88.8	Confident	89.9	Confident	108 Å²	108	39.5 Å²	39.5	47%	0.474	20%	0.199	S	C	.	.	H	α-helix	trans	-62.7	-43.8	174.4	-176.7	-104.2	0	0	0	111.8	E375 V376 A382 L383	E375-F379 VanDerWaalsContact O-CB 3.29Å; E375-F379 WeakPolarHBondContact O-CB 3.45Å; E375-F379 PolarHBondContact O-N 3.06Å; V376-F379 PolarHBondContact O-N 2.74Å; F379-A382 PolarHBondContact O-N 3.3Å; F379-L383 HydrophobicContact CD1-CD1 4.19Å; F379-L383 HydrophobicContact CE1-CD1 3.76Å; F379-L383 HydrophobicContact CE1-CG 4.34Å; F379-L383 HydrophobicContact CZ-CD1 4.32Å; F379-L383 PolarHBondContact O-N 2.85Å
380	T	92.3	Very high	90.3	Very high	31 Å²	31	43.6 Å²	43.6	19%	0.19	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-40.3	175.8	-50.4	0	0	0	0	112.3	V376 V377 A382 L383 F384 I922	V376-T380 PolarHBondContact O-N 2.52Å; V376-T380 PolarHBondContact O-OG1 3.4Å; V377-T380 PolarHBondContact O-N 3.05Å; T380-A382 VanDerWaalsContact C-N 3.33Å; T380-A382 PolarHBondContact O-N 2.9Å; T380-L383 WeakPolarHBondContact O-CB 3.44Å; T380-L383 PolarHBondContact O-N 3.14Å; T380-F384 HydrophobicContact CG2-CE1 4.09Å; T380-F384 HydrophobicContact CG2-CE2 4.22Å; T380-F384 HydrophobicContact CG2-CZ 3.85Å; T380-F384 PolarHBondContact O-N 2.9Å; T380-I922 HydrophobicContact CG2-CD1 4.19Å; T380-I922 HydrophobicContact CG2-CG1 4.37Å; T380-I922 HydrophobicContact CG2-CG2 3.74Å
381	Q	94.3	Very high	90.6	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.009	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-39.4	173.5	-74.6	170.3	-1.9	0	0	112.3	V377 K378 L383 F384 I385 N408 G921	V377-Q381 HydrophobicContact CG1-CG 4.49Å; V377-Q381 WeakPolarHBondContact O-CG 3.31Å; V377-Q381 PolarHBondContact O-N 3.1Å; K378-Q381 PolarHBondContact O-N 3.17Å; Q381-L383 VanDerWaalsContact C-N 3.35Å; Q381-F384 PolarHBondContact O-N 2.97Å; Q381-I385 PolarHBondContact O-N 3.21Å; Q381-I385 VanDerWaalsContact O-N 3.15Å; Q381-N408 WeakPolarHBondContact CB-ND2 3.45Å; Q381-N408 PolarHBondContact OE1-ND2 2.96Å; Q381-G921 PolarHBondContact NE2-O 2.85Å
382	A	91.3	Very high	91.1	Very high	5 Å²	5	46.2 Å²	46.2	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-65.2	-37.2	174.8	0	0	0	0	0	111.9	K378 F379 T380 F384 I385 N386 A402 N408	K378-A382 WeakPolarHBondContact O-CB 3.46Å; K378-A382 PolarHBondContact O-N 3.22Å; F379-A382 PolarHBondContact O-N 3.3Å; T380-A382 VanDerWaalsContact C-N 3.33Å; T380-A382 PolarHBondContact O-N 2.9Å; A382-F384 VanDerWaalsContact C-N 3.34Å; A382-F384 PolarHBondContact O-N 2.67Å; A382-I385 PolarHBondContact O-N 3.11Å; A382-N386 PolarHBondContact O-N 3.48Å; A382-N386 VanDerWaalsContact O-N 3.11Å; A382-N386 PolarHBondContact O-OD1 3.4Å; A382-N386 VanDerWaalsContact O-OD1 3.09Å; A382-A402 HydrophobicContact CB-CB 3.79Å; A382-N408 PolarHBondContact N-ND2 3.15Å
383	L	91.6	Very high	91.6	Very high	45 Å²	45	47.3 Å²	47.3	24%	0.236	23%	0.226	C	C	.	.	H	α-helix	trans	-63.7	-36.3	171.2	-67.1	175.5	0	0	0	112.6	F379 T380 Q381 I385 N386 W387	F379-L383 HydrophobicContact CD1-CD1 4.19Å; F379-L383 HydrophobicContact CE1-CD1 3.76Å; F379-L383 HydrophobicContact CE1-CG 4.34Å; F379-L383 HydrophobicContact CZ-CD1 4.32Å; F379-L383 PolarHBondContact O-N 2.85Å; T380-L383 WeakPolarHBondContact O-CB 3.44Å; T380-L383 PolarHBondContact O-N 3.14Å; Q381-L383 VanDerWaalsContact C-N 3.35Å; L383-I385 VanDerWaalsContact C-N 3.33Å; L383-I385 PolarHBondContact O-N 2.9Å; L383-N386 CarbonylContact O-C 3.43Å; L383-N386 PolarHBondContact O-N 3.31Å; L383-W387 HydrophobicContact CB-CD2 4.39Å; L383-W387 HydrophobicContact CB-CE3 4.28Å; L383-W387 HydrophobicContact CB-CH2 4.06Å; L383-W387 HydrophobicContact CB-CZ2 4.17Å; L383-W387 HydrophobicContact CB-CZ3 4.11Å; L383-W387 HydrophobicContact CD1-CH2 4.04Å; L383-W387 HydrophobicContact CD1-CZ2 4.28Å; L383-W387 HydrophobicContact CD2-CZ2 4.26Å; L383-W387 HydrophobicContact CG-CZ2 4.48Å; L383-W387 WeakPolarHBondContact O-CB 3.06Å; L383-W387 VanDerWaalsContact O-CG 3.23Å; L383-W387 PolarHBondContact O-N 3.34Å
384	F	94.7	Very high	91.6	Very high	63 Å²	63	51.2 Å²	51.2	28%	0.276	25%	0.253	S	S	.	.	H	α-helix	trans	-67.9	-28.5	174.9	-66.3	-17.7	0	0	0	113.8	T380 Q381 A382 W387 I922 F923	T380-F384 HydrophobicContact CG2-CE1 4.09Å; T380-F384 HydrophobicContact CG2-CE2 4.22Å; T380-F384 HydrophobicContact CG2-CZ 3.85Å; T380-F384 PolarHBondContact O-N 2.9Å; Q381-F384 PolarHBondContact O-N 2.97Å; A382-F384 VanDerWaalsContact C-N 3.34Å; A382-F384 PolarHBondContact O-N 2.67Å; F384-W387 HydrophobicContact CD1-CE3 4.11Å; F384-W387 HydrophobicContact CD1-CZ3 4.35Å; F384-W387 HydrophobicContact CE1-CZ3 4.41Å; F384-I922 HydrophobicContact CE2-CG2 3.52Å; F384-I922 HydrophobicContact CZ-CG2 3.68Å; F384-F923 HydrophobicContact CZ-CE1 4.17Å
385	I	94.8	Very high	91.5	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-67.8	-43.3	168.9	-68.9	166.8	0	0	0	109.7	Q381 A382 L383 W387 D388 M391 A400 A402 L411 Y844 L855 H859	Q381-I385 PolarHBondContact O-N 3.21Å; Q381-I385 VanDerWaalsContact O-N 3.15Å; A382-I385 PolarHBondContact O-N 3.11Å; L383-I385 VanDerWaalsContact C-N 3.33Å; L383-I385 PolarHBondContact O-N 2.9Å; I385-W387 VanDerWaalsContact C-N 3.26Å; I385-W387 PolarHBondContact O-N 2.87Å; I385-D388 PolarHBondContact O-N 2.79Å; I385-M391 HydrophobicContact CG2-CE 4Å; I385-A400 HydrophobicContact CG2-CB 4.42Å; I385-A402 HydrophobicContact CB-CB 4.31Å; I385-A402 HydrophobicContact CD1-CB 4.35Å; I385-A402 HydrophobicContact CG2-CB 4.16Å; I385-L411 HydrophobicContact CD1-CD1 4.41Å; I385-Y844 HydrophobicContact CD1-CE1 4.1Å; I385-L855 HydrophobicContact CD1-CD1 4.24Å; I385-L855 HydrophobicContact CG1-CD1 4.49Å; I385-L855 HydrophobicContact CG2-CD1 4.06Å; I385-H859 HydrophobicContact CD1-CB 4.31Å; I385-H859 HydrophobicContact CG1-CB 4.01Å
386	N	93.3	Very high	91.4	Very high	49 Å²	49	59 Å²	59	26%	0.262	29%	0.294	S	S	.	.	H	α-helix	trans	-72.8	-13.1	-178.1	-59.1	-2.2	0	0	0	114.5	A382 L383 A400 M401 A402	A382-N386 PolarHBondContact O-N 3.48Å; A382-N386 VanDerWaalsContact O-N 3.11Å; A382-N386 PolarHBondContact O-OD1 3.4Å; A382-N386 VanDerWaalsContact O-OD1 3.09Å; L383-N386 CarbonylContact O-C 3.43Å; L383-N386 PolarHBondContact O-N 3.31Å; N386-A400 WeakPolarHBondContact CA-O 3.4Å; N386-M401 WeakPolarHBondContact OD1-CA 3.46Å; N386-A402 PolarHBondContact OD1-N 3Å
387	W	94.5	Very high	91.4	Very high	173 Å²	173	62.4 Å²	62.4	66%	0.655	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110	10.1	179.9	-63	-23.7	0	0	0	112.9	L383 F384 I385 V389	L383-W387 HydrophobicContact CB-CD2 4.39Å; L383-W387 HydrophobicContact CB-CE3 4.28Å; L383-W387 HydrophobicContact CB-CH2 4.06Å; L383-W387 HydrophobicContact CB-CZ2 4.17Å; L383-W387 HydrophobicContact CB-CZ3 4.11Å; L383-W387 HydrophobicContact CD1-CH2 4.04Å; L383-W387 HydrophobicContact CD1-CZ2 4.28Å; L383-W387 HydrophobicContact CD2-CZ2 4.26Å; L383-W387 HydrophobicContact CG-CZ2 4.48Å; L383-W387 WeakPolarHBondContact O-CB 3.06Å; L383-W387 VanDerWaalsContact O-CG 3.23Å; L383-W387 PolarHBondContact O-N 3.34Å; F384-W387 HydrophobicContact CD1-CE3 4.11Å; F384-W387 HydrophobicContact CD1-CZ3 4.35Å; F384-W387 HydrophobicContact CE1-CZ3 4.41Å; I385-W387 VanDerWaalsContact C-N 3.26Å; I385-W387 PolarHBondContact O-N 2.87Å; W387-V389 PolarHBondContact O-N 3.02Å
388	D	95.2	Very high	91.1	Very high	23 Å²	23	63.6 Å²	63.6	12%	0.123	32%	0.318	C	S	.	.			trans	-82	106.4	178.9	-165.8	-20.5	0	0	0	111.4	I385 E390 M391 K854 H859	I385-D388 PolarHBondContact O-N 2.79Å; D388-E390 PolarHBondContact O-N 3.49Å; D388-E390 PolarHBondContact OD1-N 3.35Å; D388-E390 VanDerWaalsContact OD1-N 3.09Å; D388-M391 HydrophobicContact CB-CB 4.42Å; D388-M391 HydrophobicContact CB-CE 3.76Å; D388-M391 HydrophobicContact CB-CG 4.41Å; D388-M391 CarbonylContact O-C 3.59Å; D388-M391 PolarHBondContact O-N 2.89Å; D388-K854 IonicContact OD1-NZ 2.69Å; D388-K854 PolarHBondContact OD1-NZ 3.08Å; D388-K854 WeakPolarHBondContact OD2-CD 3.45Å; D388-K854 WeakPolarHBondContact OD2-CE 3.16Å; D388-K854 IonicContact OD2-NZ 2.65Å; D388-K854 PolarHBondContact OD2-NZ 3.22Å; D388-H859 IonicContact OD2-CD2 3.51Å; D388-H859 IonicContact OD2-CE1 3.31Å; D388-H859 IonicContact OD2-NE2 3.34Å; D388-H859 PolarHBondContact OD2-NE2 3.39Å
389	V	93.4	Very high	91.1	Very high	121 Å²	121	65.3 Å²	65.3	73%	0.733	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-63.1	-24.6	-178.1	-176.7	0	0	0	0	112.5	W387 M391 Y392	W387-V389 PolarHBondContact O-N 3.02Å; V389-M391 VanDerWaalsContact C-N 3.28Å; V389-M391 PolarHBondContact O-N 2.78Å; V389-Y392 PolarHBondContact O-N 3.22Å
390	E	91.9	Very high	91.2	Very high	108 Å²	108	60.2 Å²	60.2	51%	0.505	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-80.2	-9	175.9	-62.6	167.1	-135.1	0	0	113	D388 Y851 K854 Q929	D388-E390 PolarHBondContact O-N 3.49Å; D388-E390 PolarHBondContact OD1-N 3.35Å; D388-E390 VanDerWaalsContact OD1-N 3.09Å; E390-Y851 WeakPolarHBondContact O-CE1 3.3Å; E390-K854 HydrophobicContact CB-CD 4.22Å; E390-K854 IonicContact OE1-NZ 2.69Å; E390-K854 PolarHBondContact OE1-NZ 2.58Å; E390-K854 VanDerWaalsContact OE1-NZ 3.17Å; E390-K854 WeakPolarHBondContact OE2-CE 3.4Å; E390-K854 IonicContact OE2-NZ 2.94Å; E390-K854 PolarHBondContact OE2-NZ 3.48Å; E390-Q929 PolarHBondContact OE1-NE2 3.09Å; E390-Q929 PolarHBondContact OE2-NE2 3.45Å
391	M	92.9	Very high	91	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-112.5	24.4	172.1	-54.2	-168.4	-59.7	0	0	111.7	I385 D388 V389 A400 Y851 K854 L855 H859	I385-M391 HydrophobicContact CG2-CE 4Å; D388-M391 HydrophobicContact CB-CB 4.42Å; D388-M391 HydrophobicContact CB-CE 3.76Å; D388-M391 HydrophobicContact CB-CG 4.41Å; D388-M391 CarbonylContact O-C 3.59Å; D388-M391 PolarHBondContact O-N 2.89Å; V389-M391 VanDerWaalsContact C-N 3.28Å; V389-M391 PolarHBondContact O-N 2.78Å; M391-A400 HydrophobicContact CB-CB 3.84Å; M391-A400 HydrophobicContact CE-CB 4.21Å; M391-A400 PolarHBondContact O-N 2.85Å; M391-Y851 HydrophobicContact CB-CD2 4.11Å; M391-Y851 HydrophobicContact CB-CG 4.21Å; M391-Y851 HydrophobicContact CG-CG 4.38Å; M391-K854 HydrophobicContact CG-CB 4.41Å; M391-K854 HydrophobicContact CG-CD 4.02Å; M391-K854 HydrophobicContact SD-CB 4.05Å; M391-K854 HydrophobicContact SD-CD 4.32Å; M391-K854 HydrophobicContact SD-CG 4.21Å; M391-L855 HydrophobicContact SD-CB 4.29Å; M391-H859 VanDerWaalsContact CE-CD2 3.48Å; M391-H859 WeakPolarHBondContact CE-CD2 3.47Å; M391-H859 WeakPolarHBondContact CE-NE2 3.35Å
392	Y	92.9	Very high	90.8	Very high	87 Å²	87	62.8 Å²	62.8	34%	0.341	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.3	172.2	164	-93.2	0	0	0	109.8	V389 D397 P399 Y851	V389-Y392 PolarHBondContact O-N 3.22Å; Y392-D397 WeakPolarHBondContact CE2-OD1 3.46Å; Y392-D397 PolarHBondContact OH-OD1 3.5Å; Y392-P399 HydrophobicContact CD2-CB 4.08Å; Y392-Y851 PolarHBondContact O-OH 2.98Å
393	Y	91.1	Very high	90.4	Very high	46 Å²	46	67 Å²	67	18%	0.18	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	113.5	180	-177.2	-142.4	0	0	0	110.6	E395 T396 D397 T398 A847 Q848	Y393-E395 HydrophobicContact CD2-CB 4.34Å; Y393-E395 HydrophobicContact CD2-CG 4.44Å; Y393-E395 HydrophobicContact CE1-CB 4.2Å; Y393-E395 HydrophobicContact CE2-CB 3.76Å; Y393-E395 HydrophobicContact CE2-CG 3.74Å; Y393-E395 WeakPolarHBondContact CE2-OE2 3.1Å; Y393-E395 PolarHBondContact O-N 3.03Å; Y393-E395 PolarHBondContact OH-OE2 2.85Å; Y393-T396 HydrophobicContact CD1-CG2 4.12Å; Y393-T396 VanDerWaalsContact CD1-OG1 3.24Å; Y393-T396 WeakPolarHBondContact CD1-OG1 3.38Å; Y393-T396 HydrophobicContact CE1-CG2 3.87Å; Y393-D397 PolarHBondContact O-N 2.78Å; Y393-T398 PolarHBondContact N-O 3.17Å; Y393-T398 PolarHBondContact O-N 3.25Å; Y393-T398 VanDerWaalsContact O-N 3.14Å; Y393-A847 HydrophobicContact CD1-CB 3.67Å; Y393-A847 HydrophobicContact CG-CB 3.89Å; Y393-Q848 VanDerWaalsContact CZ-NE2 3.33Å
394	S	88.1	Confident	89.8	Confident	90 Å²	90	66.7 Å²	66.7	63%	0.629	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-21.7	-172.6	53.5	0	0	0	0	114.8	T396	S394-T396 VanDerWaalsContact C-N 3.33Å
395	E	85.6	Confident	89.2	Confident	149 Å²	149	64.1 Å²	64.1	70%	0.696	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-24.9	-177.3	-62	-179.5	175.2	0	0	112.4	Y393	Y393-E395 HydrophobicContact CD2-CB 4.34Å; Y393-E395 HydrophobicContact CD2-CG 4.44Å; Y393-E395 HydrophobicContact CE1-CB 4.2Å; Y393-E395 HydrophobicContact CE2-CB 3.76Å; Y393-E395 HydrophobicContact CE2-CG 3.74Å; Y393-E395 WeakPolarHBondContact CE2-OE2 3.1Å; Y393-E395 PolarHBondContact O-N 3.03Å; Y393-E395 PolarHBondContact OH-OE2 2.85Å
396	T	83.1	Confident	88.7	Confident	70 Å²	70	66.1 Å²	66.1	43%	0.429	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.6	15.1	-178.6	65.7	0	0	0	0	113.9	Y393 S394 T398	Y393-T396 HydrophobicContact CD1-CG2 4.12Å; Y393-T396 VanDerWaalsContact CD1-OG1 3.24Å; Y393-T396 WeakPolarHBondContact CD1-OG1 3.38Å; Y393-T396 HydrophobicContact CE1-CG2 3.87Å; S394-T396 VanDerWaalsContact C-N 3.33Å; T396-T398 PolarHBondContact O-N 3.04Å; T396-T398 PolarHBondContact O-OG1 3.1Å; T396-T398 WeakPolarHBondContact OG1-CB 3.31Å; T396-T398 PolarHBondContact OG1-OG1 2.87Å
397	D	87.1	Confident	88.5	Confident	125 Å²	125	63.8 Å²	63.8	67%	0.668	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.6	44.8	-176.2	-170.5	17.7	0	0	0	112.5	Y392 Y393 P399	Y392-D397 WeakPolarHBondContact CE2-OD1 3.46Å; Y392-D397 PolarHBondContact OH-OD1 3.5Å; Y393-D397 PolarHBondContact O-N 2.78Å; D397-P399 WeakPolarHBondContact O-CD 3.49Å
398	T	85.3	Confident	88.4	Confident	26 Å²	26	55.6 Å²	55.6	16%	0.16	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	102.1	-169.3	-61.9	0	0	0	0	111.3	Y393 T396 A847	Y393-T398 PolarHBondContact N-O 3.17Å; Y393-T398 PolarHBondContact O-N 3.25Å; Y393-T398 VanDerWaalsContact O-N 3.14Å; T396-T398 PolarHBondContact O-N 3.04Å; T396-T398 PolarHBondContact O-OG1 3.1Å; T396-T398 WeakPolarHBondContact OG1-CB 3.31Å; T396-T398 PolarHBondContact OG1-OG1 2.87Å; T398-A847 HydrophobicContact CG2-CB 3.93Å
399	P	90.9	Very high	88.3	Confident	48 Å²	48	54.6 Å²	54.6	31%	0.312	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	154.3	169.9	32	-34.2	0	0	0	111.7	Y392 D397	Y392-P399 HydrophobicContact CD2-CB 4.08Å; D397-P399 WeakPolarHBondContact O-CD 3.49Å
400	A	91.4	Very high	88.4	Confident	2 Å²	2	48.9 Å²	48.9	2%	0.017	25%	0.253	C	S	.	.			trans	-56.3	142.3	162.3	0	0	0	0	0	111.5	I385 N386 M391 S845 I846	I385-A400 HydrophobicContact CG2-CB 4.42Å; N386-A400 WeakPolarHBondContact CA-O 3.4Å; M391-A400 HydrophobicContact CB-CB 3.84Å; M391-A400 HydrophobicContact CE-CB 4.21Å; M391-A400 PolarHBondContact O-N 2.85Å; A400-S845 CarbonylContact C-O 3.59Å; A400-S845 VanDerWaalsContact CA-O 3.32Å; A400-S845 WeakPolarHBondContact CA-O 3.46Å; A400-I846 HydrophobicContact CB-CG2 4.16Å
401	M	88.4	Confident	88.5	Confident	73 Å²	73	43.7 Å²	43.7	36%	0.36	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	105.9	-178.7	-75.8	-169.2	-77.2	0	0	112.1	N386 R403 Y844 S845	N386-M401 WeakPolarHBondContact OD1-CA 3.46Å; M401-R403 PolarHBondContact O-N 2.86Å; M401-Y844 CarbonylContact O-C 3.14Å; M401-Y844 WeakPolarHBondContact O-CA 3.49Å; M401-S845 PolarHBondContact N-O 3.2Å; M401-S845 PolarHBondContact O-N 3.24Å
402	A	88.9	Confident	88.5	Confident	14 Å²	14	43.7 Å²	43.7	12%	0.116	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	106.4	163.3	0	0	0	0	0	110.1	A382 I385 N386 Y844	A382-A402 HydrophobicContact CB-CB 3.79Å; I385-A402 HydrophobicContact CB-CB 4.31Å; I385-A402 HydrophobicContact CD1-CB 4.35Å; I385-A402 HydrophobicContact CG2-CB 4.16Å; N386-A402 PolarHBondContact OD1-N 3Å; A402-Y844 HydrophobicContact CB-CD1 3.69Å; A402-Y844 HydrophobicContact CB-CE1 3.72Å
403	R	82.4	Confident	88.6	Confident	92 Å²	92	40 Å²	40	35%	0.347	22%	0.215	S	C	.	.			trans	-88.4	-44.2	178.8	-64.5	173.9	172.7	-119	7.9	111	M401 T839 N840 S842 D843	M401-R403 PolarHBondContact O-N 2.86Å; R403-T839 PolarHBondContact NE-O 3.1Å; R403-T839 PolarHBondContact NH2-O 3.04Å; R403-T839 VanDerWaalsContact NH2-O 3.12Å; R403-N840 PolarHBondContact NH1-OD1 3.13Å; R403-N840 PolarHBondContact NH2-OD1 3.12Å; R403-S842 WeakPolarHBondContact CD-O 3.38Å; R403-D843 WeakPolarHBondContact CA-O 3.34Å; R403-D843 WeakPolarHBondContact CB-O 3.47Å; R403-D843 PolarHBondContact N-O 3.15Å
404	T	80.2	Confident	88.8	Confident	39 Å²	39	37.9 Å²	37.9	24%	0.239	21%	0.207	C	C	.	.			trans	-101.3	83.3	178.7	-51.2	0	0	0	0	111	N406 L407 D843	T404-N406 PolarHBondContact O-N 3.14Å; T404-L407 HydrophobicContact CG2-CD1 3.77Å; T404-L407 HydrophobicContact CG2-CG 3.89Å; T404-L407 PolarHBondContact O-N 3.45Å; T404-D843 WeakPolarHBondContact CB-OD1 3.36Å; T404-D843 PolarHBondContact N-O 3.18Å; T404-D843 WeakPolarHBondContact OG1-CA 3.25Å; T404-D843 PolarHBondContact OG1-OD1 2.55Å
405	S	82.4	Confident	89	Confident	9 Å²	9	37.5 Å²	37.5	6%	0.063	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-53.7	-20.1	-178.4	65.7	0	0	0	0	115.3	K125 K378 L407 N408	K125-S405 PolarHBondContact NZ-OG 2.81Å; K378-S405 WeakPolarHBondContact CB-O 3.42Å; S405-L407 PolarHBondContact O-N 2.94Å; S405-N408 PolarHBondContact O-OD1 3.23Å
406	N	82.9	Confident	89.5	Confident	44 Å²	44	31 Å²	31	24%	0.235	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-78	-6.6	-170.5	-65	2.6	0	0	0	113.6	K125 K378 T404	K125-N406 PolarHBondContact NZ-OD1 2.89Å; K378-N406 PolarHBondContact NZ-O 3.09Å; T404-N406 PolarHBondContact O-N 3.14Å
407	L	90.3	Very high	90.1	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-113.7	11.5	-171.6	-56.7	175.5	0	0	0	113.8	K296 T404 S405 E409 E410 D843 Y844	K296-L407 HydrophobicContact CB-CD1 3.94Å; K296-L407 HydrophobicContact CB-CD2 4.18Å; K296-L407 HydrophobicContact CD-CD1 3.97Å; T404-L407 HydrophobicContact CG2-CD1 3.77Å; T404-L407 HydrophobicContact CG2-CG 3.89Å; T404-L407 PolarHBondContact O-N 3.45Å; S405-L407 PolarHBondContact O-N 2.94Å; L407-E409 PolarHBondContact O-N 2.97Å; L407-E410 HydrophobicContact CB-CB 4.5Å; L407-E410 HydrophobicContact CB-CG 4.37Å; L407-E410 HydrophobicContact CD2-CG 4.16Å; L407-E410 WeakPolarHBondContact O-CB 3.45Å; L407-E410 PolarHBondContact O-N 3.3Å; L407-D843 HydrophobicContact CD1-CB 4.06Å; L407-D843 VanDerWaalsContact CD1-CG 3.48Å; L407-D843 WeakPolarHBondContact CD1-OD1 3.47Å; L407-Y844 PolarHBondContact O-OH 3.1Å; L407-Y844 VanDerWaalsContact O-OH 3.12Å
408	N	93	Very high	90.6	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-33.1	-174.4	-60.6	-5.8	0	0	0	112.7	K378 Q381 A382 S405 Y844 S863	K378-N408 PolarHBondContact O-ND2 3.27Å; Q381-N408 WeakPolarHBondContact CB-ND2 3.45Å; Q381-N408 PolarHBondContact OE1-ND2 2.96Å; A382-N408 PolarHBondContact N-ND2 3.15Å; S405-N408 PolarHBondContact O-OD1 3.23Å; N408-Y844 VanDerWaalsContact CA-OH 3.27Å; N408-Y844 WeakPolarHBondContact CA-OH 3.48Å; N408-Y844 PolarHBondContact N-OH 2.8Å; N408-Y844 PolarHBondContact OD1-OH 3.03Å; N408-S863 WeakPolarHBondContact O-CB 3.5Å
409	E	93.1	Very high	91.1	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.009	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-23.6	175.8	68.6	-94.7	-125.3	0	0	113.9	S298 V300 K378 L407 L411 G412 Y864 V867	S298-E409 WeakPolarHBondContact OG-CG 3.49Å; S298-E409 PolarHBondContact OG-OE1 2.86Å; V300-E409 HydrophobicContact CB-CG 3.94Å; V300-E409 HydrophobicContact CG2-CG 3.85Å; K378-E409 VanDerWaalsContact CE-CD 3.47Å; K378-E409 WeakPolarHBondContact CE-OE1 3.41Å; K378-E409 WeakPolarHBondContact CE-OE2 3.48Å; K378-E409 IonicContact NZ-OE1 2.76Å; K378-E409 PolarHBondContact NZ-OE1 2.73Å; K378-E409 IonicContact NZ-OE2 3.1Å; K378-E409 PolarHBondContact NZ-OE2 2.88Å; L407-E409 PolarHBondContact O-N 2.97Å; E409-L411 VanDerWaalsContact C-N 3.3Å; E409-L411 PolarHBondContact O-N 3.2Å; E409-G412 PolarHBondContact O-N 2.91Å; E409-Y864 HydrophobicContact CB-CD2 4.4Å; E409-V867 HydrophobicContact CB-CB 4.34Å; E409-V867 HydrophobicContact CB-CG1 4.47Å; E409-V867 HydrophobicContact CB-CG2 4.46Å
410	E	93.7	Very high	91.1	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-69.2	-31.6	178.6	-61.9	-64.3	127.7	0	0	111.3	S298 N299 L407 G412 Q413 V414 I807 V826	S298-E410 WeakPolarHBondContact CA-OE1 3.22Å; S298-E410 WeakPolarHBondContact CB-OE1 3.29Å; S298-E410 PolarHBondContact OG-OE1 2.86Å; N299-E410 PolarHBondContact N-OE1 3.02Å; L407-E410 HydrophobicContact CB-CB 4.5Å; L407-E410 HydrophobicContact CB-CG 4.37Å; L407-E410 HydrophobicContact CD2-CG 4.16Å; L407-E410 WeakPolarHBondContact O-CB 3.45Å; L407-E410 PolarHBondContact O-N 3.3Å; E410-G412 PolarHBondContact O-N 3.35Å; E410-G412 VanDerWaalsContact O-N 3.13Å; E410-Q413 PolarHBondContact O-N 3.26Å; E410-V414 WeakPolarHBondContact O-CG2 3.25Å; E410-V414 PolarHBondContact O-N 3.08Å; E410-I807 HydrophobicContact CB-CG2 4.36Å; E410-I807 VanDerWaalsContact OE2-CD1 3.27Å; E410-I807 WeakPolarHBondContact OE2-CD1 3.25Å; E410-V826 HydrophobicContact CB-CG2 3.66Å
411	L	95.1	Very high	90.9	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-57.6	-20.8	169.7	-70.1	175.6	0	0	0	112.8	I385 E409 L809 V826 Y844 L855 L856 G860 Y939	I385-L411 HydrophobicContact CD1-CD1 4.41Å; E409-L411 VanDerWaalsContact C-N 3.3Å; E409-L411 PolarHBondContact O-N 3.2Å; L411-L809 HydrophobicContact CD2-CD1 4.11Å; L411-V826 HydrophobicContact CD2-CG1 3.9Å; L411-Y844 HydrophobicContact CD1-CD1 4.27Å; L411-Y844 HydrophobicContact CD1-CD2 4.45Å; L411-Y844 HydrophobicContact CD1-CE1 3.67Å; L411-Y844 HydrophobicContact CD1-CE2 3.87Å; L411-Y844 VanDerWaalsContact CD1-CZ 3.45Å; L411-Y844 HydrophobicContact CD2-CD2 4.16Å; L411-Y844 HydrophobicContact CD2-CE2 3.87Å; L411-Y844 HydrophobicContact CG-CE2 3.85Å; L411-L855 HydrophobicContact CD1-CD1 3.76Å; L411-L855 HydrophobicContact CD1-CG 4Å; L411-L855 HydrophobicContact CD2-CD2 4.37Å; L411-L855 HydrophobicContact CD2-CG 4.21Å; L411-L856 HydrophobicContact CB-CD2 4.15Å; L411-L856 HydrophobicContact CD2-CD2 3.68Å; L411-L856 VanDerWaalsContact O-CD2 3.29Å; L411-L856 WeakPolarHBondContact O-CD2 3.44Å; L411-G860 VanDerWaalsContact C-CA 3.49Å; L411-G860 VanDerWaalsContact CB-CA 3.43Å; L411-Y939 PolarHBondContact O-OH 3.04Å
412	G	93.1	Very high	90.6	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-85.6	-6.7	173.7	0	0	0	0	0	114.4	E409 E410 G860 T942	E409-G412 PolarHBondContact O-N 2.91Å; E410-G412 PolarHBondContact O-N 3.35Å; E410-G412 VanDerWaalsContact O-N 3.13Å; G412-G860 WeakPolarHBondContact CA-O 3.5Å; G412-T942 CarbonylContact O-C 3.52Å; G412-T942 WeakPolarHBondContact O-CB 3.47Å; G412-T942 PolarHBondContact O-OG1 3.13Å
413	Q	93.8	Very high	90.1	Very high	10 Å²	10	16 Å²	16	5%	0.047	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.7	-3.7	-170.6	-53.9	-144.3	-92.9	0	0	114.2	E410 K415 I807 Y864 T942	E410-Q413 PolarHBondContact O-N 3.26Å; Q413-K415 PolarHBondContact O-N 3.23Å; Q413-I807 HydrophobicContact CB-CB 4.26Å; Q413-I807 HydrophobicContact CB-CG1 3.79Å; Q413-Y864 HydrophobicContact CG-CD2 3.58Å; Q413-Y864 HydrophobicContact CG-CE2 3.8Å; Q413-Y864 HydrophobicContact CG-CG 4.41Å; Q413-T942 PolarHBondContact NE2-O 3.46Å; Q413-T942 VanDerWaalsContact NE2-O 3.09Å
414	V	95.5	Very high	90.4	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	129.2	-177.9	-179.7	0	0	0	0	111	E410 I807 L809 L856 Y939 Q943	E410-V414 WeakPolarHBondContact O-CG2 3.25Å; E410-V414 PolarHBondContact O-N 3.08Å; V414-I807 HydrophobicContact CG2-CG2 4.34Å; V414-L809 HydrophobicContact CB-CB 4.48Å; V414-L809 HydrophobicContact CG1-CB 3.58Å; V414-L809 HydrophobicContact CG2-CB 4.02Å; V414-L809 HydrophobicContact CG2-CD1 4.01Å; V414-L856 HydrophobicContact CB-CD2 4.27Å; V414-L856 HydrophobicContact CG2-CD2 3.77Å; V414-Y939 WeakPolarHBondContact CB-OH 3.29Å; V414-Y939 PolarHBondContact N-OH 3.31Å; V414-Y939 VanDerWaalsContact N-OH 3.11Å; V414-Y939 WeakPolarHBondContact O-CE1 3.11Å; V414-Y939 PolarHBondContact O-OH 3.05Å; V414-Q943 PolarHBondContact O-NE2 3.24Å
415	K	93.6	Very high	90.9	Very high	83 Å²	83	9.9 Å²	9.9	36%	0.361	5%	0.05	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	-24.9	177.6	-171.3	165.5	-174.1	165.1	0	113.9	Q413 K692 A806 I807	Q413-K415 PolarHBondContact O-N 3.23Å; K415-K692 PolarHBondContact O-N 3.07Å; K415-A806 HydrophobicContact CB-CB 4.23Å; K415-A806 HydrophobicContact CD-CB 4.41Å; K415-I807 PolarHBondContact N-O 2.88Å
416	Y	95.2	Very high	91.1	Very high	13 Å²	13	9.4 Å²	9.4	5%	0.051	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.9	173.1	-66.9	-92.3	0	0	0	109.5	K692 L778 V800 V804 A806 I807 L809	Y416-K692 WeakPolarHBondContact CA-O 3.43Å; Y416-K692 HydrophobicContact CD1-CB 3.87Å; Y416-K692 HydrophobicContact CE1-CB 3.88Å; Y416-K692 HydrophobicContact CE1-CD 3.85Å; Y416-K692 HydrophobicContact CE1-CG 4.3Å; Y416-L778 HydrophobicContact CE1-CD2 4.14Å; Y416-L778 WeakPolarHBondContact OH-CD2 3.19Å; Y416-V800 HydrophobicContact CD1-CG1 4.32Å; Y416-V800 HydrophobicContact CD2-CG1 4.21Å; Y416-V800 HydrophobicContact CG-CG1 4.11Å; Y416-V804 HydrophobicContact CE2-CG1 3.81Å; Y416-A806 HydrophobicContact CD2-CB 3.98Å; Y416-A806 HydrophobicContact CE2-CB 3.9Å; Y416-I807 PolarHBondContact N-O 2.89Å; Y416-L809 PolarHBondContact O-N 2.89Å
417	L	96.6	Very high	91	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.05	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	120.6	172	174.5	60.5	0	0	0	108.5	L686 I691 K692 I693 W694 L809 I811 F849 L852	L417-L686 HydrophobicContact CD2-CD1 4.05Å; L417-I691 HydrophobicContact CB-CG2 3.81Å; L417-K692 PolarHBondContact N-O 2.78Å; L417-I693 HydrophobicContact CB-CG1 4.32Å; L417-I693 HydrophobicContact CD2-CD1 4.2Å; L417-I693 HydrophobicContact CD2-CG1 4.18Å; L417-I693 HydrophobicContact CD2-CG2 4.17Å; L417-I693 HydrophobicContact CG-CG2 4.33Å; L417-I693 WeakPolarHBondContact O-CA 3.46Å; L417-W694 PolarHBondContact O-N 2.81Å; L417-L809 WeakPolarHBondContact CA-O 3.49Å; L417-L809 HydrophobicContact CD1-CB 4.39Å; L417-L809 HydrophobicContact CD1-CD2 3.39Å; L417-L809 HydrophobicContact CD1-CG 4.45Å; L417-I811 HydrophobicContact CD1-CG2 3.86Å; L417-F849 HydrophobicContact CD2-CZ 4.23Å; L417-L852 HydrophobicContact CD1-CD2 3.95Å; L417-L852 HydrophobicContact CD2-CD2 3.74Å
418	F	96.9	Very high	90.3	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	125.9	168.9	-58.3	-85	0	0	0	108.2	W694 L696 I796 V797 V800 T808 L809 A810 I811 M820	F418-W694 WeakPolarHBondContact CA-O 3.43Å; F418-W694 HydrophobicContact CD1-CB 3.82Å; F418-W694 HydrophobicContact CD1-CE3 4.32Å; F418-W694 HydrophobicContact CD1-CG 4.38Å; F418-W694 HydrophobicContact CE1-CB 4.08Å; F418-W694 AromaticContact CE1-CD2 3.87Å; F418-W694 HydrophobicContact CE1-CD2 3.87Å; F418-W694 AromaticContact CE1-CE3 3.58Å; F418-W694 HydrophobicContact CE1-CE3 3.58Å; F418-W694 HydrophobicContact CE1-CG 4.14Å; F418-W694 HydrophobicContact CE1-CZ3 4.25Å; F418-L696 HydrophobicContact CB-CD1 4.29Å; F418-L696 HydrophobicContact CD1-CD1 3.75Å; F418-L696 HydrophobicContact CD1-CG 4.26Å; F418-L696 HydrophobicContact CG-CD1 4.39Å; F418-I796 HydrophobicContact CD1-CG2 4.45Å; F418-I796 HydrophobicContact CE1-CG2 3.93Å; F418-V797 HydrophobicContact CB-CG2 4.09Å; F418-V797 HydrophobicContact CD1-CG2 3.98Å; F418-V797 HydrophobicContact CD2-CG1 4.38Å; F418-V797 HydrophobicContact CD2-CG2 3.7Å; F418-V797 HydrophobicContact CE1-CG2 4.32Å; F418-V797 HydrophobicContact CE2-CG1 4.38Å; F418-V797 HydrophobicContact CE2-CG2 4.08Å; F418-V797 HydrophobicContact CG-CG2 3.64Å; F418-V797 HydrophobicContact CZ-CG2 4.37Å; F418-V800 HydrophobicContact CE1-CG2 4.37Å; F418-V800 HydrophobicContact CZ-CB 3.82Å; F418-V800 HydrophobicContact CZ-CG1 3.93Å; F418-V800 HydrophobicContact CZ-CG2 3.91Å; F418-T808 HydrophobicContact CE2-CG2 3.85Å; F418-L809 WeakPolarHBondContact CD2-O 3.09Å; F418-L809 PolarHBondContact N-O 3.4Å; F418-A810 HydrophobicContact CB-CB 4.38Å; F418-A810 CarbonylContact O-C 3.55Å; F418-A810 VanDerWaalsContact O-CA 3.3Å; F418-A810 WeakPolarHBondContact O-CA 3.24Å; F418-I811 PolarHBondContact O-N 2.65Å; F418-M820 HydrophobicContact CB-SD 3.99Å
419	S	94.9	Very high	89.8	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	141.6	-178	-169.2	0	0	0	0	110	T424 W694 V695 L696	S419-T424 WeakPolarHBondContact OG-CG2 3.24Å; S419-W694 PolarHBondContact N-O 2.74Å; S419-V695 CarbonylContact O-C 3.54Å; S419-V695 WeakPolarHBondContact O-CA 3.4Å; S419-L696 PolarHBondContact O-N 3.01Å
420	D	91.4	Very high	89.4	Confident	10 Å²	10	15.6 Å²	15.6	5%	0.053	8%	0.082	C	C	.	.			trans	-72.8	174.9	154.3	-160.9	65.8	0	0	0	110.8	T422 L425 T697 K793 I811 D817	D420-T422 PolarHBondContact OD2-N 2.75Å; D420-L425 WeakPolarHBondContact O-CD1 3.39Å; D420-L425 WeakPolarHBondContact O-CG 3.41Å; D420-T697 WeakPolarHBondContact OD1-CA 3.37Å; D420-K793 IonicContact OD1-NZ 2.67Å; D420-K793 PolarHBondContact OD1-NZ 2.89Å; D420-I811 PolarHBondContact N-O 3.34Å; D420-D817 WeakPolarHBondContact CB-OD2 3.45Å
421	K	88.6	Confident	89	Confident	3 Å²	3	17.7 Å²	17.7	1%	0.013	9%	0.092	C	C	.	.	S	Bend	trans	-105.4	-48.9	178	-174.5	-115.3	75.1	170.4	0	111.7	L425 T426 D673 V695 T697 D699 I707	K421-L425 WeakPolarHBondContact O-CB 3.28Å; K421-L425 PolarHBondContact O-N 2.76Å; K421-L425 VanDerWaalsContact O-N 3.07Å; K421-T426 HydrophobicContact CD-CG2 4.38Å; K421-T426 HydrophobicContact CG-CG2 4.45Å; K421-T426 PolarHBondContact O-N 3.09Å; K421-D673 IonicContact NZ-OD2 3.84Å; K421-D673 PolarHBondContact NZ-OD2 3.32Å; K421-V695 HydrophobicContact CB-CG1 4.12Å; K421-T697 HydrophobicContact CB-CG2 4.31Å; K421-D699 WeakPolarHBondContact CD-OD2 3.45Å; K421-D699 WeakPolarHBondContact CE-OD2 3.4Å; K421-D699 IonicContact NZ-OD2 3Å; K421-D699 PolarHBondContact NZ-OD2 3.43Å; K421-I707 HydrophobicContact CD-CB 4.42Å; K421-I707 HydrophobicContact CD-CG1 4Å; K421-I707 HydrophobicContact CG-CB 4.15Å; K421-I707 HydrophobicContact CG-CG1 4.22Å; K421-I707 HydrophobicContact CG-CG2 3.82Å
422	T	81.6	Confident	88.8	Confident	22 Å²	22	18.4 Å²	18.4	14%	0.135	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	139.9	-174.9	-55.1	0	0	0	0	108.9	D420 T424 N428 E834	D420-T422 PolarHBondContact OD2-N 2.75Å; T422-T424 PolarHBondContact O-N 2.79Å; T422-N428 HydrophobicContact CG2-CB 4.1Å; T422-N428 WeakPolarHBondContact CG2-ND2 3.43Å; T422-E834 WeakPolarHBondContact CG2-OE1 3.27Å
423	G	79	Confident	88.5	Confident	6 Å²	6	22.1 Å²	22.1	6%	0.062	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	-33.9	-175.9	0	0	0	0	0	115	T426 Q676 D813	G423-T426 CarbonylContact C-O 3.44Å; G423-T426 VanDerWaalsContact CA-O 3.26Å; G423-T426 WeakPolarHBondContact CA-O 3.3Å; G423-T426 PolarHBondContact N-O 3.2Å; G423-Q676 PolarHBondContact O-NE2 3.17Å; G423-D813 WeakPolarHBondContact CA-OD1 3.02Å; G423-D813 VanDerWaalsContact CA-OD2 3.25Å; G423-D813 WeakPolarHBondContact CA-OD2 3.41Å
424	T	87.5	Confident	88.4	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-44.8	-171.9	-78.3	0	0	0	0	114.4	S419 T422 Q676 I811 G812 D813 I830 F849	S419-T424 WeakPolarHBondContact OG-CG2 3.24Å; T422-T424 PolarHBondContact O-N 2.79Å; T424-Q676 PolarHBondContact O-NE2 3.12Å; T424-I811 HydrophobicContact CG2-CG1 4.34Å; T424-I811 HydrophobicContact CG2-CG2 4.17Å; T424-G812 VanDerWaalsContact OG1-CA 3.22Å; T424-G812 WeakPolarHBondContact OG1-CA 3.42Å; T424-D813 PolarHBondContact N-OD1 3.31Å; T424-D813 PolarHBondContact OG1-N 2.92Å; T424-D813 PolarHBondContact OG1-OD1 2.69Å; T424-I830 HydrophobicContact CG2-CD1 3.99Å; T424-F849 HydrophobicContact CG2-CD2 4.21Å
425	L	90.3	Very high	88.2	Confident	3 Å²	3	22.8 Å²	22.8	2%	0.016	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-38	172.4	-66.4	176.2	0	0	0	111.4	D420 K421 L675 Q676 V679 I683 V695 F849	D420-L425 WeakPolarHBondContact O-CD1 3.39Å; D420-L425 WeakPolarHBondContact O-CG 3.41Å; K421-L425 WeakPolarHBondContact O-CB 3.28Å; K421-L425 PolarHBondContact O-N 2.76Å; K421-L425 VanDerWaalsContact O-N 3.07Å; L425-L675 WeakPolarHBondContact O-CA 3.3Å; L425-Q676 PolarHBondContact O-N 3.29Å; L425-V679 HydrophobicContact CD2-CG1 3.79Å; L425-I683 HydrophobicContact CD2-CD1 4.01Å; L425-V695 HydrophobicContact CD1-CG1 4.49Å; L425-V695 HydrophobicContact CD1-CG2 4.06Å; L425-F849 HydrophobicContact CD2-CD1 4.36Å; L425-F849 HydrophobicContact CD2-CD2 3.73Å; L425-F849 HydrophobicContact CD2-CE1 4.14Å; L425-F849 HydrophobicContact CD2-CE2 3.48Å; L425-F849 VanDerWaalsContact CD2-CE2 3.48Å; L425-F849 HydrophobicContact CD2-CG 4.18Å; L425-F849 HydrophobicContact CD2-CZ 3.7Å
426	T	87.3	Confident	88.2	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	152.8	172.6	94.4	0	0	0	0	110.8	K421 G423 N428 D673 R674 L675 I707	K421-T426 HydrophobicContact CD-CG2 4.38Å; K421-T426 HydrophobicContact CG-CG2 4.45Å; K421-T426 PolarHBondContact O-N 3.09Å; G423-T426 CarbonylContact C-O 3.44Å; G423-T426 VanDerWaalsContact CA-O 3.26Å; G423-T426 WeakPolarHBondContact CA-O 3.3Å; G423-T426 PolarHBondContact N-O 3.2Å; T426-N428 PolarHBondContact O-N 2.91Å; T426-N428 PolarHBondContact OG1-N 2.88Å; T426-D673 WeakPolarHBondContact CB-OD1 3.48Å; T426-D673 WeakPolarHBondContact CG2-OD1 3.39Å; T426-D673 PolarHBondContact OG1-OD1 2.87Å; T426-R674 CarbonylContact C-O 3.53Å; T426-R674 WeakPolarHBondContact CA-O 3.42Å; T426-R674 WeakPolarHBondContact CB-O 3.17Å; T426-L675 HydrophobicContact CG2-CD2 4.02Å; T426-I707 HydrophobicContact CG2-CD1 3.76Å; T426-I707 HydrophobicContact CG2-CG1 4.08Å; T426-I707 HydrophobicContact CG2-CG2 4.33Å
427	C	81.6	Confident	88.1	Confident	43 Å²	43	18.2 Å²	18.2	29%	0.291	9%	0.094	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	-1.9	175.4	-62	0	0	0	0	113.1	I429 R674	C427-I429 HydrophobicContact CB-CB 4.41Å; C427-I429 HydrophobicContact CB-CD1 4.14Å; C427-I429 HydrophobicContact CB-CG1 4.16Å; C427-I429 PolarHBondContact O-N 3.31Å; C427-R674 PolarHBondContact N-O 3.18Å
428	N	75.4	Confident	87.7	Confident	40 Å²	40	18.4 Å²	18.4	21%	0.214	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	52	38.5	-165.6	-158.3	2.7	0	0	0	113	T202 T422 T426 E834	T202-N428 PolarHBondContact OG1-ND2 2.92Å; T422-N428 HydrophobicContact CG2-CB 4.1Å; T422-N428 WeakPolarHBondContact CG2-ND2 3.43Å; T426-N428 PolarHBondContact O-N 2.91Å; T426-N428 PolarHBondContact OG1-N 2.88Å; N428-E834 PolarHBondContact ND2-OE1 3.18Å
429	I	81.5	Confident	87.2	Confident	77 Å²	77	19.2 Å²	19.2	40%	0.395	10%	0.104	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	114.4	175.9	-58.1	171.2	0	0	0	108.5	C427 H431 R674	C427-I429 HydrophobicContact CB-CB 4.41Å; C427-I429 HydrophobicContact CB-CD1 4.14Å; C427-I429 HydrophobicContact CB-CG1 4.16Å; C427-I429 PolarHBondContact O-N 3.31Å; I429-H431 WeakPolarHBondContact CG2-NE2 3.29Å; I429-R674 PolarHBondContact O-N 2.8Å
430	M	84.4	Confident	86.9	Confident	17 Å²	17	21.7 Å²	21.7	8%	0.084	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	122.5	176.4	-54.7	-54.9	157.1	0	0	110.1	P518 A522 R617 I671 E672 D673	M430-P518 HydrophobicContact CB-CB 4.46Å; M430-P518 HydrophobicContact CE-CG 4.19Å; M430-P518 HydrophobicContact CG-CB 3.71Å; M430-P518 HydrophobicContact CG-CG 3.93Å; M430-A522 HydrophobicContact CB-CB 3.98Å; M430-A522 WeakPolarHBondContact O-CB 3.14Å; M430-R617 VanDerWaalsContact CE-NH2 3.35Å; M430-I671 HydrophobicContact CB-CG2 3.8Å; M430-E672 WeakPolarHBondContact CA-O 3.4Å; M430-D673 HydrophobicContact CE-CB 4.16Å; M430-D673 HydrophobicContact SD-CB 3.64Å
431	H	85.9	Confident	86.9	Confident	44 Å²	44	23.7 Å²	23.7	20%	0.204	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.9	174.3	-75.4	-95.8	0	0	0	110.8	I429 K433 T468 I671 E672	I429-H431 WeakPolarHBondContact CG2-NE2 3.29Å; H431-K433 PolarHBondContact O-N 3.29Å; H431-T468 PolarHBondContact ND1-O 2.76Å; H431-I671 CarbonylContact O-C 3.5Å; H431-I671 WeakPolarHBondContact O-CA 3.43Å; H431-E672 PolarHBondContact N-O 2.89Å; H431-E672 PolarHBondContact O-N 3.34Å
432	F	89.9	Confident	86.9	Confident	16 Å²	16	23.7 Å²	23.7	7%	0.07	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	116.6	167.6	-176.1	-86.3	0	0	0	109	C435 F470 M496 L523 A526 T669	F432-C435 HydrophobicContact CE1-CB 4.4Å; F432-C435 HydrophobicContact CZ-CB 3.85Å; F432-F470 HydrophobicContact CD1-CB 3.95Å; F432-F470 AromaticContact CD1-CD2 3.54Å; F432-F470 HydrophobicContact CD1-CD2 3.54Å; F432-F470 HydrophobicContact CD1-CE2 4.19Å; F432-F470 AromaticContact CD1-CG 3.84Å; F432-F470 HydrophobicContact CD1-CG 3.84Å; F432-F470 HydrophobicContact CE1-CB 4.47Å; F432-F470 HydrophobicContact CE1-CD1 4.43Å; F432-F470 AromaticContact CE1-CD2 3.57Å; F432-F470 HydrophobicContact CE1-CD2 3.57Å; F432-F470 AromaticContact CE1-CE2 3.76Å; F432-F470 HydrophobicContact CE1-CE2 3.76Å; F432-F470 AromaticContact CE1-CG 3.91Å; F432-F470 HydrophobicContact CE1-CG 3.91Å; F432-F470 HydrophobicContact CE1-CZ 4.28Å; F432-M496 HydrophobicContact CD2-CE 3.98Å; F432-M496 HydrophobicContact CE2-CE 3.43Å; F432-M496 VanDerWaalsContact CE2-CE 3.43Å; F432-M496 HydrophobicContact CE2-SD 3.97Å; F432-M496 HydrophobicContact CZ-CE 3.9Å; F432-M496 HydrophobicContact CZ-SD 4.22Å; F432-L523 HydrophobicContact CD2-CD2 3.96Å; F432-L523 HydrophobicContact CE2-CD2 3.99Å; F432-A526 HydrophobicContact CB-CB 3.57Å; F432-A526 HydrophobicContact CD1-CB 3.8Å; F432-A526 HydrophobicContact CD2-CB 3.87Å; F432-A526 HydrophobicContact CE1-CB 4.4Å; F432-A526 HydrophobicContact CE2-CB 4.44Å; F432-A526 HydrophobicContact CG-CB 3.49Å; F432-A526 VanDerWaalsContact CG-CB 3.49Å; F432-T669 HydrophobicContact CE2-CG2 3.53Å; F432-T669 HydrophobicContact CZ-CG2 4.18Å
433	K	87.4	Confident	86.8	Confident	78 Å²	78	22.9 Å²	22.9	34%	0.339	13%	0.126	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	-45.5	-165.7	-168.1	57.4	168	-110.8	0	113.7	H431 L616 A670 E672	H431-K433 PolarHBondContact O-N 3.29Å; K433-L616 HydrophobicContact CB-CD2 4.34Å; K433-L616 HydrophobicContact CG-CD2 4.32Å; K433-A670 PolarHBondContact N-O 3.37Å; K433-E672 HydrophobicContact CB-CB 4.1Å; K433-E672 WeakPolarHBondContact CD-OE2 3.31Å; K433-E672 WeakPolarHBondContact CE-OE2 3.22Å; K433-E672 HydrophobicContact CG-CB 4.42Å; K433-E672 IonicContact NZ-OE1 2.83Å; K433-E672 IonicContact NZ-OE2 2.73Å; K433-E672 PolarHBondContact NZ-OE2 3.26Å
434	K	91.1	Very high	86.2	Confident	22 Å²	22	27.4 Å²	27.4	10%	0.096	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	160.9	178.2	-63.9	-176.1	177	176.6	0	110.8	Y442 G443 F611 E614 L616 A670	K434-Y442 WeakPolarHBondContact CA-O 3.38Å; K434-Y442 WeakPolarHBondContact CB-O 3.4Å; K434-G443 WeakPolarHBondContact CE-O 3.39Å; K434-G443 WeakPolarHBondContact CG-O 3.25Å; K434-F611 HydrophobicContact CB-CD1 4.35Å; K434-F611 HydrophobicContact CB-CE1 3.79Å; K434-F611 HydrophobicContact CB-CZ 3.86Å; K434-F611 HydrophobicContact CD-CD1 3.99Å; K434-F611 HydrophobicContact CD-CE1 3.65Å; K434-F611 HydrophobicContact CG-CE1 4.34Å; K434-E614 WeakPolarHBondContact CE-OE2 3.45Å; K434-E614 IonicContact NZ-OE1 2.71Å; K434-E614 PolarHBondContact NZ-OE1 3.32Å; K434-E614 IonicContact NZ-OE2 3.83Å; K434-E614 PolarHBondContact NZ-OE2 2.96Å; K434-L616 HydrophobicContact CD-CD1 4.23Å; K434-L616 HydrophobicContact CG-CD1 4.41Å; K434-A670 HydrophobicContact CB-CB 4.09Å; K434-A670 PolarHBondContact N-O 2.95Å; K434-A670 PolarHBondContact O-N 2.82Å
435	C	92.4	Very high	84.7	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.007	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	154.7	166	58.1	0	0	0	0	111.5	F432 I437 T441 Y442 F492 A668	F432-C435 HydrophobicContact CE1-CB 4.4Å; F432-C435 HydrophobicContact CZ-CB 3.85Å; C435-I437 HydrophobicContact CB-CG1 4.45Å; C435-T441 CarbonylContact O-C 3.56Å; C435-T441 WeakPolarHBondContact O-CA 3.15Å; C435-Y442 PolarHBondContact N-O 2.95Å; C435-Y442 PolarHBondContact O-N 3.42Å; C435-F492 HydrophobicContact CB-CE1 4.23Å; C435-F492 HydrophobicContact CB-CZ 4.17Å; C435-A668 CarbonylContact C-O 3.17Å; C435-A668 VanDerWaalsContact CA-O 3.3Å; C435-A668 WeakPolarHBondContact CA-O 3.34Å; C435-A668 WeakPolarHBondContact CB-O 3.27Å
436	T	93.1	Very high	82.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122.1	168.9	170.6	0	0	0	0	108.1	I440 T604 H607 F611 G667 A668	T436-I440 CarbonylContact C-O 3.57Å; T436-I440 VanDerWaalsContact CA-O 3.28Å; T436-I440 WeakPolarHBondContact CA-O 3.39Å; T436-T604 HydrophobicContact CG2-CG2 3.89Å; T436-H607 HydrophobicContact CG2-CB 4.01Å; T436-H607 PolarHBondContact OG1-ND1 2.94Å; T436-F611 HydrophobicContact CG2-CE2 4.02Å; T436-G667 CarbonylContact O-C 3.57Å; T436-G667 WeakPolarHBondContact O-CA 3.49Å; T436-A668 HydrophobicContact CG2-CB 3.83Å; T436-A668 PolarHBondContact N-O 2.93Å; T436-A668 PolarHBondContact O-N 3.12Å
437	I	93.2	Very high	79.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	127.5	-177.9	-47.6	171.2	0	0	0	108.7	C435 G439 I440 Y442 L475 I489 F492	C435-I437 HydrophobicContact CB-CG1 4.45Å; I437-G439 PolarHBondContact O-N 3.19Å; I437-G439 VanDerWaalsContact O-N 3.15Å; I437-I440 PolarHBondContact N-O 2.95Å; I437-I440 PolarHBondContact O-N 3.24Å; I437-Y442 HydrophobicContact CB-CE2 4.18Å; I437-Y442 HydrophobicContact CD1-CD2 4.41Å; I437-Y442 HydrophobicContact CD1-CE2 4.45Å; I437-Y442 HydrophobicContact CG1-CD2 4.43Å; I437-Y442 HydrophobicContact CG1-CE2 4.46Å; I437-L475 HydrophobicContact CD1-CD1 3.94Å; I437-I489 HydrophobicContact CB-CG1 4.43Å; I437-I489 HydrophobicContact CD1-CG2 4.38Å; I437-I489 HydrophobicContact CG2-CG1 3.96Å; I437-F492 HydrophobicContact CD1-CB 4.46Å; I437-F492 HydrophobicContact CD1-CD1 3.38Å; I437-F492 HydrophobicContact CD1-CE1 3.58Å; I437-F492 HydrophobicContact CD1-CG 3.98Å; I437-F492 HydrophobicContact CD1-CZ 4.31Å; I437-F492 HydrophobicContact CG1-CD1 3.77Å; I437-F492 HydrophobicContact CG1-CD2 4.28Å; I437-F492 HydrophobicContact CG1-CE1 3.72Å; I437-F492 HydrophobicContact CG1-CE2 4.23Å; I437-F492 HydrophobicContact CG1-CG 4.03Å; I437-F492 HydrophobicContact CG1-CZ 3.93Å; I437-F492 HydrophobicContact CG2-CB 4.08Å; I437-F492 HydrophobicContact CG2-CD2 4.44Å; I437-F492 HydrophobicContact CG2-CG 4.19Å
438	A	89.1	Confident	77.5	Confident	5 Å²	5	50 Å²	50	4%	0.041	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	38.8	-177.2	0	0	0	0	0	113.9	I440 T485 Q488 Y600 L666	A438-I440 PolarHBondContact O-N 3.14Å; A438-T485 HydrophobicContact CB-CG2 3.62Å; A438-Q488 HydrophobicContact CB-CB 4.07Å; A438-Q488 HydrophobicContact CB-CG 4.32Å; A438-Y600 HydrophobicContact CB-CD2 4.2Å; A438-Y600 HydrophobicContact CB-CE2 3.78Å; A438-Y600 WeakPolarHBondContact O-CD1 3.48Å; A438-Y600 VanDerWaalsContact O-CE1 3.28Å; A438-Y600 WeakPolarHBondContact O-CE1 3.25Å; A438-L666 PolarHBondContact N-O 2.83Å
439	G	84.8	Confident	75.4	Confident	16 Å²	16	55.5 Å²	55.5	17%	0.165	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	7.1	-179.3	0	0	0	0	0	116.1	I437 H607	I437-G439 PolarHBondContact O-N 3.19Å; I437-G439 VanDerWaalsContact O-N 3.15Å; G439-H607 PolarHBondContact O-CE1 2.84Å
440	I	89.7	Confident	73.1	Confident	52 Å²	52	57 Å²	57	27%	0.267	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.8	177.8	-55.1	172	0	0	0	109.4	T436 I437 A438 Y442 T485	T436-I440 CarbonylContact C-O 3.57Å; T436-I440 VanDerWaalsContact CA-O 3.28Å; T436-I440 WeakPolarHBondContact CA-O 3.39Å; I437-I440 PolarHBondContact N-O 2.95Å; I437-I440 PolarHBondContact O-N 3.24Å; A438-I440 PolarHBondContact O-N 3.14Å; I440-Y442 HydrophobicContact CB-CE2 3.79Å; I440-Y442 HydrophobicContact CG2-CD2 4.36Å; I440-Y442 HydrophobicContact CG2-CE1 3.96Å; I440-Y442 HydrophobicContact CG2-CE2 3.72Å; I440-Y442 VanDerWaalsContact CG2-CZ 3.5Å; I440-Y442 WeakPolarHBondContact O-CD2 3.43Å; I440-Y442 WeakPolarHBondContact O-CE2 3.47Å; I440-T485 HydrophobicContact CD1-CG2 4.13Å
441	T	90.2	Very high	70.6	Confident	53 Å²	53	64.2 Å²	64.2	33%	0.325	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	143.1	171.3	40.2	0	0	0	0	112.1	C435 H607 F611	C435-T441 CarbonylContact O-C 3.56Å; C435-T441 WeakPolarHBondContact O-CA 3.15Å; T441-H607 HydrophobicContact CG2-CB 4.03Å; T441-F611 HydrophobicContact CG2-CE1 4.44Å; T441-F611 HydrophobicContact CG2-CZ 4.08Å
442	Y	89.1	Confident	67.9	Low	2 Å²	2	73 Å²	73	1%	0.008	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	152.5	176.7	-56.5	-86.6	0	0	0	110.1	K434 C435 I437 I440 D472 S474 L475 N478 I489	K434-Y442 WeakPolarHBondContact CA-O 3.38Å; K434-Y442 WeakPolarHBondContact CB-O 3.4Å; C435-Y442 PolarHBondContact N-O 2.95Å; C435-Y442 PolarHBondContact O-N 3.42Å; I437-Y442 HydrophobicContact CB-CE2 4.18Å; I437-Y442 HydrophobicContact CD1-CD2 4.41Å; I437-Y442 HydrophobicContact CD1-CE2 4.45Å; I437-Y442 HydrophobicContact CG1-CD2 4.43Å; I437-Y442 HydrophobicContact CG1-CE2 4.46Å; I440-Y442 HydrophobicContact CB-CE2 3.79Å; I440-Y442 HydrophobicContact CG2-CD2 4.36Å; I440-Y442 HydrophobicContact CG2-CE1 3.96Å; I440-Y442 HydrophobicContact CG2-CE2 3.72Å; I440-Y442 VanDerWaalsContact CG2-CZ 3.5Å; I440-Y442 WeakPolarHBondContact O-CD2 3.43Å; I440-Y442 WeakPolarHBondContact O-CE2 3.47Å; Y442-D472 VanDerWaalsContact CA-OD2 3.24Å; Y442-D472 WeakPolarHBondContact CA-OD2 3.26Å; Y442-D472 WeakPolarHBondContact CB-OD2 3.46Å; Y442-S474 WeakPolarHBondContact CD1-OG 3.35Å; Y442-L475 HydrophobicContact CD1-CB 3.67Å; Y442-L475 HydrophobicContact CD1-CD1 4.31Å; Y442-L475 HydrophobicContact CD1-CG 4.18Å; Y442-L475 HydrophobicContact CD2-CD1 4.08Å; Y442-L475 HydrophobicContact CE1-CB 3.94Å; Y442-L475 HydrophobicContact CE1-CG 4.31Å; Y442-L475 HydrophobicContact CG-CB 4.14Å; Y442-L475 HydrophobicContact CG-CD1 3.91Å; Y442-L475 HydrophobicContact CG-CG 4.27Å; Y442-N478 PolarHBondContact OH-ND2 3.48Å; Y442-I489 WeakPolarHBondContact OH-CD1 3.43Å
443	G	80.1	Confident	65	Low	6 Å²	6	77.6 Å²	77.6	6%	0.062	41%	0.412	C	S	.	.	S	Bend	trans	89.1	22.4	-170.8	0	0	0	0	0	113.5	K434 D472	K434-G443 WeakPolarHBondContact CE-O 3.39Å; K434-G443 WeakPolarHBondContact CG-O 3.25Å; G443-D472 PolarHBondContact N-OD2 3.15Å
444	H	66.8	Low	62.5	Low	101 Å²	101	83.1 Å²	83.1	47%	0.468	44%	0.441	S	S	.	.			trans	-100.4	105.5	176.5	-176.9	47.5	0	0	0	110.4	D447	H444-D447 IonicContact CE1-OD2 3.68Å; H444-D447 PolarHBondContact CE1-OD2 2.95Å
445	F	56	Low	59.7	Low	128 Å²	128	90.8 Å²	90.8	56%	0.561	48%	0.477	S	S	*	.			trans	-65.4	131.8	159.9	-57.7	-80.8	0	0	0	107.9	D447	F445-D447 PolarHBondContact O-N 3.44Å; F445-D447 VanDerWaalsContact O-N 3.13Å
446	P	38.6	Very low	56.6	Low	112 Å²	112	98 Å²	98	73%	0.727	52%	0.516	S	S	*	.			trans	-66.5	113.9	175.1	26.8	-32.7	0	0	0	109	L448	P446-L448 PolarHBondContact O-N 2.96Å
447	D	35.1	Very low	53.8	Low	119 Å²	119	108.8 Å²	108.8	64%	0.636	56%	0.563	S	S	*	*			trans	-60.9	130.6	-174.4	-71.9	-60.1	0	0	0	111.7	H444 F445 D449	H444-D447 IonicContact CE1-OD2 3.68Å; H444-D447 PolarHBondContact CE1-OD2 2.95Å; F445-D447 PolarHBondContact O-N 3.44Å; F445-D447 VanDerWaalsContact O-N 3.13Å; D447-D449 HydrophobicContact CB-CB 4.47Å; D447-D449 PolarHBondContact O-N 2.93Å
448	L	32.9	Very low	50.8	Low	161 Å²	161	112.8 Å²	112.8	84%	0.843	59%	0.592	S	S	*	*			trans	-80.4	41.5	175.6	-100.2	160.3	0	0	0	111.6	P446 C450	P446-L448 PolarHBondContact O-N 2.96Å; L448-C450 PolarHBondContact O-N 2.74Å
449	D	32.5	Very low	47.9	Very low	155 Å²	155	119.9 Å²	119.9	83%	0.829	63%	0.629	S	S	*	*			trans	-76.4	68.6	178	-104.8	5.7	0	0	0	110.7	D447	D447-D449 HydrophobicContact CB-CB 4.47Å; D447-D449 PolarHBondContact O-N 2.93Å
450	C	33.6	Very low	45.2	Very low	108 Å²	108	127 Å²	127	73%	0.73	66%	0.662	S	S	*	*	S	Bend	trans	-148.8	125.5	165.9	-131.7	0	0	0	0	110.4	L448 R452	L448-C450 PolarHBondContact O-N 2.74Å; C450-R452 PolarHBondContact O-N 3.43Å
451	D	31.6	Very low	42.2	Very low	169 Å²	169	130.4 Å²	130.4	90%	0.904	69%	0.687	S	S	*	*			trans	-32.6	114.6	-175.1	-68.6	-57.7	0	0	0	115
452	R	29.4	Very low	39.3	Very low	230 Å²	230	133.6 Å²	133.6	87%	0.868	71%	0.712	S	S	*	*			trans	-128.6	120.8	163.1	-74.1	-164.8	169.3	-162.8	-4.1	111.9	C450	C450-R452 PolarHBondContact O-N 3.43Å
453	S	28.9	Very low	36.4	Very low	111 Å²	111	141 Å²	141	78%	0.776	75%	0.752	S	S	*	*			trans	-61.9	153.3	172.6	46	0	0	0	0	112	E455	S453-E455 VanDerWaalsContact C-N 3.33Å; S453-E455 PolarHBondContact O-N 3.05Å
454	M	34.6	Very low	33.9	Very low	194 Å²	194	145.3 Å²	145.3	96%	0.956	78%	0.781	S	S	*	*	S	Bend	trans	-73.8	72.8	-176.5	-174.3	179.7	179.2	0	0	112.8
455	E	31.7	Very low	32.3	Very low	183 Å²	183	149.4 Å²	149.4	86%	0.855	80%	0.8	S	S	*	*			trans	-161.2	145.6	165.1	-110.4	156	-146.6	0	0	110	S453	S453-E455 VanDerWaalsContact C-N 3.33Å; S453-E455 PolarHBondContact O-N 3.05Å
456	D	27.3	Very low	31.3	Very low	154 Å²	154	150.2 Å²	150.2	82%	0.824	81%	0.81	S	S	*	*			trans	86.9	78.3	-173.3	-69.4	-20.1	0	0	0	118.8
457	F	34.3	Very low	31.2	Very low	225 Å²	225	149.4 Å²	149.4	99%	0.987	81%	0.807	S	S	*	*			trans	-113.6	65.5	163.3	-116	-82.7	0	0	0	111.6
458	S	29.9	Very low	31.7	Very low	85 Å²	85	147.7 Å²	147.7	59%	0.594	80%	0.801	S	S	*	*			trans	-147.6	146.9	167.4	68.1	0	0	0	0	111.6
459	N	28.6	Very low	33	Very low	153 Å²	153	146.5 Å²	146.5	82%	0.818	79%	0.791	S	S	*	*			trans	74.7	61.6	176.4	-45.5	-49.8	0	0	0	117.7
460	L	28.7	Very low	34.9	Very low	167 Å²	167	140.4 Å²	140.4	87%	0.874	76%	0.757	S	S	*	*			trans	-113.1	141.7	140.1	-86.2	90.6	0	0	0	109.7	S462	L460-S462 PolarHBondContact O-N 2.86Å
461	P	26.9	Very low	36.4	Very low	122 Å²	122	140.6 Å²	140.6	79%	0.792	75%	0.751	S	S	*	*			trans	-77.1	122.4	-177.1	30.2	-33.7	0	0	0	111.9	N463	P461-N463 PolarHBondContact O-N 3.35Å
462	S	28.5	Very low	38.7	Very low	121 Å²	121	133.7 Å²	133.7	85%	0.846	71%	0.714	S	S	*	*			trans	-75.5	100.2	176.1	53.5	0	0	0	0	111.4	L460	L460-S462 PolarHBondContact O-N 2.86Å
463	N	28.3	Very low	40.9	Very low	158 Å²	158	126.3 Å²	126.3	85%	0.845	70%	0.696	S	S	*	*			trans	-154.3	53	176.8	-131.1	4.2	0	0	0	115.3	P461	P461-N463 PolarHBondContact O-N 3.35Å
464	S	28.5	Very low	43.5	Very low	95 Å²	95	123.1 Å²	123.1	66%	0.664	67%	0.674	S	S	*	*			trans	-154.4	69.5	170.2	50.1	0	0	0	0	113.1	N466	S464-N466 VanDerWaalsContact C-N 3.3Å; S464-N466 PolarHBondContact O-N 3.38Å
465	H	32.7	Very low	45.9	Very low	188 Å²	188	113.9 Å²	113.9	87%	0.87	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	86.5	166.2	-80	-84.5	0	0	0	110.4
466	N	34.3	Very low	48.4	Very low	144 Å²	144	107.2 Å²	107.2	77%	0.77	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	163.1	36.7	152.5	-82.7	-8	0	0	0	112.8	S464 T468	S464-N466 VanDerWaalsContact C-N 3.3Å; S464-N466 PolarHBondContact O-N 3.38Å; N466-T468 PolarHBondContact O-N 3.13Å
467	S	37.8	Very low	51.1	Low	95 Å²	95	103.6 Å²	103.6	66%	0.664	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	59.8	179.7	64.4	0	0	0	0	113.2
468	T	45.5	Very low	53.6	Low	84 Å²	84	94.3 Å²	94.3	52%	0.515	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.7	-2.5	-174.6	51	0	0	0	0	114.7	H431 N466	H431-T468 PolarHBondContact ND1-O 2.76Å; N466-T468 PolarHBondContact O-N 3.13Å
469	E	59.9	Low	56.2	Low	135 Å²	135	90.6 Å²	90.6	63%	0.631	51%	0.51	S	S	*	.	S	Bend	trans	-103	178.4	172.4	-60.7	-165.3	148.7	0	0	110.7	D471	E469-D471 PolarHBondContact O-N 2.84Å; E469-D471 VanDerWaalsContact O-N 3.1Å
470	F	72.1	Confident	58.9	Low	28 Å²	28	88.6 Å²	88.6	12%	0.123	50%	0.496	C	S	.	.			trans	-72.5	101.3	-176.9	175.2	-92.7	0	0	0	111	F432 D472 L475 L530	F432-F470 HydrophobicContact CD1-CB 3.95Å; F432-F470 AromaticContact CD1-CD2 3.54Å; F432-F470 HydrophobicContact CD1-CD2 3.54Å; F432-F470 HydrophobicContact CD1-CE2 4.19Å; F432-F470 AromaticContact CD1-CG 3.84Å; F432-F470 HydrophobicContact CD1-CG 3.84Å; F432-F470 HydrophobicContact CE1-CB 4.47Å; F432-F470 HydrophobicContact CE1-CD1 4.43Å; F432-F470 AromaticContact CE1-CD2 3.57Å; F432-F470 HydrophobicContact CE1-CD2 3.57Å; F432-F470 AromaticContact CE1-CE2 3.76Å; F432-F470 HydrophobicContact CE1-CE2 3.76Å; F432-F470 AromaticContact CE1-CG 3.91Å; F432-F470 HydrophobicContact CE1-CG 3.91Å; F432-F470 HydrophobicContact CE1-CZ 4.28Å; F470-D472 HydrophobicContact CE1-CB 3.86Å; F470-D472 HydrophobicContact CZ-CB 3.89Å; F470-D472 PolarHBondContact O-N 3.45Å; F470-L475 HydrophobicContact CE1-CB 4.48Å; F470-L475 HydrophobicContact CE1-CD1 3.88Å; F470-L475 HydrophobicContact CZ-CD1 4.09Å; F470-L530 HydrophobicContact CD1-CD1 4.04Å; F470-L530 HydrophobicContact CD1-CD2 4.01Å; F470-L530 HydrophobicContact CD1-CG 4.38Å; F470-L530 HydrophobicContact CE1-CD1 4.27Å; F470-L530 HydrophobicContact CE1-CD2 4.33Å
471	D	66.1	Low	61.6	Low	111 Å²	111	87.3 Å²	87.3	59%	0.594	48%	0.483	S	S	*	.			trans	-102	68.8	-174	-166.5	11.1	0	0	0	111.8	E469	E469-D471 PolarHBondContact O-N 2.84Å; E469-D471 VanDerWaalsContact O-N 3.1Å
472	D	78.2	Confident	64.3	Low	24 Å²	24	87.9 Å²	87.9	13%	0.128	48%	0.48	C	S	.	.			trans	-121	95	166.8	-171.3	-20.7	0	0	0	110.3	Y442 G443 F470 S474 L475	Y442-D472 VanDerWaalsContact CA-OD2 3.24Å; Y442-D472 WeakPolarHBondContact CA-OD2 3.26Å; Y442-D472 WeakPolarHBondContact CB-OD2 3.46Å; G443-D472 PolarHBondContact N-OD2 3.15Å; F470-D472 HydrophobicContact CE1-CB 3.86Å; F470-D472 HydrophobicContact CZ-CB 3.89Å; F470-D472 PolarHBondContact O-N 3.45Å; D472-S474 PolarHBondContact O-N 3.49Å; D472-S474 VanDerWaalsContact O-N 3.17Å; D472-S474 WeakPolarHBondContact OD1-CA 3.31Å; D472-S474 WeakPolarHBondContact OD1-CB 3.45Å; D472-S474 PolarHBondContact OD1-N 3.33Å; D472-S474 PolarHBondContact OD1-OG 3.43Å; D472-S474 PolarHBondContact OD2-OG 2.96Å; D472-L475 PolarHBondContact O-N 3.02Å
473	P	77.1	Confident	67.1	Low	75 Å²	75	85.4 Å²	85.4	49%	0.487	46%	0.455	S	S	.	.	H	α-helix	trans	-69.4	-10.3	-179	28.8	-35.6	0	0	0	113.2	L475 Q477	P473-L475 VanDerWaalsContact C-N 3.32Å; P473-Q477 WeakPolarHBondContact O-CB 3.28Å; P473-Q477 WeakPolarHBondContact O-CG 3.42Å; P473-Q477 PolarHBondContact O-N 3.03Å
474	S	83.3	Confident	69.9	Low	44 Å²	44	83.1 Å²	83.1	31%	0.308	45%	0.448	S	S	.	.	H	α-helix	trans	-68.7	-31.7	176.7	77.2	0	0	0	0	112.1	Y442 D472 Q477 N478	Y442-S474 WeakPolarHBondContact CD1-OG 3.35Å; D472-S474 PolarHBondContact O-N 3.49Å; D472-S474 VanDerWaalsContact O-N 3.17Å; D472-S474 WeakPolarHBondContact OD1-CA 3.31Å; D472-S474 WeakPolarHBondContact OD1-CB 3.45Å; D472-S474 PolarHBondContact OD1-N 3.33Å; D472-S474 PolarHBondContact OD1-OG 3.43Å; D472-S474 PolarHBondContact OD2-OG 2.96Å; S474-Q477 PolarHBondContact O-N 2.91Å; S474-N478 WeakPolarHBondContact O-CB 3.3Å; S474-N478 PolarHBondContact O-N 3.09Å
475	L	85.4	Confident	72.7	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	42%	0.42	C	S	.	.	H	α-helix	trans	-63.1	-50.5	177.4	-168.1	156.6	0	0	0	110.8	I437 Y442 F470 D472 P473 N478 I479 I489 L493 L530	I437-L475 HydrophobicContact CD1-CD1 3.94Å; Y442-L475 HydrophobicContact CD1-CB 3.67Å; Y442-L475 HydrophobicContact CD1-CD1 4.31Å; Y442-L475 HydrophobicContact CD1-CG 4.18Å; Y442-L475 HydrophobicContact CD2-CD1 4.08Å; Y442-L475 HydrophobicContact CE1-CB 3.94Å; Y442-L475 HydrophobicContact CE1-CG 4.31Å; Y442-L475 HydrophobicContact CG-CB 4.14Å; Y442-L475 HydrophobicContact CG-CD1 3.91Å; Y442-L475 HydrophobicContact CG-CG 4.27Å; F470-L475 HydrophobicContact CE1-CB 4.48Å; F470-L475 HydrophobicContact CE1-CD1 3.88Å; F470-L475 HydrophobicContact CZ-CD1 4.09Å; D472-L475 PolarHBondContact O-N 3.02Å; P473-L475 VanDerWaalsContact C-N 3.32Å; L475-N478 PolarHBondContact O-N 3.02Å; L475-I479 HydrophobicContact CD2-CD1 4.22Å; L475-I479 PolarHBondContact O-N 3.11Å; L475-I489 HydrophobicContact CD2-CG2 3.65Å; L475-I489 HydrophobicContact CG-CG2 4.15Å; L475-L493 HydrophobicContact CD2-CD1 4.05Å; L475-L530 HydrophobicContact CD2-CD1 4.49Å; L475-L530 HydrophobicContact CD2-CD2 4.38Å
476	I	83.8	Confident	75.3	Confident	44 Å²	44	70.8 Å²	70.8	23%	0.226	38%	0.383	C	S	.	.	H	α-helix	trans	-65.7	-42.8	176.3	-61.7	-60	0	0	0	111	N478 I479 E480 L530	I476-N478 VanDerWaalsContact C-N 3.26Å; I476-N478 PolarHBondContact O-N 3.06Å; I476-I479 HydrophobicContact CD1-CD1 4.29Å; I476-I479 WeakPolarHBondContact O-CB 3.18Å; I476-I479 PolarHBondContact O-N 3.31Å; I476-E480 HydrophobicContact CG2-CG 4.32Å; I476-E480 WeakPolarHBondContact O-CG 3.3Å; I476-E480 PolarHBondContact O-N 3.21Å; I476-L530 HydrophobicContact CD1-CB 4.38Å; I476-L530 HydrophobicContact CD1-CD2 3.8Å; I476-L530 HydrophobicContact CG1-CD2 4.02Å
477	Q	84.1	Confident	77.9	Confident	78 Å²	78	68 Å²	68	36%	0.364	37%	0.373	S	S	.	.	H	α-helix	trans	-60.4	-33.6	176.5	-77.3	178.5	52.6	0	0	113	P473 S474 I479 E480 K481	P473-Q477 WeakPolarHBondContact O-CB 3.28Å; P473-Q477 WeakPolarHBondContact O-CG 3.42Å; P473-Q477 PolarHBondContact O-N 3.03Å; S474-Q477 PolarHBondContact O-N 2.91Å; Q477-I479 VanDerWaalsContact C-N 3.32Å; Q477-E480 PolarHBondContact O-N 3.44Å; Q477-K481 HydrophobicContact CB-CD 4.39Å; Q477-K481 VanDerWaalsContact O-CB 3.24Å; Q477-K481 WeakPolarHBondContact O-CB 3.47Å; Q477-K481 WeakPolarHBondContact O-CD 3.4Å; Q477-K481 WeakPolarHBondContact O-CG 3.07Å; Q477-K481 PolarHBondContact O-N 2.97Å
478	N	86.8	Confident	80.4	Confident	30 Å²	30	66.2 Å²	66.2	16%	0.16	35%	0.354	C	S	.	.	H	α-helix	trans	-68.6	-32.2	176	-76.5	-12.9	0	0	0	112.1	Y442 S474 L475 I476 H483 I489	Y442-N478 PolarHBondContact OH-ND2 3.48Å; S474-N478 WeakPolarHBondContact O-CB 3.3Å; S474-N478 PolarHBondContact O-N 3.09Å; L475-N478 PolarHBondContact O-N 3.02Å; I476-N478 VanDerWaalsContact C-N 3.26Å; I476-N478 PolarHBondContact O-N 3.06Å; N478-H483 HydrophobicContact CB-CB 3.98Å; N478-H483 VanDerWaalsContact O-CB 3.22Å; N478-H483 WeakPolarHBondContact O-CB 3.49Å; N478-H483 PolarHBondContact O-N 3.35Å; N478-I489 HydrophobicContact CB-CD1 4.08Å
479	I	84.3	Confident	82.6	Confident	6 Å²	6	62.2 Å²	62.2	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-67.9	-49.1	170.5	-54.9	170.2	0	0	0	110	L475 I476 Q477 N482 I489 L493	L475-I479 HydrophobicContact CD2-CD1 4.22Å; L475-I479 PolarHBondContact O-N 3.11Å; I476-I479 HydrophobicContact CD1-CD1 4.29Å; I476-I479 WeakPolarHBondContact O-CB 3.18Å; I476-I479 PolarHBondContact O-N 3.31Å; Q477-I479 VanDerWaalsContact C-N 3.32Å; I479-N482 PolarHBondContact O-N 3.34Å; I479-I489 HydrophobicContact CD1-CG2 3.76Å; I479-I489 HydrophobicContact CG1-CB 4.32Å; I479-I489 HydrophobicContact CG1-CG2 3.77Å; I479-L493 HydrophobicContact CD1-CD1 4.12Å
480	E	84.9	Confident	84	Confident	112 Å²	112	57.5 Å²	57.5	52%	0.523	31%	0.311	S	S	.	.	H	α-helix	trans	-68.4	-36.5	-175.1	-69	-174.7	155.9	0	0	114.3	I476 Q477 N482 R547	I476-E480 HydrophobicContact CG2-CG 4.32Å; I476-E480 WeakPolarHBondContact O-CG 3.3Å; I476-E480 PolarHBondContact O-N 3.21Å; Q477-E480 PolarHBondContact O-N 3.44Å; E480-N482 PolarHBondContact O-N 2.8Å; E480-R547 VanDerWaalsContact CG-NH2 3.34Å; E480-R547 IonicContact OE1-NH2 3.63Å; E480-R547 PolarHBondContact OE1-NH2 3.09Å
481	K	85.4	Confident	85	Confident	139 Å²	139	58 Å²	58	60%	0.604	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	2.2	175.8	-65.5	168.1	-173.3	170.6	0	113	Q477 H483	Q477-K481 HydrophobicContact CB-CD 4.39Å; Q477-K481 VanDerWaalsContact O-CB 3.24Å; Q477-K481 WeakPolarHBondContact O-CB 3.47Å; Q477-K481 WeakPolarHBondContact O-CD 3.4Å; Q477-K481 WeakPolarHBondContact O-CG 3.07Å; Q477-K481 PolarHBondContact O-N 2.97Å; K481-H483 VanDerWaalsContact C-N 3.33Å; K481-H483 PolarHBondContact O-N 2.58Å
482	N	82.8	Confident	86.3	Confident	134 Å²	134	52.7 Å²	52.7	72%	0.717	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	48.4	-174	-62.7	-76	0	0	0	112.6	I479 E480	I479-N482 PolarHBondContact O-N 3.34Å; E480-N482 PolarHBondContact O-N 2.8Å
483	H	88.1	Confident	87	Confident	70 Å²	70	51.6 Å²	51.6	32%	0.324	28%	0.279	S	S	.	.			trans	-58.6	149.3	174.5	-169.6	-105.1	0	0	0	110.5	N478 K481 T485 S486	N478-H483 HydrophobicContact CB-CB 3.98Å; N478-H483 VanDerWaalsContact O-CB 3.22Å; N478-H483 WeakPolarHBondContact O-CB 3.49Å; N478-H483 PolarHBondContact O-N 3.35Å; K481-H483 VanDerWaalsContact C-N 3.33Å; K481-H483 PolarHBondContact O-N 2.58Å; H483-T485 PolarHBondContact ND1-OG1 2.7Å; H483-T485 PolarHBondContact O-N 2.88Å; H483-S486 WeakPolarHBondContact O-CB 3.2Å; H483-S486 PolarHBondContact O-N 2.82Å
484	P	86.5	Confident	87.8	Confident	109 Å²	109	48.4 Å²	48.4	71%	0.708	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-18.2	-178.7	-29.9	37.7	0	0	0	116.1
485	T	87.2	Confident	88.3	Confident	11 Å²	11	46.3 Å²	46.3	7%	0.067	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-2	174.7	59	0	0	0	0	114.4	A438 I440 H483 P487 Q488 I489	A438-T485 HydrophobicContact CB-CG2 3.62Å; I440-T485 HydrophobicContact CD1-CG2 4.13Å; H483-T485 PolarHBondContact ND1-OG1 2.7Å; H483-T485 PolarHBondContact O-N 2.88Å; T485-P487 VanDerWaalsContact C-CD 3.46Å; T485-Q488 PolarHBondContact O-N 3.03Å; T485-Q488 VanDerWaalsContact O-N 3.11Å; T485-Q488 PolarHBondContact O-OE1 3.27Å; T485-I489 WeakPolarHBondContact O-CG1 3.49Å; T485-I489 PolarHBondContact O-N 3.02Å
486	S	88	Confident	88.7	Confident	13 Å²	13	46.5 Å²	46.5	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-53.1	-41.5	-179.7	176	0	0	0	0	113.8	H483 Q488 I489 C490	H483-S486 WeakPolarHBondContact O-CB 3.2Å; H483-S486 PolarHBondContact O-N 2.82Å; S486-Q488 PolarHBondContact O-N 2.8Å; S486-I489 PolarHBondContact O-N 3.23Å; S486-C490 PolarHBondContact O-N 3.27Å; S486-C490 PolarHBondContact O-SG 2.82Å
487	P	88.9	Confident	89.1	Confident	87 Å²	87	44.4 Å²	44.4	57%	0.565	23%	0.234	S	C	*	.	H	α-helix	trans	-59.3	-45.3	174.7	-24.5	35.4	0	0	0	112.9	T485 I489 C490 E491	T485-P487 VanDerWaalsContact C-CD 3.46Å; P487-I489 VanDerWaalsContact C-N 3.35Å; P487-I489 PolarHBondContact O-N 2.87Å; P487-C490 PolarHBondContact O-N 3.05Å; P487-E491 WeakPolarHBondContact O-CB 3.49Å; P487-E491 PolarHBondContact O-N 2.97Å
488	Q	90.2	Very high	89.6	Confident	56 Å²	56	40.7 Å²	40.7	26%	0.262	22%	0.217	S	C	.	.	H	α-helix	trans	-66.3	-36.4	179.2	-63.5	86.4	-27.2	0	0	111.7	A438 T485 S486 F492 L666	A438-Q488 HydrophobicContact CB-CB 4.07Å; A438-Q488 HydrophobicContact CB-CG 4.32Å; T485-Q488 PolarHBondContact O-N 3.03Å; T485-Q488 VanDerWaalsContact O-N 3.11Å; T485-Q488 PolarHBondContact O-OE1 3.27Å; S486-Q488 PolarHBondContact O-N 2.8Å; Q488-F492 VanDerWaalsContact O-CB 3.26Å; Q488-F492 WeakPolarHBondContact O-CB 3.5Å; Q488-F492 PolarHBondContact O-N 3.46Å; Q488-L666 HydrophobicContact CB-CD2 4.47Å
489	I	91.2	Very high	89.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.2	-46.2	174.9	-61.6	164	0	0	0	110.6	I437 Y442 L475 N478 I479 T485 S486 P487 E491 F492 L493	I437-I489 HydrophobicContact CB-CG1 4.43Å; I437-I489 HydrophobicContact CD1-CG2 4.38Å; I437-I489 HydrophobicContact CG2-CG1 3.96Å; Y442-I489 WeakPolarHBondContact OH-CD1 3.43Å; L475-I489 HydrophobicContact CD2-CG2 3.65Å; L475-I489 HydrophobicContact CG-CG2 4.15Å; N478-I489 HydrophobicContact CB-CD1 4.08Å; I479-I489 HydrophobicContact CD1-CG2 3.76Å; I479-I489 HydrophobicContact CG1-CB 4.32Å; I479-I489 HydrophobicContact CG1-CG2 3.77Å; T485-I489 WeakPolarHBondContact O-CG1 3.49Å; T485-I489 PolarHBondContact O-N 3.02Å; S486-I489 PolarHBondContact O-N 3.23Å; P487-I489 VanDerWaalsContact C-N 3.35Å; P487-I489 PolarHBondContact O-N 2.87Å; I489-E491 VanDerWaalsContact C-N 3.33Å; I489-E491 PolarHBondContact O-N 3.48Å; I489-F492 PolarHBondContact O-N 2.64Å; I489-L493 HydrophobicContact CG2-CD1 4.21Å; I489-L493 WeakPolarHBondContact O-CG 3.38Å; I489-L493 PolarHBondContact O-N 2.95Å
490	C	90.9	Very high	90.2	Very high	37 Å²	37	39.2 Å²	39.2	25%	0.25	21%	0.209	C	C	.	.	H	α-helix	trans	-62.9	-40.1	177	-64.5	0	0	0	0	112.1	S486 P487 T494 F532	S486-C490 PolarHBondContact O-N 3.27Å; S486-C490 PolarHBondContact O-SG 2.82Å; P487-C490 PolarHBondContact O-N 3.05Å; C490-T494 VanDerWaalsContact O-CB 3.28Å; C490-T494 WeakPolarHBondContact O-CB 3.34Å; C490-T494 PolarHBondContact O-N 2.96Å; C490-T494 PolarHBondContact O-OG1 3.1Å; C490-F532 HydrophobicContact CB-CZ 4.24Å
491	E	92.3	Very high	90.3	Very high	37 Å²	37	34.1 Å²	34.1	17%	0.173	19%	0.186	C	C	.	.	H	α-helix	trans	-65.2	-41.9	176.3	-167	71.5	-127.5	0	0	111.9	P487 I489 T494 M495 R580 Y582 L666	P487-E491 WeakPolarHBondContact O-CB 3.49Å; P487-E491 PolarHBondContact O-N 2.97Å; I489-E491 VanDerWaalsContact C-N 3.33Å; I489-E491 PolarHBondContact O-N 3.48Å; E491-T494 WeakPolarHBondContact O-CB 3.06Å; E491-T494 PolarHBondContact O-N 2.73Å; E491-M495 WeakPolarHBondContact O-CB 3.49Å; E491-M495 PolarHBondContact O-N 3.48Å; E491-R580 IonicContact OE1-CZ 1.85Å; E491-R580 IonicContact OE1-NH1 3.9Å; E491-R580 PolarHBondContact OE1-NH1 3.34Å; E491-R580 IonicContact OE2-CZ 2.6Å; E491-R580 IonicContact OE2-NH1 2.74Å; E491-R580 PolarHBondContact OE2-NH1 3.48Å; E491-Y582 WeakPolarHBondContact OE1-CE1 3.41Å; E491-Y582 PolarHBondContact OE1-OH 3.41Å; E491-L666 HydrophobicContact CB-CD1 4.47Å; E491-L666 HydrophobicContact CB-CD2 4.03Å; E491-L666 HydrophobicContact CG-CD1 3.96Å; E491-L666 HydrophobicContact CG-CD2 3.9Å
492	F	94.2	Very high	90.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63.3	-46.7	176.7	-177.6	-93	0	0	0	112.4	C435 I437 Q488 I489 M495 M496 F621 L666 T669	C435-F492 HydrophobicContact CB-CE1 4.23Å; C435-F492 HydrophobicContact CB-CZ 4.17Å; I437-F492 HydrophobicContact CD1-CB 4.46Å; I437-F492 HydrophobicContact CD1-CD1 3.38Å; I437-F492 HydrophobicContact CD1-CE1 3.58Å; I437-F492 HydrophobicContact CD1-CG 3.98Å; I437-F492 HydrophobicContact CD1-CZ 4.31Å; I437-F492 HydrophobicContact CG1-CD1 3.77Å; I437-F492 HydrophobicContact CG1-CD2 4.28Å; I437-F492 HydrophobicContact CG1-CE1 3.72Å; I437-F492 HydrophobicContact CG1-CE2 4.23Å; I437-F492 HydrophobicContact CG1-CG 4.03Å; I437-F492 HydrophobicContact CG1-CZ 3.93Å; I437-F492 HydrophobicContact CG2-CB 4.08Å; I437-F492 HydrophobicContact CG2-CD2 4.44Å; I437-F492 HydrophobicContact CG2-CG 4.19Å; Q488-F492 VanDerWaalsContact O-CB 3.26Å; Q488-F492 WeakPolarHBondContact O-CB 3.5Å; Q488-F492 PolarHBondContact O-N 3.46Å; I489-F492 PolarHBondContact O-N 2.64Å; F492-M495 PolarHBondContact O-N 2.98Å; F492-M496 HydrophobicContact CD1-SD 3.9Å; F492-M496 HydrophobicContact CE1-SD 3.6Å; F492-M496 VanDerWaalsContact CE1-SD 3.6Å; F492-M496 HydrophobicContact CZ-SD 4.42Å; F492-M496 PolarHBondContact O-N 2.98Å; F492-F621 HydrophobicContact CD2-CB 3.99Å; F492-F621 HydrophobicContact CD2-CG 4.34Å; F492-F621 HydrophobicContact CE2-CB 3.81Å; F492-F621 HydrophobicContact CE2-CD2 4.2Å; F492-F621 AromaticContact CE2-CG 3.94Å; F492-F621 HydrophobicContact CE2-CG 3.94Å; F492-L666 HydrophobicContact CB-CB 4.39Å; F492-L666 HydrophobicContact CD2-CB 3.91Å; F492-T669 HydrophobicContact CE1-CG2 4.02Å; F492-T669 HydrophobicContact CE2-CG2 4.35Å; F492-T669 HydrophobicContact CZ-CG2 3.45Å; F492-T669 VanDerWaalsContact CZ-CG2 3.45Å
493	L	92.9	Very high	90.7	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-67.2	-37.5	176.6	-63.9	177	0	0	0	112.2	L475 I479 I489 M495 M496 A497 L530 F532	L475-L493 HydrophobicContact CD2-CD1 4.05Å; I479-L493 HydrophobicContact CD1-CD1 4.12Å; I489-L493 HydrophobicContact CG2-CD1 4.21Å; I489-L493 WeakPolarHBondContact O-CG 3.38Å; I489-L493 PolarHBondContact O-N 2.95Å; L493-M495 VanDerWaalsContact C-N 3.34Å; L493-M496 HydrophobicContact CD2-SD 4.17Å; L493-M496 PolarHBondContact O-N 3.25Å; L493-A497 PolarHBondContact O-N 3.34Å; L493-A497 VanDerWaalsContact O-N 3.15Å; L493-L530 HydrophobicContact CD1-CB 4.21Å; L493-L530 HydrophobicContact CD2-CB 4.27Å; L493-L530 HydrophobicContact CD2-CD1 3.57Å; L493-F532 HydrophobicContact CB-CB 4.41Å; L493-F532 HydrophobicContact CB-CD1 4.04Å; L493-F532 HydrophobicContact CB-CD2 3.62Å; L493-F532 HydrophobicContact CB-CE1 4.18Å; L493-F532 HydrophobicContact CB-CE2 3.79Å; L493-F532 HydrophobicContact CB-CG 3.76Å; L493-F532 HydrophobicContact CB-CZ 4.07Å; L493-F532 HydrophobicContact CD1-CD2 3.68Å; L493-F532 HydrophobicContact CD1-CE2 3.49Å; L493-F532 VanDerWaalsContact CD1-CE2 3.49Å; L493-F532 HydrophobicContact CD1-CZ 4.3Å; L493-F532 HydrophobicContact CG-CD2 4.28Å; L493-F532 HydrophobicContact CG-CE2 4.3Å
494	T	93.3	Very high	90.7	Very high	9 Å²	9	18.5 Å²	18.5	6%	0.055	11%	0.112	C	C	.	.	H	α-helix	trans	-58.8	-46.1	170.6	-61.5	0	0	0	0	110.9	C490 E491 M496 A497 V498 F532 I544 Y553	C490-T494 VanDerWaalsContact O-CB 3.28Å; C490-T494 WeakPolarHBondContact O-CB 3.34Å; C490-T494 PolarHBondContact O-N 2.96Å; C490-T494 PolarHBondContact O-OG1 3.1Å; E491-T494 WeakPolarHBondContact O-CB 3.06Å; E491-T494 PolarHBondContact O-N 2.73Å; T494-M496 VanDerWaalsContact C-N 3.34Å; T494-M496 PolarHBondContact O-N 3.47Å; T494-A497 CarbonylContact O-C 3.59Å; T494-A497 PolarHBondContact O-N 3.13Å; T494-A497 VanDerWaalsContact O-N 3.1Å; T494-V498 HydrophobicContact CG2-CG2 4.36Å; T494-V498 WeakPolarHBondContact O-CB 3.37Å; T494-V498 WeakPolarHBondContact O-CG2 3.23Å; T494-V498 PolarHBondContact O-N 3.48Å; T494-V498 VanDerWaalsContact O-N 3.12Å; T494-F532 WeakPolarHBondContact OG1-CE1 3.33Å; T494-I544 HydrophobicContact CG2-CD1 4.11Å; T494-Y553 HydrophobicContact CG2-CE1 4.13Å; T494-Y553 HydrophobicContact CG2-CE2 4.24Å; T494-Y553 VanDerWaalsContact CG2-OH 3.27Å; T494-Y553 WeakPolarHBondContact CG2-OH 3.49Å
495	M	93.9	Very high	90.4	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-63.7	-37.9	178.8	-177.7	173.9	162.9	0	0	112.2	E491 F492 L493 A497 V498 C499 Y582 C583 K584 F621 A622 L666	E491-M495 WeakPolarHBondContact O-CB 3.49Å; E491-M495 PolarHBondContact O-N 3.48Å; F492-M495 PolarHBondContact O-N 2.98Å; L493-M495 VanDerWaalsContact C-N 3.34Å; M495-A497 VanDerWaalsContact C-N 3.28Å; M495-A497 PolarHBondContact O-N 3.02Å; M495-V498 PolarHBondContact O-N 2.75Å; M495-C499 HydrophobicContact CG-CB 4.06Å; M495-C499 VanDerWaalsContact O-CB 3.3Å; M495-C499 WeakPolarHBondContact O-CB 3.47Å; M495-C499 PolarHBondContact O-N 3.47Å; M495-Y582 HydrophobicContact CB-CD1 3.93Å; M495-Y582 HydrophobicContact CB-CE1 4.05Å; M495-Y582 HydrophobicContact CB-CG 4.37Å; M495-Y582 HydrophobicContact CG-CD1 3.65Å; M495-Y582 HydrophobicContact CG-CE1 4.29Å; M495-Y582 HydrophobicContact CG-CG 3.8Å; M495-Y582 HydrophobicContact SD-CD1 3.66Å; M495-Y582 HydrophobicContact SD-CG 4.15Å; M495-C583 VanDerWaalsContact CE-C 3.47Å; M495-C583 VanDerWaalsContact CE-O 3.24Å; M495-C583 WeakPolarHBondContact CE-O 3.39Å; M495-K584 HydrophobicContact CE-CB 4.04Å; M495-F621 HydrophobicContact CB-CD1 4.49Å; M495-F621 HydrophobicContact CE-CB 3.95Å; M495-F621 HydrophobicContact CE-CD1 3.55Å; M495-F621 HydrophobicContact CE-CE1 4.36Å; M495-F621 HydrophobicContact CE-CG 4.04Å; M495-F621 HydrophobicContact CG-CD1 3.89Å; M495-F621 HydrophobicContact CG-CE1 4.42Å; M495-F621 HydrophobicContact SD-CB 4.1Å; M495-F621 HydrophobicContact SD-CD1 3.8Å; M495-F621 HydrophobicContact SD-CG 4.43Å; M495-A622 WeakPolarHBondContact CE-O 3.06Å; M495-L666 HydrophobicContact SD-CD1 3.94Å
496	M	92.9	Very high	90.1	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.015	11%	0.114	C	C	.	.	H	α-helix	trans	-61.5	-33.2	172.1	-72.6	173.9	54.2	0	0	113	F432 F492 L493 T494 H500 L523 A526 A527 F621 T669	F432-M496 HydrophobicContact CD2-CE 3.98Å; F432-M496 HydrophobicContact CE2-CE 3.43Å; F432-M496 VanDerWaalsContact CE2-CE 3.43Å; F432-M496 HydrophobicContact CE2-SD 3.97Å; F432-M496 HydrophobicContact CZ-CE 3.9Å; F432-M496 HydrophobicContact CZ-SD 4.22Å; F492-M496 HydrophobicContact CD1-SD 3.9Å; F492-M496 HydrophobicContact CE1-SD 3.6Å; F492-M496 VanDerWaalsContact CE1-SD 3.6Å; F492-M496 HydrophobicContact CZ-SD 4.42Å; F492-M496 PolarHBondContact O-N 2.98Å; L493-M496 HydrophobicContact CD2-SD 4.17Å; L493-M496 PolarHBondContact O-N 3.25Å; T494-M496 VanDerWaalsContact C-N 3.34Å; T494-M496 PolarHBondContact O-N 3.47Å; M496-H500 PolarHBondContact O-CD2 3.32Å; M496-L523 HydrophobicContact CE-CB 4.46Å; M496-L523 HydrophobicContact CE-CD2 4.01Å; M496-L523 VanDerWaalsContact CE-O 3.27Å; M496-L523 WeakPolarHBondContact CE-O 3.33Å; M496-L523 HydrophobicContact CG-CD2 4.38Å; M496-A526 HydrophobicContact CE-CB 3.94Å; M496-A527 HydrophobicContact CB-CB 4.16Å; M496-A527 HydrophobicContact CE-CB 4.48Å; M496-F621 HydrophobicContact CG-CD1 4.43Å; M496-F621 HydrophobicContact CG-CE1 3.73Å; M496-F621 HydrophobicContact CG-CZ 4.15Å; M496-T669 HydrophobicContact SD-CG2 4.28Å
497	A	93.4	Very high	89.4	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	4.9	179	0	0	0	0	0	114.8	L493 T494 M495 H500 A527 F532 I544	L493-A497 PolarHBondContact O-N 3.34Å; L493-A497 VanDerWaalsContact O-N 3.15Å; T494-A497 CarbonylContact O-C 3.59Å; T494-A497 PolarHBondContact O-N 3.13Å; T494-A497 VanDerWaalsContact O-N 3.1Å; M495-A497 VanDerWaalsContact C-N 3.28Å; M495-A497 PolarHBondContact O-N 3.02Å; A497-H500 VanDerWaalsContact C-NE2 3.26Å; A497-H500 PolarHBondContact O-NE2 3.01Å; A497-H500 VanDerWaalsContact O-NE2 3.13Å; A497-A527 HydrophobicContact CB-CB 4.11Å; A497-F532 HydrophobicContact CB-CB 4.43Å; A497-I544 HydrophobicContact CB-CG2 4.06Å; A497-I544 WeakPolarHBondContact O-CG2 3.22Å
498	V	92.7	Very high	88.7	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.006	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.2	-41.3	-178.6	175	0	0	0	0	113	T494 M495 H500 V542 I544 Y553 V570 V572 Y582	T494-V498 HydrophobicContact CG2-CG2 4.36Å; T494-V498 WeakPolarHBondContact O-CB 3.37Å; T494-V498 WeakPolarHBondContact O-CG2 3.23Å; T494-V498 PolarHBondContact O-N 3.48Å; T494-V498 VanDerWaalsContact O-N 3.12Å; M495-V498 PolarHBondContact O-N 2.75Å; V498-H500 VanDerWaalsContact C-N 3.33Å; V498-H500 PolarHBondContact O-N 2.92Å; V498-V542 HydrophobicContact CG2-CG1 4.28Å; V498-I544 HydrophobicContact CG2-CD1 4.25Å; V498-I544 HydrophobicContact CG2-CG2 4.21Å; V498-Y553 HydrophobicContact CG1-CG 4.5Å; V498-Y553 HydrophobicContact CG2-CD2 4.07Å; V498-Y553 HydrophobicContact CG2-CE2 4.41Å; V498-Y553 HydrophobicContact CG2-CG 4.18Å; V498-V570 HydrophobicContact CG1-CG2 4.48Å; V498-V572 HydrophobicContact CG1-CG1 3.97Å; V498-Y582 HydrophobicContact CB-CE2 4.36Å; V498-Y582 HydrophobicContact CG1-CD2 4.2Å; V498-Y582 HydrophobicContact CG1-CE2 4.04Å
499	C	92.5	Very high	88	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.014	19%	0.186	C	C	.	.	S	Bend	trans	-83.6	70.5	-177.2	-169.5	0	0	0	0	111.4	M495 V570 K584	M495-C499 HydrophobicContact CG-CB 4.06Å; M495-C499 VanDerWaalsContact O-CB 3.3Å; M495-C499 WeakPolarHBondContact O-CB 3.47Å; M495-C499 PolarHBondContact O-N 3.47Å; C499-V570 HydrophobicContact CB-CG2 3.96Å; C499-K584 WeakPolarHBondContact O-CE 3.46Å; C499-K584 PolarHBondContact O-NZ 3.33Å
500	H	91.4	Very high	87.4	Confident	3 Å²	3	44.5 Å²	44.5	1%	0.014	22%	0.217	C	C	.	.	S	Bend	trans	-161.4	162.6	178.8	60.8	77.8	0	0	0	114.9	M496 A497 V498 V502 E520 V524 F534 R537	M496-H500 PolarHBondContact O-CD2 3.32Å; A497-H500 VanDerWaalsContact C-NE2 3.26Å; A497-H500 PolarHBondContact O-NE2 3.01Å; A497-H500 VanDerWaalsContact O-NE2 3.13Å; V498-H500 VanDerWaalsContact C-N 3.33Å; V498-H500 PolarHBondContact O-N 2.92Å; H500-V502 HydrophobicContact CB-CG2 4.1Å; H500-V502 WeakPolarHBondContact ND1-CB 3.33Å; H500-V502 PolarHBondContact ND1-N 2.8Å; H500-E520 VanDerWaalsContact CA-OE1 3.29Å; H500-E520 WeakPolarHBondContact CA-OE1 3.42Å; H500-V524 HydrophobicContact CB-CG2 4.27Å; H500-V524 VanDerWaalsContact CD2-CG2 3.43Å; H500-V524 WeakPolarHBondContact CD2-CG2 3.47Å; H500-F534 AromaticContact CE1-CD1 3.61Å; H500-F534 AromaticContact CE1-CE1 3.48Å; H500-F534 VanDerWaalsContact CE1-CE1 3.48Å; H500-F534 WeakPolarHBondContact CE1-CE1 3.43Å; H500-F534 AromaticContact CE1-CZ 3.76Å; H500-R537 PolarHBondContact CE1-NH2 2.95Å; H500-R537 PolarHBondContact ND1-NH2 2.84Å; H500-R537 PolarHBondContact O-NH1 3.44Å; H500-R537 PolarHBondContact O-NH2 3.41Å
501	T	88.7	Confident	87.1	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.031	21%	0.213	C	C	.	.			trans	-85.2	-19	173.6	63.2	0	0	0	0	114.4	E520 M568 Q1163 V1167	T501-E520 WeakPolarHBondContact CA-OE2 3.35Å; T501-E520 WeakPolarHBondContact CB-OE2 3.2Å; T501-E520 PolarHBondContact N-OE1 2.68Å; T501-E520 PolarHBondContact N-OE2 2.82Å; T501-E520 PolarHBondContact OG1-OE2 3.14Å; T501-M568 HydrophobicContact CG2-CE 3.62Å; T501-Q1163 HydrophobicContact CG2-CB 3.98Å; T501-Q1163 HydrophobicContact CG2-CG 4.37Å; T501-V1167 HydrophobicContact CG2-CG2 4.31Å
502	V	88.3	Confident	86.7	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.006	22%	0.222	C	C	.	.			trans	-43.3	135.2	-177.3	-171	0	0	0	0	113.7	H500 Y513 Q514 A515 E520 V524 F534	H500-V502 HydrophobicContact CB-CG2 4.1Å; H500-V502 WeakPolarHBondContact ND1-CB 3.33Å; H500-V502 PolarHBondContact ND1-N 2.8Å; V502-Y513 HydrophobicContact CG1-CD1 4.26Å; V502-Y513 HydrophobicContact CG1-CG 4.26Å; V502-Q514 CarbonylContact C-O 3.53Å; V502-Q514 VanDerWaalsContact CA-O 3.29Å; V502-Q514 WeakPolarHBondContact CA-O 3.31Å; V502-Q514 VanDerWaalsContact CG1-O 3.26Å; V502-Q514 WeakPolarHBondContact CG1-O 3.37Å; V502-A515 HydrophobicContact CB-CB 4.41Å; V502-A515 HydrophobicContact CG1-CB 4.28Å; V502-A515 HydrophobicContact CG2-CB 3.69Å; V502-E520 HydrophobicContact CG2-CB 3.8Å; V502-V524 HydrophobicContact CB-CG2 4.26Å; V502-V524 HydrophobicContact CG2-CB 4.44Å; V502-V524 HydrophobicContact CG2-CG2 3.77Å; V502-F534 HydrophobicContact CB-CE1 4.48Å; V502-F534 HydrophobicContact CG1-CE1 4.46Å; V502-F534 WeakPolarHBondContact O-CE1 3.45Å; V502-F534 WeakPolarHBondContact O-CZ 3.49Å
503	V	86.6	Confident	86.4	Confident	9 Å²	9	46.9 Å²	46.9	6%	0.055	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	134.4	174.6	-178.6	0	0	0	0	109.5	Q514 Y1170 T1172	V503-Q514 PolarHBondContact N-O 3.42Å; V503-Q514 PolarHBondContact O-N 3.04Å; V503-Y1170 HydrophobicContact CG1-CD1 4.25Å; V503-Y1170 HydrophobicContact CG1-CD2 4.44Å; V503-Y1170 HydrophobicContact CG1-CG 4.12Å; V503-Y1170 HydrophobicContact CG2-CD2 3.92Å; V503-Y1170 HydrophobicContact CG2-CE2 4.3Å; V503-Y1170 HydrophobicContact CG2-CG 4.37Å; V503-T1172 HydrophobicContact CG1-CG2 3.94Å
504	P	88.4	Confident	85.7	Confident	4 Å²	4	48.5 Å²	48.5	3%	0.026	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	120.7	177.2	35.3	-26.3	0	0	0	110.2	I511 Y513 F534 T1172	P504-I511 HydrophobicContact CB-CG2 3.93Å; P504-Y513 HydrophobicContact CB-CD1 4.26Å; P504-Y513 HydrophobicContact CB-CE1 4.28Å; P504-F534 HydrophobicContact CB-CD1 4.06Å; P504-F534 HydrophobicContact CB-CE1 3.8Å; P504-F534 HydrophobicContact CB-CZ 4.28Å; P504-F534 VanDerWaalsContact CD-CE1 3.41Å; P504-F534 VanDerWaalsContact CD-CZ 3.4Å; P504-F534 HydrophobicContact CG-CD1 4.16Å; P504-F534 HydrophobicContact CG-CE1 3.53Å; P504-F534 HydrophobicContact CG-CE2 4.07Å; P504-F534 HydrophobicContact CG-CZ 3.51Å; P504-T1172 HydrophobicContact CG-CG2 4.4Å
505	E	80.9	Confident	85	Confident	42 Å²	42	49.9 Å²	49.9	20%	0.196	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	145.9	165	-70.1	-160.4	-160.5	0	0	110.2	I511 I512 Q514 R1176	E505-I511 CarbonylContact O-C 3.54Å; E505-I511 WeakPolarHBondContact O-CA 3.44Å; E505-I512 PolarHBondContact N-O 3.46Å; E505-I512 PolarHBondContact O-N 2.85Å; E505-Q514 PolarHBondContact OE1-NE2 2.68Å; E505-R1176 IonicContact OE1-CZ 3.05Å; E505-R1176 IonicContact OE1-NH1 3.28Å; E505-R1176 PolarHBondContact OE1-NH1 3.14Å; E505-R1176 VanDerWaalsContact OE1-NH1 3.09Å; E505-R1176 IonicContact OE1-NH2 3.37Å; E505-R1176 PolarHBondContact OE1-NH2 3.34Å; E505-R1176 IonicContact OE2-CZ 2.74Å; E505-R1176 IonicContact OE2-NH1 3.09Å; E505-R1176 PolarHBondContact OE2-NH1 3.09Å; E505-R1176 IonicContact OE2-NH2 3.38Å
506	R	79.6	Confident	84	Confident	169 Å²	169	52 Å²	52	64%	0.638	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	118.4	171.2	-66.2	-174	-173.7	-165.5	2.6	108.4	Q510 I511 T535	R506-Q510 WeakPolarHBondContact CA-O 3.5Å; R506-I511 HydrophobicContact CG-CG1 4.22Å; R506-T535 PolarHBondContact NH2-O 2.92Å; R506-T535 VanDerWaalsContact NH2-O 3.16Å
507	E	74.3	Confident	83.2	Confident	135 Å²	135	51.8 Å²	51.8	63%	0.631	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.1	115.8	170.8	-162.8	162.9	-135.2	0	0	106.7	D509 Q510 I512	E507-D509 PolarHBondContact O-N 3.09Å; E507-D509 VanDerWaalsContact O-N 3.15Å; E507-Q510 PolarHBondContact N-O 2.78Å; E507-Q510 PolarHBondContact O-N 2.82Å; E507-I512 HydrophobicContact CB-CD1 3.82Å; E507-I512 VanDerWaalsContact OE2-CD1 3.27Å; E507-I512 WeakPolarHBondContact OE2-CD1 3.47Å
508	D	74.7	Confident	82.5	Confident	169 Å²	169	53.7 Å²	53.7	90%	0.904	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.6	-112.5	-161.7	-61.6	-36	0	0	0	112.9
509	D	74	Confident	82	Confident	166 Å²	166	53.7 Å²	53.7	89%	0.888	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	8.6	-177.4	-151.6	33.3	0	0	0	112.5	E507	E507-D509 PolarHBondContact O-N 3.09Å; E507-D509 VanDerWaalsContact O-N 3.15Å
510	Q	80.1	Confident	81.8	Confident	141 Å²	141	53.6 Å²	53.6	66%	0.659	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112	133.2	179.5	-64	-161	16.6	0	0	112.9	R506 E507	R506-Q510 WeakPolarHBondContact CA-O 3.5Å; E507-Q510 PolarHBondContact N-O 2.78Å; E507-Q510 PolarHBondContact O-N 2.82Å
511	I	84.9	Confident	81.6	Confident	31 Å²	31	53.7 Å²	53.7	16%	0.159	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	115.8	169	-56.7	167	0	0	0	109.2	P504 E505 R506 Y513 K528 V533	P504-I511 HydrophobicContact CB-CG2 3.93Å; E505-I511 CarbonylContact O-C 3.54Å; E505-I511 WeakPolarHBondContact O-CA 3.44Å; R506-I511 HydrophobicContact CG-CG1 4.22Å; I511-Y513 HydrophobicContact CG2-CD1 3.93Å; I511-Y513 HydrophobicContact CG2-CE1 3.51Å; I511-K528 PolarHBondContact O-NZ 3.33Å; I511-K528 VanDerWaalsContact O-NZ 3.12Å; I511-V533 HydrophobicContact CD1-CG1 3.88Å
512	I	83.8	Confident	81.7	Confident	72 Å²	72	53.8 Å²	53.8	37%	0.369	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	126.1	173.4	-59.3	178.7	0	0	0	108.6	E505 E507	E505-I512 PolarHBondContact N-O 3.46Å; E505-I512 PolarHBondContact O-N 2.85Å; E507-I512 HydrophobicContact CB-CD1 3.82Å; E507-I512 VanDerWaalsContact OE2-CD1 3.27Å; E507-I512 WeakPolarHBondContact OE2-CD1 3.47Å
513	Y	86.8	Confident	81.8	Confident	22 Å²	22	54 Å²	54	9%	0.086	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	116.1	179.4	-66.3	-44.5	0	0	0	111.4	V502 P504 I511 V524 K525 K528 F534	V502-Y513 HydrophobicContact CG1-CD1 4.26Å; V502-Y513 HydrophobicContact CG1-CG 4.26Å; P504-Y513 HydrophobicContact CB-CD1 4.26Å; P504-Y513 HydrophobicContact CB-CE1 4.28Å; I511-Y513 HydrophobicContact CG2-CD1 3.93Å; I511-Y513 HydrophobicContact CG2-CE1 3.51Å; Y513-V524 HydrophobicContact CD1-CG1 4.01Å; Y513-V524 HydrophobicContact CD2-CB 4.46Å; Y513-V524 HydrophobicContact CD2-CG1 3.88Å; Y513-V524 HydrophobicContact CE1-CG1 3.87Å; Y513-V524 HydrophobicContact CE2-CG1 3.7Å; Y513-V524 HydrophobicContact CG-CG1 4.02Å; Y513-K525 HydrophobicContact CD2-CG 3.95Å; Y513-K528 HydrophobicContact CE2-CB 3.91Å; Y513-K528 HydrophobicContact CE2-CD 3.6Å; Y513-K528 HydrophobicContact CE2-CG 4.35Å; Y513-F534 AromaticContact CD1-CD1 3.97Å; Y513-F534 HydrophobicContact CD1-CD1 3.97Å; Y513-F534 HydrophobicContact CE1-CB 3.98Å; Y513-F534 AromaticContact CE1-CD1 3.63Å; Y513-F534 HydrophobicContact CE1-CD1 3.63Å; Y513-F534 HydrophobicContact CE1-CG 4.22Å; Y513-F534 WeakPolarHBondContact CE1-O 3.09Å; Y513-F534 PolarHBondContact OH-N 3.27Å; Y513-F534 VanDerWaalsContact OH-N 3.14Å; Y513-F534 PolarHBondContact OH-O 3.35Å
514	Q	78.4	Confident	82.1	Confident	34 Å²	34	53.6 Å²	53.6	16%	0.159	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	120.2	174.4	-58.5	-177.6	8.8	0	0	109.6	N269 V502 V503 E505	N269-Q514 PolarHBondContact ND2-NE2 2.9Å; N269-Q514 PolarHBondContact ND2-OE1 3.17Å; V502-Q514 CarbonylContact C-O 3.53Å; V502-Q514 VanDerWaalsContact CA-O 3.29Å; V502-Q514 WeakPolarHBondContact CA-O 3.31Å; V502-Q514 VanDerWaalsContact CG1-O 3.26Å; V502-Q514 WeakPolarHBondContact CG1-O 3.37Å; V503-Q514 PolarHBondContact N-O 3.42Å; V503-Q514 PolarHBondContact O-N 3.04Å; E505-Q514 PolarHBondContact OE1-NE2 2.68Å
515	A	79.5	Confident	82.2	Confident	38 Å²	38	58.9 Å²	58.9	31%	0.314	30%	0.296	S	S	.	.			trans	-130.8	136.4	-175.9	0	0	0	0	0	110.7	V502 S517 E520	V502-A515 HydrophobicContact CB-CB 4.41Å; V502-A515 HydrophobicContact CG1-CB 4.28Å; V502-A515 HydrophobicContact CG2-CB 3.69Å; A515-S517 WeakPolarHBondContact CB-O 3.48Å; A515-S517 PolarHBondContact O-N 3.07Å; A515-E520 HydrophobicContact CB-CB 4.47Å
516	S	71.2	Confident	82.6	Confident	44 Å²	44	57.4 Å²	57.4	31%	0.308	29%	0.291	S	S	.	.	S	Bend	trans	-71.4	-17.7	171.4	-54.1	0	0	0	0	112.9
517	S	76.8	Confident	83.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.261	C	S	.	.	S	Bend	trans	-122.1	132.7	171.5	175.5	0	0	0	0	110.4	A515 D519 E520 G521 S1154	A515-S517 WeakPolarHBondContact CB-O 3.48Å; A515-S517 PolarHBondContact O-N 3.07Å; S517-D519 PolarHBondContact O-N 2.98Å; S517-D519 PolarHBondContact OG-N 2.92Å; S517-E520 PolarHBondContact O-N 3.38Å; S517-G521 PolarHBondContact O-N 3.32Å; S517-S1154 WeakPolarHBondContact CA-O 3.36Å; S517-S1154 WeakPolarHBondContact CB-O 3.39Å; S517-S1154 PolarHBondContact OG-O 3.27Å
518	P	78.3	Confident	83.9	Confident	40 Å²	40	46.6 Å²	46.6	26%	0.26	25%	0.247	S	C	.	.	H	α-helix	trans	-68.7	-23.7	175.1	31.3	-36.5	0	0	0	112.2	M430 G521 A522	M430-P518 HydrophobicContact CB-CB 4.46Å; M430-P518 HydrophobicContact CE-CG 4.19Å; M430-P518 HydrophobicContact CG-CB 3.71Å; M430-P518 HydrophobicContact CG-CG 3.93Å; P518-G521 PolarHBondContact O-N 3.36Å; P518-A522 WeakPolarHBondContact O-CB 3.36Å; P518-A522 PolarHBondContact O-N 2.75Å
519	D	83.9	Confident	84.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-67.7	-42.6	173.8	-57.7	-50.8	0	0	0	110.8	S517 A522 L523 R617 I671 F1153 S1154	S517-D519 PolarHBondContact O-N 2.98Å; S517-D519 PolarHBondContact OG-N 2.92Å; D519-A522 PolarHBondContact O-N 3.3Å; D519-L523 WeakPolarHBondContact O-CG 3.33Å; D519-L523 PolarHBondContact O-N 2.84Å; D519-L523 VanDerWaalsContact O-N 3.1Å; D519-R617 IonicContact OD1-CZ 2.72Å; D519-R617 IonicContact OD1-NH1 3.6Å; D519-R617 PolarHBondContact OD1-NH1 2.73Å; D519-R617 IonicContact OD2-NH1 3.24Å; D519-R617 PolarHBondContact OD2-NH1 2.98Å; D519-R617 VanDerWaalsContact OD2-NH1 3.09Å; D519-I671 HydrophobicContact CB-CD1 4.08Å; D519-F1153 HydrophobicContact CB-CD2 3.81Å; D519-F1153 HydrophobicContact CB-CE2 3.83Å; D519-S1154 VanDerWaalsContact OD2-CB 3.31Å; D519-S1154 WeakPolarHBondContact OD2-CB 3.46Å; D519-S1154 PolarHBondContact OD2-N 3.33Å
520	E	87.3	Confident	85.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-42.2	170.6	-69.2	-152.3	142	0	0	111.8	H500 T501 V502 A515 S517 A522 L523 V524 K584 F1153	H500-E520 VanDerWaalsContact CA-OE1 3.29Å; H500-E520 WeakPolarHBondContact CA-OE1 3.42Å; T501-E520 WeakPolarHBondContact CA-OE2 3.35Å; T501-E520 WeakPolarHBondContact CB-OE2 3.2Å; T501-E520 PolarHBondContact N-OE1 2.68Å; T501-E520 PolarHBondContact N-OE2 2.82Å; T501-E520 PolarHBondContact OG1-OE2 3.14Å; V502-E520 HydrophobicContact CG2-CB 3.8Å; A515-E520 HydrophobicContact CB-CB 4.47Å; S517-E520 PolarHBondContact O-N 3.38Å; E520-A522 VanDerWaalsContact C-N 3.29Å; E520-A522 PolarHBondContact O-N 3.33Å; E520-L523 PolarHBondContact O-N 2.95Å; E520-V524 WeakPolarHBondContact O-CG2 3.28Å; E520-V524 PolarHBondContact O-N 2.8Å; E520-K584 IonicContact OE1-NZ 2.66Å; E520-K584 PolarHBondContact OE1-NZ 3.15Å; E520-F1153 HydrophobicContact CG-CE2 4.17Å; E520-F1153 HydrophobicContact CG-CZ 3.81Å
521	G	88.3	Confident	85.4	Confident	6 Å²	6	28.1 Å²	28.1	6%	0.062	17%	0.17	C	C	.	.	H	α-helix	trans	-59.1	-39.2	176.4	0	0	0	0	0	112.8	S517 P518 K525	S517-G521 PolarHBondContact O-N 3.32Å; P518-G521 PolarHBondContact O-N 3.36Å; G521-K525 WeakPolarHBondContact O-CB 3.1Å; G521-K525 WeakPolarHBondContact O-CD 3.35Å; G521-K525 WeakPolarHBondContact O-CG 3.49Å; G521-K525 PolarHBondContact O-N 2.85Å; G521-K525 VanDerWaalsContact O-N 3.13Å
522	A	89.2	Confident	85.8	Confident	7 Å²	7	27 Å²	27	6%	0.058	16%	0.164	C	C	.	.	H	α-helix	trans	-67.3	-43.6	175.6	0	0	0	0	0	112.3	M430 P518 D519 E520 K525 A526 I671	M430-A522 HydrophobicContact CB-CB 3.98Å; M430-A522 WeakPolarHBondContact O-CB 3.14Å; P518-A522 WeakPolarHBondContact O-CB 3.36Å; P518-A522 PolarHBondContact O-N 2.75Å; D519-A522 PolarHBondContact O-N 3.3Å; E520-A522 VanDerWaalsContact C-N 3.29Å; E520-A522 PolarHBondContact O-N 3.33Å; A522-K525 PolarHBondContact O-N 2.7Å; A522-A526 WeakPolarHBondContact O-CB 3.45Å; A522-A526 PolarHBondContact O-N 3.34Å; A522-I671 HydrophobicContact CB-CG2 4.46Å
523	L	91.8	Very high	86.2	Confident	4 Å²	4	25 Å²	25	2%	0.021	16%	0.155	C	C	.	.	H	α-helix	trans	-60.4	-46.6	177.8	-71.6	165.4	0	0	0	112.4	F432 M496 D519 E520 A526 A527 L619 F621 T669 I671	F432-L523 HydrophobicContact CD2-CD2 3.96Å; F432-L523 HydrophobicContact CE2-CD2 3.99Å; M496-L523 HydrophobicContact CE-CB 4.46Å; M496-L523 HydrophobicContact CE-CD2 4.01Å; M496-L523 VanDerWaalsContact CE-O 3.27Å; M496-L523 WeakPolarHBondContact CE-O 3.33Å; M496-L523 HydrophobicContact CG-CD2 4.38Å; D519-L523 WeakPolarHBondContact O-CG 3.33Å; D519-L523 PolarHBondContact O-N 2.84Å; D519-L523 VanDerWaalsContact O-N 3.1Å; E520-L523 PolarHBondContact O-N 2.95Å; L523-A526 PolarHBondContact O-N 3.42Å; L523-A527 PolarHBondContact O-N 3.19Å; L523-L619 HydrophobicContact CD1-CD1 4.17Å; L523-F621 HydrophobicContact CD1-CZ 4.05Å; L523-F621 HydrophobicContact CD2-CE2 4.46Å; L523-F621 HydrophobicContact CD2-CZ 3.92Å; L523-T669 HydrophobicContact CD2-CG2 3.83Å; L523-I671 HydrophobicContact CD1-CD1 4.47Å; L523-I671 HydrophobicContact CD2-CD1 4.27Å; L523-I671 HydrophobicContact CG-CD1 4.06Å
524	V	91.9	Very high	86.5	Confident	1 Å²	1	24 Å²	24	1%	0.006	15%	0.151	C	C	.	.	H	α-helix	trans	-73.1	-31.8	-178.2	-178.4	0	0	0	0	111.8	H500 V502 Y513 E520 K528 F534	H500-V524 HydrophobicContact CB-CG2 4.27Å; H500-V524 VanDerWaalsContact CD2-CG2 3.43Å; H500-V524 WeakPolarHBondContact CD2-CG2 3.47Å; V502-V524 HydrophobicContact CB-CG2 4.26Å; V502-V524 HydrophobicContact CG2-CB 4.44Å; V502-V524 HydrophobicContact CG2-CG2 3.77Å; Y513-V524 HydrophobicContact CD1-CG1 4.01Å; Y513-V524 HydrophobicContact CD2-CB 4.46Å; Y513-V524 HydrophobicContact CD2-CG1 3.88Å; Y513-V524 HydrophobicContact CE1-CG1 3.87Å; Y513-V524 HydrophobicContact CE2-CG1 3.7Å; Y513-V524 HydrophobicContact CG-CG1 4.02Å; E520-V524 WeakPolarHBondContact O-CG2 3.28Å; E520-V524 PolarHBondContact O-N 2.8Å; V524-K528 PolarHBondContact O-N 2.79Å; V524-K528 VanDerWaalsContact O-N 3.09Å; V524-F534 HydrophobicContact CG1-CB 4.02Å; V524-F534 HydrophobicContact CG1-CD1 3.96Å; V524-F534 HydrophobicContact CG1-CG 4.45Å
525	K	90.3	Very high	87	Confident	116 Å²	116	23.1 Å²	23.1	50%	0.504	15%	0.148	S	C	.	.	H	α-helix	trans	-64	-44.8	169.3	-74.6	171	-175.4	177.8	0	111.8	Y513 G521 A522 A527 K528 G529	Y513-K525 HydrophobicContact CD2-CG 3.95Å; G521-K525 WeakPolarHBondContact O-CB 3.1Å; G521-K525 WeakPolarHBondContact O-CD 3.35Å; G521-K525 WeakPolarHBondContact O-CG 3.49Å; G521-K525 PolarHBondContact O-N 2.85Å; G521-K525 VanDerWaalsContact O-N 3.13Å; A522-K525 PolarHBondContact O-N 2.7Å; K525-A527 PolarHBondContact O-N 2.83Å; K525-K528 WeakPolarHBondContact O-CB 3.42Å; K525-K528 PolarHBondContact O-N 2.6Å; K525-G529 PolarHBondContact O-N 3.17Å
526	A	89.9	Confident	87.5	Confident	11 Å²	11	21.7 Å²	21.7	9%	0.091	14%	0.136	C	C	.	.	H	α-helix	trans	-63.6	-40.8	177	0	0	0	0	0	112.5	F432 M496 A522 L523 K528 G529 L530	F432-A526 HydrophobicContact CB-CB 3.57Å; F432-A526 HydrophobicContact CD1-CB 3.8Å; F432-A526 HydrophobicContact CD2-CB 3.87Å; F432-A526 HydrophobicContact CE1-CB 4.4Å; F432-A526 HydrophobicContact CE2-CB 4.44Å; F432-A526 HydrophobicContact CG-CB 3.49Å; F432-A526 VanDerWaalsContact CG-CB 3.49Å; M496-A526 HydrophobicContact CE-CB 3.94Å; A522-A526 WeakPolarHBondContact O-CB 3.45Å; A522-A526 PolarHBondContact O-N 3.34Å; L523-A526 PolarHBondContact O-N 3.42Å; A526-K528 PolarHBondContact O-N 3.25Å; A526-G529 PolarHBondContact O-N 2.74Å; A526-L530 WeakPolarHBondContact O-CB 3.32Å; A526-L530 WeakPolarHBondContact O-CG 3.42Å; A526-L530 PolarHBondContact O-N 2.91Å
527	A	90.6	Very high	88.4	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60	-43.6	173.7	0	0	0	0	0	112	M496 A497 L523 K525 L530 G531 F532	M496-A527 HydrophobicContact CB-CB 4.16Å; M496-A527 HydrophobicContact CE-CB 4.48Å; A497-A527 HydrophobicContact CB-CB 4.11Å; L523-A527 PolarHBondContact O-N 3.19Å; K525-A527 PolarHBondContact O-N 2.83Å; A527-L530 CarbonylContact O-C 3.52Å; A527-L530 PolarHBondContact O-N 3.42Å; A527-G531 PolarHBondContact O-N 3.31Å; A527-F532 CarbonylContact C-O 3.46Å; A527-F532 HydrophobicContact CB-CB 4.33Å; A527-F532 CarbonylContact O-C 3.57Å; A527-F532 WeakPolarHBondContact O-CA 3.42Å; A527-F532 PolarHBondContact O-N 2.96Å
528	K	89.7	Confident	88.9	Confident	77 Å²	77	21 Å²	21	34%	0.335	13%	0.13	S	C	.	.	H	α-helix	trans	-57.8	-48	173.8	176.1	-179.8	176.2	-174.2	0	112	I511 Y513 V524 K525 A526 L530 G531 F532 V533	I511-K528 PolarHBondContact O-NZ 3.33Å; I511-K528 VanDerWaalsContact O-NZ 3.12Å; Y513-K528 HydrophobicContact CE2-CB 3.91Å; Y513-K528 HydrophobicContact CE2-CD 3.6Å; Y513-K528 HydrophobicContact CE2-CG 4.35Å; V524-K528 PolarHBondContact O-N 2.79Å; V524-K528 VanDerWaalsContact O-N 3.09Å; K525-K528 WeakPolarHBondContact O-CB 3.42Å; K525-K528 PolarHBondContact O-N 2.6Å; A526-K528 PolarHBondContact O-N 3.25Å; K528-L530 VanDerWaalsContact C-N 3.28Å; K528-L530 PolarHBondContact O-N 3.11Å; K528-G531 PolarHBondContact O-N 3.47Å; K528-G531 VanDerWaalsContact O-N 3.13Å; K528-F532 PolarHBondContact N-O 3.24Å; K528-V533 HydrophobicContact CG-CG1 4.21Å; K528-V533 HydrophobicContact CG-CG2 4.2Å
529	G	86.3	Confident	89.2	Confident	47 Å²	47	20.6 Å²	20.6	49%	0.485	13%	0.128	S	C	.	.	H	α-helix	trans	-61.5	-34.2	177.1	0	0	0	0	0	113.3	K525 A526 G531	K525-G529 PolarHBondContact O-N 3.17Å; A526-G529 PolarHBondContact O-N 2.74Å; G529-G531 VanDerWaalsContact C-N 3.27Å; G529-G531 PolarHBondContact O-N 3.37Å
530	L	88.1	Confident	89.5	Confident	14 Å²	14	26.5 Å²	26.5	7%	0.073	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	11.4	176.3	-67.6	172.3	0	0	0	114.3	F470 L475 I476 L493 A526 A527 K528	F470-L530 HydrophobicContact CD1-CD1 4.04Å; F470-L530 HydrophobicContact CD1-CD2 4.01Å; F470-L530 HydrophobicContact CD1-CG 4.38Å; F470-L530 HydrophobicContact CE1-CD1 4.27Å; F470-L530 HydrophobicContact CE1-CD2 4.33Å; L475-L530 HydrophobicContact CD2-CD1 4.49Å; L475-L530 HydrophobicContact CD2-CD2 4.38Å; I476-L530 HydrophobicContact CD1-CB 4.38Å; I476-L530 HydrophobicContact CD1-CD2 3.8Å; I476-L530 HydrophobicContact CG1-CD2 4.02Å; L493-L530 HydrophobicContact CD1-CB 4.21Å; L493-L530 HydrophobicContact CD2-CB 4.27Å; L493-L530 HydrophobicContact CD2-CD1 3.57Å; A526-L530 WeakPolarHBondContact O-CB 3.32Å; A526-L530 WeakPolarHBondContact O-CG 3.42Å; A526-L530 PolarHBondContact O-N 2.91Å; A527-L530 CarbonylContact O-C 3.52Å; A527-L530 PolarHBondContact O-N 3.42Å; K528-L530 VanDerWaalsContact C-N 3.28Å; K528-L530 PolarHBondContact O-N 3.11Å
531	G	87.1	Confident	89.6	Confident	27 Å²	27	27.3 Å²	27.3	28%	0.278	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	18.5	174.3	0	0	0	0	0	115.5	A527 K528 G529 R547	A527-G531 PolarHBondContact O-N 3.31Å; K528-G531 PolarHBondContact O-N 3.47Å; K528-G531 VanDerWaalsContact O-N 3.13Å; G529-G531 VanDerWaalsContact C-N 3.27Å; G529-G531 PolarHBondContact O-N 3.37Å; G531-R547 PolarHBondContact O-N 3.49Å
532	F	91.8	Very high	89.8	Confident	7 Å²	7	27 Å²	27	3%	0.031	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	79	171.1	-73	-105.2	0	0	0	108.5	C490 L493 T494 A497 A527 K528 D545 A546 R547	C490-F532 HydrophobicContact CB-CZ 4.24Å; L493-F532 HydrophobicContact CB-CB 4.41Å; L493-F532 HydrophobicContact CB-CD1 4.04Å; L493-F532 HydrophobicContact CB-CD2 3.62Å; L493-F532 HydrophobicContact CB-CE1 4.18Å; L493-F532 HydrophobicContact CB-CE2 3.79Å; L493-F532 HydrophobicContact CB-CG 3.76Å; L493-F532 HydrophobicContact CB-CZ 4.07Å; L493-F532 HydrophobicContact CD1-CD2 3.68Å; L493-F532 HydrophobicContact CD1-CE2 3.49Å; L493-F532 VanDerWaalsContact CD1-CE2 3.49Å; L493-F532 HydrophobicContact CD1-CZ 4.3Å; L493-F532 HydrophobicContact CG-CD2 4.28Å; L493-F532 HydrophobicContact CG-CE2 4.3Å; T494-F532 WeakPolarHBondContact OG1-CE1 3.33Å; A497-F532 HydrophobicContact CB-CB 4.43Å; A527-F532 CarbonylContact C-O 3.46Å; A527-F532 HydrophobicContact CB-CB 4.33Å; A527-F532 CarbonylContact O-C 3.57Å; A527-F532 WeakPolarHBondContact O-CA 3.42Å; A527-F532 PolarHBondContact O-N 2.96Å; K528-F532 PolarHBondContact N-O 3.24Å; F532-D545 CarbonylContact C-O 3.18Å; F532-D545 WeakPolarHBondContact CA-O 3.39Å; F532-A546 HydrophobicContact CD1-CB 3.74Å; F532-A546 HydrophobicContact CE1-CB 3.74Å; F532-R547 HydrophobicContact CE2-CG 4.31Å
533	V	92.4	Very high	90	Very high	30 Å²	30	27.8 Å²	27.8	18%	0.182	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	124.1	-172.1	-172.7	0	0	0	0	109.9	I511 K528 T535 I544 D545	I511-V533 HydrophobicContact CD1-CG1 3.88Å; K528-V533 HydrophobicContact CG-CG1 4.21Å; K528-V533 HydrophobicContact CG-CG2 4.2Å; V533-T535 HydrophobicContact CB-CG2 4.36Å; V533-T535 HydrophobicContact CG1-CG2 4.11Å; V533-T535 PolarHBondContact O-N 3.13Å; V533-I544 CarbonylContact O-C 3.53Å; V533-I544 VanDerWaalsContact O-CA 3.23Å; V533-I544 WeakPolarHBondContact O-CA 3.3Å; V533-D545 HydrophobicContact CB-CB 4.43Å; V533-D545 PolarHBondContact N-O 3.47Å; V533-D545 PolarHBondContact O-N 2.83Å
534	F	93.1	Very high	90.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	111.7	170.2	167.9	-131.5	0	0	0	109.2	H500 V502 P504 Y513 V524 A536 R537 V542 I544	H500-F534 AromaticContact CE1-CD1 3.61Å; H500-F534 AromaticContact CE1-CE1 3.48Å; H500-F534 VanDerWaalsContact CE1-CE1 3.48Å; H500-F534 WeakPolarHBondContact CE1-CE1 3.43Å; H500-F534 AromaticContact CE1-CZ 3.76Å; V502-F534 HydrophobicContact CB-CE1 4.48Å; V502-F534 HydrophobicContact CG1-CE1 4.46Å; V502-F534 WeakPolarHBondContact O-CE1 3.45Å; V502-F534 WeakPolarHBondContact O-CZ 3.49Å; P504-F534 HydrophobicContact CB-CD1 4.06Å; P504-F534 HydrophobicContact CB-CE1 3.8Å; P504-F534 HydrophobicContact CB-CZ 4.28Å; P504-F534 VanDerWaalsContact CD-CE1 3.41Å; P504-F534 VanDerWaalsContact CD-CZ 3.4Å; P504-F534 HydrophobicContact CG-CD1 4.16Å; P504-F534 HydrophobicContact CG-CE1 3.53Å; P504-F534 HydrophobicContact CG-CE2 4.07Å; P504-F534 HydrophobicContact CG-CZ 3.51Å; Y513-F534 AromaticContact CD1-CD1 3.97Å; Y513-F534 HydrophobicContact CD1-CD1 3.97Å; Y513-F534 HydrophobicContact CE1-CB 3.98Å; Y513-F534 AromaticContact CE1-CD1 3.63Å; Y513-F534 HydrophobicContact CE1-CD1 3.63Å; Y513-F534 HydrophobicContact CE1-CG 4.22Å; Y513-F534 WeakPolarHBondContact CE1-O 3.09Å; Y513-F534 PolarHBondContact OH-N 3.27Å; Y513-F534 VanDerWaalsContact OH-N 3.14Å; Y513-F534 PolarHBondContact OH-O 3.35Å; V524-F534 HydrophobicContact CG1-CB 4.02Å; V524-F534 HydrophobicContact CG1-CD1 3.96Å; V524-F534 HydrophobicContact CG1-CG 4.45Å; F534-A536 WeakPolarHBondContact CE2-O 3.35Å; F534-R537 HydrophobicContact CE2-CB 4.12Å; F534-R537 HydrophobicContact CZ-CB 3.94Å; F534-V542 HydrophobicContact CD2-CG1 3.89Å; F534-V542 HydrophobicContact CE2-CG1 3.73Å; F534-I544 HydrophobicContact CD2-CG2 4.4Å
535	T	90.3	Very high	90.1	Very high	16 Å²	16	29.9 Å²	29.9	10%	0.098	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-30.7	-164.2	57.3	0	0	0	0	114.8	R506 V533 I543 D545	R506-T535 PolarHBondContact NH2-O 2.92Å; R506-T535 VanDerWaalsContact NH2-O 3.16Å; V533-T535 HydrophobicContact CB-CG2 4.36Å; V533-T535 HydrophobicContact CG1-CG2 4.11Å; V533-T535 PolarHBondContact O-N 3.13Å; T535-I543 PolarHBondContact N-O 2.9Å; T535-I543 WeakPolarHBondContact OG1-CG2 3.34Å; T535-I543 PolarHBondContact OG1-O 3.34Å; T535-D545 HydrophobicContact CG2-CB 3.86Å
536	A	89.6	Confident	90	Very high	9 Å²	9	25 Å²	25	7%	0.074	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	159.7	179.9	0	0	0	0	0	112.4	F534 I543 T1172 T1173	F534-A536 WeakPolarHBondContact CE2-O 3.35Å; A536-I543 HydrophobicContact CB-CB 4.29Å; A536-I543 HydrophobicContact CB-CD1 4.21Å; A536-I543 PolarHBondContact N-O 2.93Å; A536-I543 PolarHBondContact O-N 2.69Å; A536-T1172 WeakPolarHBondContact CA-OG1 3.47Å; A536-T1173 HydrophobicContact CB-CG2 4.36Å
537	R	89	Confident	89.7	Confident	2 Å²	2	30.2 Å²	30.2	1%	0.008	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	136	173.3	-177.2	166.1	-72	-154.3	-3.4	110.6	H500 F534 V1167 T1172	H500-R537 PolarHBondContact CE1-NH2 2.95Å; H500-R537 PolarHBondContact ND1-NH2 2.84Å; H500-R537 PolarHBondContact O-NH1 3.44Å; H500-R537 PolarHBondContact O-NH2 3.41Å; F534-R537 HydrophobicContact CE2-CB 4.12Å; F534-R537 HydrophobicContact CZ-CB 3.94Å; R537-V1167 VanDerWaalsContact NH1-CG2 3.35Å; R537-T1172 PolarHBondContact N-OG1 3.37Å; R537-T1172 PolarHBondContact O-N 3.47Å; R537-T1172 PolarHBondContact O-OG1 3Å
538	T	88.2	Confident	89.2	Confident	26 Å²	26	33.3 Å²	33.3	16%	0.16	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	168.6	168.7	82.3	0	0	0	0	109.3	H540 S541 Y1170 T1173	T538-H540 PolarHBondContact O-N 2.69Å; T538-H540 PolarHBondContact OG1-N 3.21Å; T538-S541 WeakPolarHBondContact CG2-OG 3.39Å; T538-S541 PolarHBondContact N-O 3.21Å; T538-S541 PolarHBondContact O-N 2.99Å; T538-S541 PolarHBondContact OG1-N 3.49Å; T538-S541 PolarHBondContact OG1-OG 3.02Å; T538-Y1170 CarbonylContact C-O 3.6Å; T538-Y1170 VanDerWaalsContact C-O 3.31Å; T538-T1173 HydrophobicContact CG2-CG2 3.98Å
539	P	85.4	Confident	89.2	Confident	33 Å²	33	36.9 Å²	36.9	21%	0.214	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-20.2	174.4	-31	39.9	0	0	0	114.4	R1168 Y1170 D1171	P539-R1168 VanDerWaalsContact CB-O 3.3Å; P539-R1168 WeakPolarHBondContact CB-O 3.04Å; P539-R1168 WeakPolarHBondContact O-CD 3.17Å; P539-R1168 PolarHBondContact O-NH1 2.95Å; P539-Y1170 WeakPolarHBondContact CD-O 3.49Å; P539-D1171 HydrophobicContact CG-CB 4.3Å
540	H	88.6	Confident	89.4	Confident	124 Å²	124	41.4 Å²	41.4	57%	0.574	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126.8	3	-176.7	-60.1	-68.2	0	0	0	114.7	T538 L555	T538-H540 PolarHBondContact O-N 2.69Å; T538-H540 PolarHBondContact OG1-N 3.21Å; H540-L555 PolarHBondContact O-N 3.44Å
541	S	90.9	Very high	89.6	Confident	16 Å²	16	43 Å²	43	11%	0.112	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	151.3	-179.4	67.6	0	0	0	0	114.9	T538 Y553	T538-S541 WeakPolarHBondContact CG2-OG 3.39Å; T538-S541 PolarHBondContact N-O 3.21Å; T538-S541 PolarHBondContact O-N 2.99Å; T538-S541 PolarHBondContact OG1-N 3.49Å; T538-S541 PolarHBondContact OG1-OG 3.02Å; S541-Y553 CarbonylContact C-O 3.31Å; S541-Y553 WeakPolarHBondContact CA-O 3.39Å; S541-Y553 WeakPolarHBondContact CB-O 3.29Å
542	V	92.3	Very high	89.9	Confident	1 Å²	1	45 Å²	45	1%	0.006	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.7	168.4	179.7	0	0	0	0	107.5	V498 F534 I544 Y553 L555	V498-V542 HydrophobicContact CG2-CG1 4.28Å; F534-V542 HydrophobicContact CD2-CG1 3.89Å; F534-V542 HydrophobicContact CE2-CG1 3.73Å; V542-I544 HydrophobicContact CG1-CG2 4.15Å; V542-Y553 PolarHBondContact N-O 2.96Å; V542-Y553 PolarHBondContact O-N 2.99Å; V542-L555 HydrophobicContact CG2-CD2 4.46Å
543	I	92.9	Very high	90	Very high	22 Å²	22	45.4 Å²	45.4	11%	0.113	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	125.2	179.9	-49.7	-179.5	0	0	0	108.1	T535 A536 E550 T552	T535-I543 PolarHBondContact N-O 2.9Å; T535-I543 WeakPolarHBondContact OG1-CG2 3.34Å; T535-I543 PolarHBondContact OG1-O 3.34Å; A536-I543 HydrophobicContact CB-CB 4.29Å; A536-I543 HydrophobicContact CB-CD1 4.21Å; A536-I543 PolarHBondContact N-O 2.93Å; A536-I543 PolarHBondContact O-N 2.69Å; I543-E550 HydrophobicContact CG2-CG 3.48Å; I543-E550 VanDerWaalsContact CG2-CG 3.48Å; I543-T552 HydrophobicContact CG1-CG2 4.36Å
544	I	94	Very high	90.1	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	146.8	177.1	68.9	173.8	0	0	0	110.2	T494 A497 V498 V533 F534 V542 E550 M551 Y553	T494-I544 HydrophobicContact CG2-CD1 4.11Å; A497-I544 HydrophobicContact CB-CG2 4.06Å; A497-I544 WeakPolarHBondContact O-CG2 3.22Å; V498-I544 HydrophobicContact CG2-CD1 4.25Å; V498-I544 HydrophobicContact CG2-CG2 4.21Å; V533-I544 CarbonylContact O-C 3.53Å; V533-I544 VanDerWaalsContact O-CA 3.23Å; V533-I544 WeakPolarHBondContact O-CA 3.3Å; F534-I544 HydrophobicContact CD2-CG2 4.4Å; V542-I544 HydrophobicContact CG1-CG2 4.15Å; I544-E550 CarbonylContact O-C 3.52Å; I544-E550 WeakPolarHBondContact O-CA 3.47Å; I544-M551 HydrophobicContact CD1-CE 3.94Å; I544-M551 HydrophobicContact CG1-CB 4.1Å; I544-M551 HydrophobicContact CG1-CE 4.31Å; I544-M551 PolarHBondContact N-O 3.02Å; I544-M551 PolarHBondContact O-N 2.99Å; I544-Y553 HydrophobicContact CD1-CD2 4.41Å; I544-Y553 HydrophobicContact CD1-CE2 3.8Å; I544-Y553 HydrophobicContact CG1-CD2 4.41Å; I544-Y553 HydrophobicContact CG1-CE2 4.08Å
545	D	92.1	Very high	90	Very high	50 Å²	50	48.2 Å²	48.2	27%	0.267	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	112.8	161.1	177.6	6.3	0	0	0	108.7	F532 V533 T535 G548 K549	F532-D545 CarbonylContact C-O 3.18Å; F532-D545 WeakPolarHBondContact CA-O 3.39Å; V533-D545 HydrophobicContact CB-CB 4.43Å; V533-D545 PolarHBondContact N-O 3.47Å; V533-D545 PolarHBondContact O-N 2.83Å; T535-D545 HydrophobicContact CG2-CB 3.86Å; D545-G548 VanDerWaalsContact OD1-C 3.31Å; D545-G548 WeakPolarHBondContact OD1-CA 3.39Å; D545-G548 PolarHBondContact OD1-N 2.69Å; D545-K549 PolarHBondContact OD1-N 2.89Å
546	A	88.1	Confident	90.1	Very high	13 Å²	13	49 Å²	49	11%	0.107	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	98.9	173.2	0	0	0	0	0	110	F532 G548 K549 M551	F532-A546 HydrophobicContact CD1-CB 3.74Å; F532-A546 HydrophobicContact CE1-CB 3.74Å; A546-G548 PolarHBondContact O-N 3.25Å; A546-K549 PolarHBondContact N-O 3.27Å; A546-K549 PolarHBondContact O-N 3.15Å; A546-M551 HydrophobicContact CB-CE 3.54Å
547	R	82.8	Confident	90.2	Very high	121 Å²	121	49 Å²	49	46%	0.457	26%	0.256	S	S	.	.	S	Bend	trans	56.7	44.4	177	-50.4	-174	71.2	-157.9	2.2	114.3	E480 G531 F532	E480-R547 VanDerWaalsContact CG-NH2 3.34Å; E480-R547 IonicContact OE1-NH2 3.63Å; E480-R547 PolarHBondContact OE1-NH2 3.09Å; G531-R547 PolarHBondContact O-N 3.49Å; F532-R547 HydrophobicContact CE2-CG 4.31Å
548	G	81.3	Confident	90.2	Very high	65 Å²	65	49.3 Å²	49.3	67%	0.67	26%	0.258	S	S	*	.	S	Bend	trans	84.4	27.7	179.2	0	0	0	0	0	113.6	D545 A546	D545-G548 VanDerWaalsContact OD1-C 3.31Å; D545-G548 WeakPolarHBondContact OD1-CA 3.39Å; D545-G548 PolarHBondContact OD1-N 2.69Å; A546-G548 PolarHBondContact O-N 3.25Å
549	K	88.3	Confident	90.4	Very high	152 Å²	152	48.1 Å²	48.1	66%	0.661	25%	0.25	S	S	*	.			trans	-139.9	111.4	176.3	-69	-176.3	179.9	177.5	0	109.7	D545 A546 M551	D545-K549 PolarHBondContact OD1-N 2.89Å; A546-K549 PolarHBondContact N-O 3.27Å; A546-K549 PolarHBondContact O-N 3.15Å; K549-M551 PolarHBondContact O-N 3.47Å
550	E	91.4	Very high	90.4	Very high	141 Å²	141	48.5 Å²	48.5	66%	0.659	25%	0.249	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-66.3	129.7	171.6	-167.3	170.6	85.4	0	0	110.7	I543 I544	I543-E550 HydrophobicContact CG2-CG 3.48Å; I543-E550 VanDerWaalsContact CG2-CG 3.48Å; I544-E550 CarbonylContact O-C 3.52Å; I544-E550 WeakPolarHBondContact O-CA 3.47Å
551	M	92.1	Very high	90.3	Very high	48 Å²	48	43 Å²	43	24%	0.236	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	122.7	-179.9	-63.7	-161.8	-52.6	0	0	109.7	I544 A546 K549 Y553 P575	I544-M551 HydrophobicContact CD1-CE 3.94Å; I544-M551 HydrophobicContact CG1-CB 4.1Å; I544-M551 HydrophobicContact CG1-CE 4.31Å; I544-M551 PolarHBondContact N-O 3.02Å; I544-M551 PolarHBondContact O-N 2.99Å; A546-M551 HydrophobicContact CB-CE 3.54Å; K549-M551 PolarHBondContact O-N 3.47Å; M551-Y553 HydrophobicContact CB-CE2 3.91Å; M551-Y553 HydrophobicContact CE-CE2 4.09Å; M551-Y553 WeakPolarHBondContact CE-OH 3.38Å; M551-P575 HydrophobicContact CB-CG 3.96Å; M551-P575 HydrophobicContact CG-CG 4.49Å
552	T	93.6	Very high	89.8	Confident	69 Å²	69	43.1 Å²	43.1	42%	0.423	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	120.7	179.3	-59.4	0	0	0	0	110.3	I543	I543-T552 HydrophobicContact CG1-CG2 4.36Å
553	Y	94	Very high	88.8	Confident	15 Å²	15	44.4 Å²	44.4	6%	0.059	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	122	173	-70.5	-103.6	0	0	0	108.7	T494 V498 S541 V542 I544 M551 L555 V572 R573 T574 P575	T494-Y553 HydrophobicContact CG2-CE1 4.13Å; T494-Y553 HydrophobicContact CG2-CE2 4.24Å; T494-Y553 VanDerWaalsContact CG2-OH 3.27Å; T494-Y553 WeakPolarHBondContact CG2-OH 3.49Å; V498-Y553 HydrophobicContact CG1-CG 4.5Å; V498-Y553 HydrophobicContact CG2-CD2 4.07Å; V498-Y553 HydrophobicContact CG2-CE2 4.41Å; V498-Y553 HydrophobicContact CG2-CG 4.18Å; S541-Y553 CarbonylContact C-O 3.31Å; S541-Y553 WeakPolarHBondContact CA-O 3.39Å; S541-Y553 WeakPolarHBondContact CB-O 3.29Å; V542-Y553 PolarHBondContact N-O 2.96Å; V542-Y553 PolarHBondContact O-N 2.99Å; I544-Y553 HydrophobicContact CD1-CD2 4.41Å; I544-Y553 HydrophobicContact CD1-CE2 3.8Å; I544-Y553 HydrophobicContact CG1-CD2 4.41Å; I544-Y553 HydrophobicContact CG1-CE2 4.08Å; M551-Y553 HydrophobicContact CB-CE2 3.91Å; M551-Y553 HydrophobicContact CE-CE2 4.09Å; M551-Y553 WeakPolarHBondContact CE-OH 3.38Å; Y553-L555 PolarHBondContact O-N 2.9Å; Y553-V572 HydrophobicContact CD1-CG2 4.13Å; Y553-R573 WeakPolarHBondContact CA-O 3.32Å; Y553-T574 HydrophobicContact CD1-CG2 4.48Å; Y553-T574 HydrophobicContact CE1-CG2 4.11Å; Y553-P575 HydrophobicContact CD2-CG 4.4Å; Y553-P575 HydrophobicContact CE2-CG 4Å
554	E	93.9	Very high	88.2	Confident	85 Å²	85	49.7 Å²	49.7	40%	0.397	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	123.9	173.5	-171.6	-173.7	-158.7	0	0	108.5	L556 V572 R573	E554-L556 HydrophobicContact CG-CD2 3.92Å; E554-L556 HydrophobicContact CG-CG 4.45Å; E554-V572 CarbonylContact O-C 3.58Å; E554-V572 WeakPolarHBondContact O-CA 3.4Å; E554-V572 WeakPolarHBondContact O-CB 3.37Å; E554-R573 HydrophobicContact CB-CB 3.77Å; E554-R573 PolarHBondContact N-O 3.42Å; E554-R573 PolarHBondContact O-N 3.31Å; E554-R573 VanDerWaalsContact OE2-CB 3.3Å; E554-R573 WeakPolarHBondContact OE2-CB 3.33Å; E554-R573 WeakPolarHBondContact OE2-CD 3.47Å; E554-R573 IonicContact OE2-NE 3.88Å; E554-R573 PolarHBondContact OE2-NE 3Å
555	L	92.3	Very high	87.8	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	111.8	-178.2	-178.3	63.6	0	0	0	110.3	H540 V542 Y553 V558 V570 V572 V1167 R1168	H540-L555 PolarHBondContact O-N 3.44Å; V542-L555 HydrophobicContact CG2-CD2 4.46Å; Y553-L555 PolarHBondContact O-N 2.9Å; L555-V558 HydrophobicContact CD1-CG2 4.08Å; L555-V558 HydrophobicContact CD2-CG2 3.95Å; L555-V558 HydrophobicContact CG-CG2 4.29Å; L555-V570 HydrophobicContact CD1-CB 4.01Å; L555-V570 HydrophobicContact CD1-CG1 4.33Å; L555-V572 HydrophobicContact CD1-CG1 3.87Å; L555-V1167 HydrophobicContact CD2-CG1 3.4Å; L555-R1168 VanDerWaalsContact O-CZ 3.29Å; L555-R1168 PolarHBondContact O-NH1 3.45Å; L555-R1168 PolarHBondContact O-NH2 3.35Å
556	L	91.8	Very high	87.6	Confident	31 Å²	31	50.9 Å²	50.9	16%	0.162	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-49	-170.4	-63.2	174.6	0	0	0	112.4	E554 V571 R573 L579 Y631 R1168	E554-L556 HydrophobicContact CG-CD2 3.92Å; E554-L556 HydrophobicContact CG-CG 4.45Å; L556-V571 HydrophobicContact CB-CB 4.39Å; L556-V571 HydrophobicContact CB-CG1 4.17Å; L556-V571 HydrophobicContact CD1-CG1 4.32Å; L556-V571 PolarHBondContact N-O 2.72Å; L556-R573 HydrophobicContact CD1-CB 4.36Å; L556-L579 HydrophobicContact CD1-CD2 3.25Å; L556-Y631 HydrophobicContact CD1-CE1 4.23Å; L556-R1168 VanDerWaalsContact C-NH2 3.34Å; L556-R1168 PolarHBondContact O-NH2 3.1Å
557	N	91.1	Very high	87.7	Confident	11 Å²	11	50.4 Å²	50.4	6%	0.059	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	150.6	171.6	-73.4	90.1	0	0	0	111.2	L559 V570 V571 Y631 W634 Y638	N557-L559 HydrophobicContact CB-CD2 4.2Å; N557-V570 WeakPolarHBondContact O-CA 3.49Å; N557-V571 HydrophobicContact CB-CB 4.2Å; N557-V571 HydrophobicContact CB-CG2 4.17Å; N557-V571 PolarHBondContact N-O 3.44Å; N557-V571 PolarHBondContact O-N 3.06Å; N557-Y631 PolarHBondContact OD1-OH 2.91Å; N557-W634 HydrophobicContact CB-CH2 4.32Å; N557-W634 HydrophobicContact CB-CZ3 4.39Å; N557-Y638 VanDerWaalsContact ND2-CE1 3.33Å; N557-Y638 WeakPolarHBondContact ND2-CE1 3.4Å
558	V	90.2	Very high	88.2	Confident	8 Å²	8	44.8 Å²	44.8	5%	0.048	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	119.7	166.9	177.7	0	0	0	0	106.7	L555 M568 V570 V1167	L555-V558 HydrophobicContact CD1-CG2 4.08Å; L555-V558 HydrophobicContact CD2-CG2 3.95Å; L555-V558 HydrophobicContact CG-CG2 4.29Å; V558-M568 HydrophobicContact CG1-CE 3.81Å; V558-V570 HydrophobicContact CG1-CG1 4.42Å; V558-V570 HydrophobicContact CG2-CG1 4.23Å; V558-V1167 HydrophobicContact CG2-CG1 4.35Å
559	L	91.5	Very high	88.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	95.7	174.8	-43.3	-171.6	0	0	0	106.6	N557 S569 L581 W634 Y656 L659 E660	N557-L559 HydrophobicContact CB-CD2 4.2Å; L559-S569 PolarHBondContact N-O 3.49Å; L559-S569 PolarHBondContact O-N 2.99Å; L559-L581 HydrophobicContact CD1-CD1 4.33Å; L559-W634 HydrophobicContact CD2-CH2 3.77Å; L559-W634 HydrophobicContact CD2-CZ2 3.96Å; L559-Y656 HydrophobicContact CB-CD1 4.35Å; L559-Y656 HydrophobicContact CB-CD2 4.36Å; L559-Y656 HydrophobicContact CB-CG 4.22Å; L559-Y656 HydrophobicContact CD1-CD1 4.3Å; L559-Y656 HydrophobicContact CD1-CG 4.38Å; L559-Y656 HydrophobicContact CD2-CD1 3.72Å; L559-Y656 HydrophobicContact CD2-CE1 3.79Å; L559-Y656 HydrophobicContact CD2-CG 4.41Å; L559-Y656 HydrophobicContact CG-CD1 4.33Å; L559-L659 HydrophobicContact CD1-CD2 4.31Å; L559-E660 HydrophobicContact CD1-CG 4Å
560	E	86.3	Confident	89.1	Confident	41 Å²	41	34.5 Å²	34.5	19%	0.192	18%	0.176	C	C	.	.			trans	-58.4	156.5	-167.8	-50.6	-166	-176.3	0	0	113.1	R565 S1162 Q1163 S1164	E560-R565 PolarHBondContact O-NH1 2.73Å; E560-S1162 VanDerWaalsContact OE1-CB 3.25Å; E560-S1162 WeakPolarHBondContact OE1-CB 3.35Å; E560-S1162 PolarHBondContact OE1-OG 3.39Å; E560-S1162 WeakPolarHBondContact OE2-CB 3.43Å; E560-Q1163 HydrophobicContact CB-CB 4.16Å; E560-Q1163 VanDerWaalsContact CD-N 3.28Å; E560-Q1163 HydrophobicContact CG-CB 3.91Å; E560-Q1163 PolarHBondContact OE1-N 3.37Å; E560-Q1163 PolarHBondContact OE2-N 2.95Å; E560-S1164 WeakPolarHBondContact OE1-CB 3.4Å; E560-S1164 PolarHBondContact OE1-N 3.01Å; E560-S1164 PolarHBondContact OE1-OG 3.29Å
561	F	85.8	Confident	89.2	Confident	9 Å²	9	27.8 Å²	27.8	4%	0.039	14%	0.144	C	C	.	.			trans	-76.8	141.4	177.6	-180	-93.3	0	0	0	112.8	R567 M568 Y1151 F1153 Q1155 E1157	F561-R567 WeakPolarHBondContact CD2-O 3.25Å; F561-M568 HydrophobicContact CB-CB 4.19Å; F561-M568 HydrophobicContact CB-CG 4.49Å; F561-Y1151 VanDerWaalsContact CE2-OH 3.31Å; F561-Y1151 WeakPolarHBondContact CE2-OH 3.45Å; F561-Y1151 WeakPolarHBondContact CZ-OH 3.21Å; F561-F1153 HydrophobicContact CD1-CD1 4.39Å; F561-F1153 AromaticContact CD2-CD1 3.67Å; F561-F1153 HydrophobicContact CD2-CD1 3.67Å; F561-F1153 AromaticContact CD2-CE1 3.88Å; F561-F1153 HydrophobicContact CD2-CE1 3.88Å; F561-F1153 HydrophobicContact CE1-CD1 4.3Å; F561-F1153 AromaticContact CE2-CD1 3.55Å; F561-F1153 HydrophobicContact CE2-CD1 3.55Å; F561-F1153 HydrophobicContact CE2-CE1 4.25Å; F561-F1153 HydrophobicContact CE2-CG 4.49Å; F561-F1153 HydrophobicContact CG-CD1 4.1Å; F561-F1153 HydrophobicContact CG-CE1 4.11Å; F561-F1153 AromaticContact CZ-CD1 3.9Å; F561-F1153 HydrophobicContact CZ-CD1 3.9Å; F561-Q1155 HydrophobicContact CB-CG 3.98Å; F561-Q1155 HydrophobicContact CD1-CB 3.79Å; F561-Q1155 HydrophobicContact CD1-CG 4Å; F561-Q1155 HydrophobicContact CE1-CB 4.29Å; F561-Q1155 HydrophobicContact CG-CB 4.19Å; F561-Q1155 HydrophobicContact CG-CG 4.17Å; F561-E1157 HydrophobicContact CD1-CG 3.93Å; F561-E1157 HydrophobicContact CE1-CG 4.07Å
562	S	79.6	Confident	89.3	Confident	18 Å²	18	25.5 Å²	25.5	13%	0.126	13%	0.133	C	C	.	.			trans	-140.7	154.2	166.3	74.2	0	0	0	0	111.4	N564 R565 K566 E653	S562-N564 PolarHBondContact O-N 3.08Å; S562-R565 PolarHBondContact O-N 2.88Å; S562-R565 WeakPolarHBondContact OG-CB 3.43Å; S562-R565 PolarHBondContact OG-N 3.3Å; S562-K566 WeakPolarHBondContact O-CA 3.4Å; S562-K566 PolarHBondContact O-N 3.25Å; S562-E653 VanDerWaalsContact CB-OE1 3.31Å; S562-E653 WeakPolarHBondContact CB-OE1 3.43Å; S562-E653 PolarHBondContact OG-OE1 3.46Å
563	S	72.8	Confident	89.3	Confident	29 Å²	29	25.1 Å²	25.1	20%	0.203	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-24.4	172.8	-84.1	0	0	0	0	112.9	K566 K700 E1157	S563-K566 WeakPolarHBondContact O-CG 3.26Å; S563-K700 PolarHBondContact OG-NZ 3.06Å; S563-E1157 WeakPolarHBondContact CA-OE2 3.43Å; S563-E1157 WeakPolarHBondContact CB-OE1 3.49Å; S563-E1157 WeakPolarHBondContact CB-OE2 3.3Å; S563-E1157 VanDerWaalsContact N-CD 3.25Å; S563-E1157 PolarHBondContact N-OE2 3.43Å; S563-E1157 VanDerWaalsContact OG-CD 3.22Å; S563-E1157 PolarHBondContact OG-OE1 2.93Å; S563-E1157 PolarHBondContact OG-OE2 2.88Å; S563-E1157 VanDerWaalsContact OG-OE2 3.09Å
564	N	78.6	Confident	89.2	Confident	133 Å²	133	24.9 Å²	24.9	71%	0.711	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-48.8	174.3	-65.3	-7.7	0	0	0	110.7	S562 E653	S562-N564 PolarHBondContact O-N 3.08Å; N564-E653 PolarHBondContact ND2-OE2 3Å
565	R	86.2	Confident	88.9	Confident	13 Å²	13	24.3 Å²	24.3	5%	0.049	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-19.4	-177.4	-77.2	174.9	50.8	-106.4	3.4	114	E560 S562 R567 V589 E653 E660	E560-R565 PolarHBondContact O-NH1 2.73Å; S562-R565 PolarHBondContact O-N 2.88Å; S562-R565 WeakPolarHBondContact OG-CB 3.43Å; S562-R565 PolarHBondContact OG-N 3.3Å; R565-R567 HydrophobicContact CB-CG 4.23Å; R565-R567 WeakPolarHBondContact O-CG 3.39Å; R565-R567 PolarHBondContact O-N 3.13Å; R565-R567 PolarHBondContact O-NH1 3.38Å; R565-V589 WeakPolarHBondContact O-CG1 3.43Å; R565-E653 WeakPolarHBondContact CD-OE1 3.33Å; R565-E653 HydrophobicContact CG-CB 4.41Å; R565-E653 HydrophobicContact CG-CG 4.36Å; R565-E660 IonicContact CZ-OE2 2.72Å; R565-E660 IonicContact NE-OE2 3.37Å; R565-E660 PolarHBondContact NE-OE2 3.35Å; R565-E660 VanDerWaalsContact NH2-CD 3.26Å; R565-E660 IonicContact NH2-OE1 2.79Å; R565-E660 PolarHBondContact NH2-OE1 3.28Å; R565-E660 IonicContact NH2-OE2 3.75Å; R565-E660 PolarHBondContact NH2-OE2 2.93Å
566	K	87.5	Confident	88.6	Confident	62 Å²	62	28.4 Å²	28.4	27%	0.27	16%	0.157	S	C	.	.			trans	44.8	33.5	-176.5	-58.8	-166.2	175.7	-163.2	0	114.4	S562 S563 G585 A586 V589 E702 Y1151	S562-K566 WeakPolarHBondContact O-CA 3.4Å; S562-K566 PolarHBondContact O-N 3.25Å; S563-K566 WeakPolarHBondContact O-CG 3.26Å; K566-G585 WeakPolarHBondContact O-CA 3.49Å; K566-A586 HydrophobicContact CB-CB 3.92Å; K566-A586 PolarHBondContact O-N 2.92Å; K566-V589 HydrophobicContact CB-CG2 4.19Å; K566-E702 IonicContact NZ-OE1 3.09Å; K566-E702 PolarHBondContact NZ-OE1 2.9Å; K566-Y1151 HydrophobicContact CB-CE1 4.01Å; K566-Y1151 HydrophobicContact CD-CD1 4.28Å; K566-Y1151 HydrophobicContact CD-CE1 3.84Å; K566-Y1151 HydrophobicContact CG-CE1 4.22Å; K566-Y1151 PolarHBondContact O-OH 3.4Å
567	R	91.4	Very high	88.4	Confident	3 Å²	3	28.9 Å²	28.9	1%	0.011	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	162	-179.6	72.1	-169.8	178.2	-101.9	6	111.9	F561 R565 K584 V589 E657 E660	F561-R567 WeakPolarHBondContact CD2-O 3.25Å; R565-R567 HydrophobicContact CB-CG 4.23Å; R565-R567 WeakPolarHBondContact O-CG 3.39Å; R565-R567 PolarHBondContact O-N 3.13Å; R565-R567 PolarHBondContact O-NH1 3.38Å; R567-K584 CarbonylContact C-O 3.55Å; R567-K584 VanDerWaalsContact CA-O 3.24Å; R567-K584 WeakPolarHBondContact CA-O 3.08Å; R567-K584 WeakPolarHBondContact CB-O 3.42Å; R567-V589 HydrophobicContact CB-CG1 4.49Å; R567-V589 HydrophobicContact CG-CG1 4.48Å; R567-E657 IonicContact CZ-OE2 2.85Å; R567-E657 IonicContact NH1-OE2 3.54Å; R567-E657 PolarHBondContact NH1-OE2 3.37Å; R567-E657 IonicContact NH2-OE1 3.15Å; R567-E657 IonicContact NH2-OE2 2.71Å; R567-E657 PolarHBondContact NH2-OE2 2.69Å; R567-E660 IonicContact CZ-OE2 2.69Å; R567-E660 IonicContact NE-OE1 2.69Å; R567-E660 IonicContact NE-OE2 3.47Å; R567-E660 PolarHBondContact NE-OE2 3.38Å; R567-E660 IonicContact NH2-OE2 2.83Å; R567-E660 PolarHBondContact NH2-OE2 3.47Å
568	M	92.1	Very high	88.3	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	142	174.8	-173.1	-153.7	177.2	0	0	108.8	T501 V558 F561 V570 K584	T501-M568 HydrophobicContact CG2-CE 3.62Å; V558-M568 HydrophobicContact CG1-CE 3.81Å; F561-M568 HydrophobicContact CB-CB 4.19Å; F561-M568 HydrophobicContact CB-CG 4.49Å; M568-V570 HydrophobicContact CE-CG1 4.46Å; M568-K584 HydrophobicContact CB-CG 4.36Å; M568-K584 PolarHBondContact N-O 2.94Å; M568-K584 PolarHBondContact O-N 2.79Å; M568-K584 VanDerWaalsContact SD-CE 3.55Å
569	S	94.1	Very high	88.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	156.4	178.4	-50	0	0	0	0	113.1	L559 Y582 C583 E660	L559-S569 PolarHBondContact N-O 3.49Å; L559-S569 PolarHBondContact O-N 2.99Å; S569-Y582 CarbonylContact C-O 3.46Å; S569-Y582 WeakPolarHBondContact CA-O 3.33Å; S569-Y582 VanDerWaalsContact CB-O 3.23Å; S569-Y582 WeakPolarHBondContact CB-O 3.45Å; S569-C583 WeakPolarHBondContact OG-CB 3.37Å; S569-C583 PolarHBondContact OG-SG 3.35Å; S569-E660 WeakPolarHBondContact CB-OE1 3.31Å; S569-E660 PolarHBondContact OG-OE1 3.49Å
570	V	93.9	Very high	88.6	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.8	170	-59.2	0	0	0	0	110.9	V498 C499 L555 N557 V558 M568 V572 L581 Y582	V498-V570 HydrophobicContact CG1-CG2 4.48Å; C499-V570 HydrophobicContact CB-CG2 3.96Å; L555-V570 HydrophobicContact CD1-CB 4.01Å; L555-V570 HydrophobicContact CD1-CG1 4.33Å; N557-V570 WeakPolarHBondContact O-CA 3.49Å; V558-V570 HydrophobicContact CG1-CG1 4.42Å; V558-V570 HydrophobicContact CG2-CG1 4.23Å; M568-V570 HydrophobicContact CE-CG1 4.46Å; V570-V572 HydrophobicContact CG2-CG1 4.14Å; V570-L581 WeakPolarHBondContact O-CA 3.4Å; V570-Y582 HydrophobicContact CG2-CD2 4.05Å; V570-Y582 PolarHBondContact N-O 3.27Å; V570-Y582 PolarHBondContact O-N 3.05Å
571	V	94.3	Very high	89	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.2	169.3	-176	0	0	0	0	107.7	L556 N557 L581 L626 Y631 L659	L556-V571 HydrophobicContact CB-CB 4.39Å; L556-V571 HydrophobicContact CB-CG1 4.17Å; L556-V571 HydrophobicContact CD1-CG1 4.32Å; L556-V571 PolarHBondContact N-O 2.72Å; N557-V571 HydrophobicContact CB-CB 4.2Å; N557-V571 HydrophobicContact CB-CG2 4.17Å; N557-V571 PolarHBondContact N-O 3.44Å; N557-V571 PolarHBondContact O-N 3.06Å; V571-L581 HydrophobicContact CG2-CD1 3.88Å; V571-L626 HydrophobicContact CG1-CD1 4.25Å; V571-Y631 HydrophobicContact CG1-CD2 4.15Å; V571-Y631 HydrophobicContact CG1-CE2 3.86Å; V571-L659 HydrophobicContact CG2-CD2 3.61Å
572	V	94.2	Very high	89.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	150.5	179.8	-64.3	0	0	0	0	112.1	V498 Y553 E554 L555 V570 R580 Y582	V498-V572 HydrophobicContact CG1-CG1 3.97Å; Y553-V572 HydrophobicContact CD1-CG2 4.13Å; E554-V572 CarbonylContact O-C 3.58Å; E554-V572 WeakPolarHBondContact O-CA 3.4Å; E554-V572 WeakPolarHBondContact O-CB 3.37Å; L555-V572 HydrophobicContact CD1-CG1 3.87Å; V570-V572 HydrophobicContact CG2-CG1 4.14Å; V572-R580 HydrophobicContact CG2-CB 4.42Å; V572-R580 PolarHBondContact N-O 3.34Å; V572-R580 PolarHBondContact O-N 2.97Å; V572-Y582 HydrophobicContact CG2-CD2 3.89Å; V572-Y582 HydrophobicContact CG2-CE2 3.63Å
573	R	93.9	Very high	90.2	Very high	60 Å²	60	31.5 Å²	31.5	23%	0.226	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	122.3	158.6	-155.3	176.9	-66.3	-80.3	0.8	108.5	Y553 E554 L556 G577 K578 L579 E628	Y553-R573 WeakPolarHBondContact CA-O 3.32Å; E554-R573 HydrophobicContact CB-CB 3.77Å; E554-R573 PolarHBondContact N-O 3.42Å; E554-R573 PolarHBondContact O-N 3.31Å; E554-R573 VanDerWaalsContact OE2-CB 3.3Å; E554-R573 WeakPolarHBondContact OE2-CB 3.33Å; E554-R573 WeakPolarHBondContact OE2-CD 3.47Å; E554-R573 IonicContact OE2-NE 3.88Å; E554-R573 PolarHBondContact OE2-NE 3Å; L556-R573 HydrophobicContact CD1-CB 4.36Å; R573-G577 WeakPolarHBondContact CD-O 3.32Å; R573-G577 WeakPolarHBondContact CG-O 3.41Å; R573-G577 PolarHBondContact NH1-O 3.35Å; R573-K578 WeakPolarHBondContact CA-O 3.4Å; R573-L579 HydrophobicContact CB-CD2 4.43Å; R573-L579 HydrophobicContact CG-CD2 4.47Å; R573-E628 IonicContact CZ-OE2 3.01Å; R573-E628 VanDerWaalsContact CZ-OE2 3.28Å; R573-E628 IonicContact NH1-OE2 3.83Å; R573-E628 PolarHBondContact NH1-OE2 3.09Å; R573-E628 IonicContact NH2-OE1 3.69Å; R573-E628 PolarHBondContact NH2-OE1 3.24Å; R573-E628 IonicContact NH2-OE2 3.25Å; R573-E628 PolarHBondContact NH2-OE2 2.84Å
574	T	91.1	Very high	91.3	Very high	10 Å²	10	30.3 Å²	30.3	6%	0.061	17%	0.167	C	C	.	.			trans	-70.1	161.2	176.7	64.8	0	0	0	0	111	Y553 S576 G577 K578 R580	Y553-T574 HydrophobicContact CD1-CG2 4.48Å; Y553-T574 HydrophobicContact CE1-CG2 4.11Å; T574-S576 PolarHBondContact O-N 3.38Å; T574-S576 PolarHBondContact OG1-N 3.3Å; T574-S576 PolarHBondContact OG1-OG 3.33Å; T574-G577 PolarHBondContact O-N 3.43Å; T574-K578 PolarHBondContact N-O 2.72Å; T574-K578 PolarHBondContact OG1-N 2.83Å; T574-K578 PolarHBondContact OG1-O 3.38Å; T574-K578 VanDerWaalsContact OG1-O 3.04Å; T574-R580 HydrophobicContact CG2-CB 4.11Å
575	P	88.1	Confident	91.9	Very high	74 Å²	74	24 Å²	24	48%	0.481	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-18.5	169.7	-25.2	31.4	0	0	0	114.6	M551 Y553 G577	M551-P575 HydrophobicContact CB-CG 3.96Å; M551-P575 HydrophobicContact CG-CG 4.49Å; Y553-P575 HydrophobicContact CD2-CG 4.4Å; Y553-P575 HydrophobicContact CE2-CG 4Å; P575-G577 VanDerWaalsContact C-N 3.32Å
576	S	86.4	Confident	92	Very high	91 Å²	91	23.4 Å²	23.4	64%	0.636	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	1.6	175.3	76.3	0	0	0	0	114.6	T574 K578	T574-S576 PolarHBondContact O-N 3.38Å; T574-S576 PolarHBondContact OG1-N 3.3Å; T574-S576 PolarHBondContact OG1-OG 3.33Å; S576-K578 PolarHBondContact O-N 3.04Å
577	G	86.6	Confident	91.9	Very high	41 Å²	41	20.5 Å²	20.5	42%	0.423	12%	0.119	S	C	.	.	S	Bend	trans	82.8	-17.7	-176.8	0	0	0	0	0	115	R573 T574 P575	R573-G577 WeakPolarHBondContact CD-O 3.32Å; R573-G577 WeakPolarHBondContact CG-O 3.41Å; R573-G577 PolarHBondContact NH1-O 3.35Å; T574-G577 PolarHBondContact O-N 3.43Å; P575-G577 VanDerWaalsContact C-N 3.32Å
578	K	90.4	Very high	91.5	Very high	110 Å²	110	23.9 Å²	23.9	48%	0.478	14%	0.137	S	C	.	.			trans	-63.1	139.9	175	-69.6	-178.1	158.6	-155.8	0	112.4	R573 T574 S576 D625	R573-K578 WeakPolarHBondContact CA-O 3.4Å; T574-K578 PolarHBondContact N-O 2.72Å; T574-K578 PolarHBondContact OG1-N 2.83Å; T574-K578 PolarHBondContact OG1-O 3.38Å; T574-K578 VanDerWaalsContact OG1-O 3.04Å; S576-K578 PolarHBondContact O-N 3.04Å; K578-D625 IonicContact NZ-OD2 3.33Å; K578-D625 PolarHBondContact NZ-OD2 3.02Å
579	L	93.4	Very high	91.4	Very high	7 Å²	7	24.5 Å²	24.5	4%	0.037	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	138.4	164.6	-69.4	176.7	0	0	0	111.1	L556 R573 L626 E628 Y631	L556-L579 HydrophobicContact CD1-CD2 3.25Å; R573-L579 HydrophobicContact CB-CD2 4.43Å; R573-L579 HydrophobicContact CG-CD2 4.47Å; L579-L626 HydrophobicContact CB-CB 4.02Å; L579-L626 PolarHBondContact O-N 3.24Å; L579-L626 VanDerWaalsContact O-N 3.09Å; L579-E628 HydrophobicContact CD1-CB 4.25Å; L579-E628 WeakPolarHBondContact CD1-OE2 3.38Å; L579-Y631 HydrophobicContact CD1-CD1 3.66Å; L579-Y631 HydrophobicContact CD1-CG 3.89Å; L579-Y631 HydrophobicContact CD2-CD1 4.47Å
580	R	94.1	Very high	91.3	Very high	25 Å²	25	24.5 Å²	24.5	9%	0.094	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	135.3	176.5	-176.4	163.5	-70	167.9	-8	110.8	E491 V572 T574 Y582 Y623 V624 D625	E491-R580 IonicContact OE1-CZ 1.85Å; E491-R580 IonicContact OE1-NH1 3.9Å; E491-R580 PolarHBondContact OE1-NH1 3.34Å; E491-R580 IonicContact OE2-CZ 2.6Å; E491-R580 IonicContact OE2-NH1 2.74Å; E491-R580 PolarHBondContact OE2-NH1 3.48Å; V572-R580 HydrophobicContact CG2-CB 4.42Å; V572-R580 PolarHBondContact N-O 3.34Å; V572-R580 PolarHBondContact O-N 2.97Å; T574-R580 HydrophobicContact CG2-CB 4.11Å; R580-Y582 VanDerWaalsContact CD-CE1 3.4Å; R580-Y582 HydrophobicContact CG-CD1 4.2Å; R580-Y582 HydrophobicContact CG-CE1 3.95Å; R580-Y623 HydrophobicContact CG-CD2 4.07Å; R580-V624 WeakPolarHBondContact CA-O 2.85Å; R580-D625 IonicContact CZ-OD1 3.92Å; R580-D625 IonicContact NE-OD1 3.47Å; R580-D625 PolarHBondContact NE-OD1 3.31Å; R580-D625 IonicContact NH2-OD1 2.75Å; R580-D625 PolarHBondContact NH2-OD1 2.95Å; R580-D625 IonicContact NH2-OD2 3.76Å; R580-D625 PolarHBondContact NH2-OD2 2.72Å
581	L	94.9	Very high	91.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.7	165.6	174.1	68.7	0	0	0	108.3	L559 V570 V571 Y623 V624 L626 L659 E660 L663	L559-L581 HydrophobicContact CD1-CD1 4.33Å; V570-L581 WeakPolarHBondContact O-CA 3.4Å; V571-L581 HydrophobicContact CG2-CD1 3.88Å; L581-Y623 CarbonylContact O-C 3.53Å; L581-Y623 WeakPolarHBondContact O-CA 3.33Å; L581-Y623 WeakPolarHBondContact O-CB 3.36Å; L581-V624 HydrophobicContact CB-CG1 3.85Å; L581-V624 HydrophobicContact CD2-CG1 3.96Å; L581-V624 HydrophobicContact CG-CG1 4.38Å; L581-V624 PolarHBondContact N-O 3.48Å; L581-V624 PolarHBondContact O-N 2.93Å; L581-L626 HydrophobicContact CB-CD1 4.01Å; L581-L626 HydrophobicContact CB-CG 4.26Å; L581-L659 HydrophobicContact CD1-CD2 4.23Å; L581-L659 HydrophobicContact CD2-CD2 4.29Å; L581-L659 HydrophobicContact CD2-CG 4.16Å; L581-L659 WeakPolarHBondContact CD2-O 3.2Å; L581-E660 HydrophobicContact CD2-CG 4.2Å; L581-L663 HydrophobicContact CD2-CD2 4.22Å
582	Y	95.8	Very high	90.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.9	166.1	-66.1	-57	0	0	0	108.9	E491 M495 V498 S569 V570 V572 R580	E491-Y582 WeakPolarHBondContact OE1-CE1 3.41Å; E491-Y582 PolarHBondContact OE1-OH 3.41Å; M495-Y582 HydrophobicContact CB-CD1 3.93Å; M495-Y582 HydrophobicContact CB-CE1 4.05Å; M495-Y582 HydrophobicContact CB-CG 4.37Å; M495-Y582 HydrophobicContact CG-CD1 3.65Å; M495-Y582 HydrophobicContact CG-CE1 4.29Å; M495-Y582 HydrophobicContact CG-CG 3.8Å; M495-Y582 HydrophobicContact SD-CD1 3.66Å; M495-Y582 HydrophobicContact SD-CG 4.15Å; V498-Y582 HydrophobicContact CB-CE2 4.36Å; V498-Y582 HydrophobicContact CG1-CD2 4.2Å; V498-Y582 HydrophobicContact CG1-CE2 4.04Å; S569-Y582 CarbonylContact C-O 3.46Å; S569-Y582 WeakPolarHBondContact CA-O 3.33Å; S569-Y582 VanDerWaalsContact CB-O 3.23Å; S569-Y582 WeakPolarHBondContact CB-O 3.45Å; V570-Y582 HydrophobicContact CG2-CD2 4.05Å; V570-Y582 PolarHBondContact N-O 3.27Å; V570-Y582 PolarHBondContact O-N 3.05Å; V572-Y582 HydrophobicContact CG2-CD2 3.89Å; V572-Y582 HydrophobicContact CG2-CE2 3.63Å; R580-Y582 VanDerWaalsContact CD-CE1 3.4Å; R580-Y582 HydrophobicContact CG-CD1 4.2Å; R580-Y582 HydrophobicContact CG-CE1 3.95Å
583	C	95.1	Very high	90.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	119.7	-177.1	178.3	0	0	0	0	110.7	M495 S569 I590 A622 L663	M495-C583 VanDerWaalsContact CE-C 3.47Å; M495-C583 VanDerWaalsContact CE-O 3.24Å; M495-C583 WeakPolarHBondContact CE-O 3.39Å; S569-C583 WeakPolarHBondContact OG-CB 3.37Å; S569-C583 PolarHBondContact OG-SG 3.35Å; C583-I590 WeakPolarHBondContact SG-CD1 3.41Å; C583-A622 PolarHBondContact N-O 3.11Å; C583-A622 PolarHBondContact O-N 2.78Å; C583-A622 VanDerWaalsContact O-O 3.07Å; C583-L663 HydrophobicContact CB-CD1 3.98Å; C583-L663 HydrophobicContact CB-CD2 4.47Å
584	K	94.3	Very high	90.7	Very high	4 Å²	4	31.9 Å²	31.9	2%	0.017	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	142.9	177.1	68.9	-178.3	-176.2	-175.8	0	110.8	M495 C499 E520 R567 M568 C620 F621	M495-K584 HydrophobicContact CE-CB 4.04Å; C499-K584 WeakPolarHBondContact O-CE 3.46Å; C499-K584 PolarHBondContact O-NZ 3.33Å; E520-K584 IonicContact OE1-NZ 2.66Å; E520-K584 PolarHBondContact OE1-NZ 3.15Å; R567-K584 CarbonylContact C-O 3.55Å; R567-K584 VanDerWaalsContact CA-O 3.24Å; R567-K584 WeakPolarHBondContact CA-O 3.08Å; R567-K584 WeakPolarHBondContact CB-O 3.42Å; M568-K584 HydrophobicContact CB-CG 4.36Å; M568-K584 PolarHBondContact N-O 2.94Å; M568-K584 PolarHBondContact O-N 2.79Å; M568-K584 VanDerWaalsContact SD-CE 3.55Å; K584-C620 VanDerWaalsContact CA-O 3.27Å; K584-C620 WeakPolarHBondContact CA-O 3.38Å; K584-F621 HydrophobicContact CB-CD1 4.47Å; K584-F621 HydrophobicContact CB-CE1 4.38Å; K584-F621 HydrophobicContact CB-CZ 4.39Å; K584-F621 HydrophobicContact CD-CZ 4.46Å
585	G	91.9	Very high	90.7	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.8	-162.4	179.9	0	0	0	0	0	114.9	K566 C620	K566-G585 WeakPolarHBondContact O-CA 3.49Å; G585-C620 PolarHBondContact N-O 2.8Å; G585-C620 VanDerWaalsContact N-O 3.07Å; G585-C620 PolarHBondContact O-N 2.68Å
586	A	88.2	Confident	90.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.21	C	C	.	.			trans	-60	141.2	177.6	0	0	0	0	0	112.2	K566 N588 V589 I590 Y1151	K566-A586 HydrophobicContact CB-CB 3.92Å; K566-A586 PolarHBondContact O-N 2.92Å; A586-N588 WeakPolarHBondContact CB-OD1 3.37Å; A586-V589 HydrophobicContact CB-CB 4.22Å; A586-V589 HydrophobicContact CB-CG2 4.16Å; A586-V589 PolarHBondContact O-N 3.35Å; A586-I590 WeakPolarHBondContact O-CB 3.49Å; A586-I590 VanDerWaalsContact O-CG1 3.28Å; A586-I590 WeakPolarHBondContact O-CG1 3.3Å; A586-I590 PolarHBondContact O-N 3.03Å; A586-Y1151 HydrophobicContact CB-CD1 3.67Å; A586-Y1151 HydrophobicContact CB-CD2 3.62Å; A586-Y1151 HydrophobicContact CB-CE1 3.89Å; A586-Y1151 HydrophobicContact CB-CE2 3.82Å; A586-Y1151 HydrophobicContact CB-CG 3.51Å
587	D	85.4	Confident	89.9	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-55.9	-51.4	178.2	40	27	0	0	0	112	V589 I590 F591 L608 T618 H1149	D587-V589 VanDerWaalsContact C-N 3.35Å; D587-V589 PolarHBondContact O-N 3.29Å; D587-I590 PolarHBondContact O-N 3.49Å; D587-F591 HydrophobicContact CB-CD2 4.04Å; D587-F591 HydrophobicContact CB-CE2 3.71Å; D587-F591 VanDerWaalsContact O-CB 3.25Å; D587-F591 WeakPolarHBondContact O-CB 3.31Å; D587-F591 WeakPolarHBondContact O-CD2 3.44Å; D587-F591 WeakPolarHBondContact O-CG 3.31Å; D587-F591 PolarHBondContact O-N 3.37Å; D587-L608 HydrophobicContact CB-CD1 3.76Å; D587-T618 PolarHBondContact OD2-OG1 2.75Å; D587-H1149 WeakPolarHBondContact OD1-CB 3.32Å; D587-H1149 IonicContact OD1-CG 2.63Å; D587-H1149 WeakPolarHBondContact OD2-CB 3.28Å; D587-H1149 IonicContact OD2-CG 3.17Å; D587-H1149 IonicContact OD2-ND1 2.77Å
588	N	83.3	Confident	89.6	Confident	74 Å²	74	36.9 Å²	36.9	40%	0.396	19%	0.187	S	C	.	.	H	α-helix	trans	-56.6	-45.4	177	73.5	-38.3	0	0	0	112.8	A586 E592	A586-N588 WeakPolarHBondContact CB-OD1 3.37Å; N588-E592 WeakPolarHBondContact O-CG 3.34Å; N588-E592 PolarHBondContact O-N 3.1Å
589	V	90.1	Very high	88.8	Confident	15 Å²	15	39.3 Å²	39.3	9%	0.091	20%	0.2	C	C	.	.	H	α-helix	trans	-67.6	-41.3	179.7	173.4	0	0	0	0	112.2	R565 K566 R567 A586 D587 R593	R565-V589 WeakPolarHBondContact O-CG1 3.43Å; K566-V589 HydrophobicContact CB-CG2 4.19Å; R567-V589 HydrophobicContact CB-CG1 4.49Å; R567-V589 HydrophobicContact CG-CG1 4.48Å; A586-V589 HydrophobicContact CB-CB 4.22Å; A586-V589 HydrophobicContact CB-CG2 4.16Å; A586-V589 PolarHBondContact O-N 3.35Å; D587-V589 VanDerWaalsContact C-N 3.35Å; D587-V589 PolarHBondContact O-N 3.29Å; V589-R593 WeakPolarHBondContact O-CD 3.23Å; V589-R593 PolarHBondContact O-NH1 3.19Å
590	I	91.5	Very high	88.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-71.1	-40.5	178.5	-64.1	-65.8	0	0	0	110.3	C583 A586 D587 E592 R593 L594 C620 A622 L663	C583-I590 WeakPolarHBondContact SG-CD1 3.41Å; A586-I590 WeakPolarHBondContact O-CB 3.49Å; A586-I590 VanDerWaalsContact O-CG1 3.28Å; A586-I590 WeakPolarHBondContact O-CG1 3.3Å; A586-I590 PolarHBondContact O-N 3.03Å; D587-I590 PolarHBondContact O-N 3.49Å; I590-E592 VanDerWaalsContact C-N 3.3Å; I590-E592 PolarHBondContact O-N 3.17Å; I590-R593 PolarHBondContact O-N 3.47Å; I590-L594 HydrophobicContact CG2-CD2 4.05Å; I590-L594 WeakPolarHBondContact O-CG 3.15Å; I590-L594 PolarHBondContact O-N 3.15Å; I590-C620 HydrophobicContact CB-CB 3.92Å; I590-C620 HydrophobicContact CG1-CB 3.94Å; I590-C620 HydrophobicContact CG2-CB 4Å; I590-A622 HydrophobicContact CG2-CB 3.92Å; I590-L663 HydrophobicContact CD1-CD1 4.46Å
591	F	89.9	Confident	88.1	Confident	19 Å²	19	43.9 Å²	43.9	8%	0.083	22%	0.219	C	C	.	.	H	α-helix	trans	-67.5	-23.2	-177.9	-71.1	-38.1	0	0	0	114.9	D587 R593 L594 K601 T604 I605 L608 L665	D587-F591 HydrophobicContact CB-CD2 4.04Å; D587-F591 HydrophobicContact CB-CE2 3.71Å; D587-F591 VanDerWaalsContact O-CB 3.25Å; D587-F591 WeakPolarHBondContact O-CB 3.31Å; D587-F591 WeakPolarHBondContact O-CD2 3.44Å; D587-F591 WeakPolarHBondContact O-CG 3.31Å; D587-F591 PolarHBondContact O-N 3.37Å; F591-R593 VanDerWaalsContact C-N 3.32Å; F591-L594 HydrophobicContact CD1-CD1 3.7Å; F591-L594 HydrophobicContact CE1-CD1 4.26Å; F591-K601 HydrophobicContact CD1-CD 4.48Å; F591-K601 HydrophobicContact CD1-CG 4.12Å; F591-K601 HydrophobicContact CE1-CG 4.23Å; F591-K601 PolarHBondContact O-NZ 3.39Å; F591-T604 HydrophobicContact CZ-CG2 4.23Å; F591-I605 HydrophobicContact CD2-CD1 4.44Å; F591-I605 HydrophobicContact CD2-CG1 4.09Å; F591-I605 HydrophobicContact CE1-CG1 4.32Å; F591-I605 HydrophobicContact CE2-CD1 4.24Å; F591-I605 HydrophobicContact CE2-CG1 3.43Å; F591-I605 VanDerWaalsContact CE2-CG1 3.43Å; F591-I605 HydrophobicContact CZ-CD1 4.45Å; F591-I605 HydrophobicContact CZ-CG1 3.57Å; F591-L608 HydrophobicContact CE2-CD1 3.61Å; F591-L608 HydrophobicContact CZ-CD1 3.51Å; F591-L665 HydrophobicContact CE1-CD1 4.38Å; F591-L665 HydrophobicContact CE1-CD2 3.99Å
592	E	90.7	Very high	87.7	Confident	137 Å²	137	50 Å²	50	64%	0.64	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-25.8	167.8	-74.6	170.8	175.5	0	0	113.2	N588 I590	N588-E592 WeakPolarHBondContact O-CG 3.34Å; N588-E592 PolarHBondContact O-N 3.1Å; I590-E592 VanDerWaalsContact C-N 3.3Å; I590-E592 PolarHBondContact O-N 3.17Å
593	R	92.2	Very high	87.4	Confident	37 Å²	37	54.3 Å²	54.3	14%	0.14	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	0.3	-169.4	-70.8	163.4	-177.1	71.2	6.9	113.7	V589 I590 F591 E657 E660 N662 L663	V589-R593 WeakPolarHBondContact O-CD 3.23Å; V589-R593 PolarHBondContact O-NH1 3.19Å; I590-R593 PolarHBondContact O-N 3.47Å; F591-R593 VanDerWaalsContact C-N 3.32Å; R593-E657 IonicContact CZ-OE1 2.83Å; R593-E657 IonicContact CZ-OE2 3.58Å; R593-E657 IonicContact NE-OE1 3.67Å; R593-E657 PolarHBondContact NE-OE1 3.35Å; R593-E657 IonicContact NE-OE2 3.25Å; R593-E657 PolarHBondContact NE-OE2 3.11Å; R593-E657 VanDerWaalsContact NH2-CD 3.29Å; R593-E657 IonicContact NH2-OE1 2.75Å; R593-E657 PolarHBondContact NH2-OE1 2.87Å; R593-E657 VanDerWaalsContact NH2-OE1 3.13Å; R593-E657 IonicContact NH2-OE2 2.69Å; R593-E657 PolarHBondContact NH2-OE2 3.28Å; R593-E660 WeakPolarHBondContact CD-O 3.32Å; R593-E660 WeakPolarHBondContact CG-O 3.3Å; R593-N662 PolarHBondContact O-N 2.91Å; R593-N662 VanDerWaalsContact O-N 3.13Å; R593-L663 HydrophobicContact CB-CD1 3.99Å; R593-L663 HydrophobicContact CB-CG 4.42Å; R593-L663 PolarHBondContact O-N 2.72Å
594	L	92	Very high	87.2	Confident	23 Å²	23	54.3 Å²	54.3	12%	0.12	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-73.9	146.3	175.8	-65.1	-174.3	0	0	0	112.6	I590 F591 K601 A622 L663 L665	I590-L594 HydrophobicContact CG2-CD2 4.05Å; I590-L594 WeakPolarHBondContact O-CG 3.15Å; I590-L594 PolarHBondContact O-N 3.15Å; F591-L594 HydrophobicContact CD1-CD1 3.7Å; F591-L594 HydrophobicContact CE1-CD1 4.26Å; L594-K601 HydrophobicContact CD1-CD 4.27Å; L594-K601 HydrophobicContact CD1-CG 4.44Å; L594-A622 HydrophobicContact CD2-CB 4.08Å; L594-L663 CarbonylContact C-O 3.57Å; L594-L663 VanDerWaalsContact CA-O 3.25Å; L594-L663 WeakPolarHBondContact CA-O 3.27Å; L594-L663 HydrophobicContact CD2-CB 4.07Å; L594-L663 WeakPolarHBondContact CD2-O 3.21Å; L594-L665 HydrophobicContact CD1-CB 3.88Å; L594-L665 HydrophobicContact CD1-CD1 4.46Å; L594-L665 HydrophobicContact CD1-CD2 4.18Å; L594-L665 HydrophobicContact CD1-CG 4.41Å; L594-L665 HydrophobicContact CD2-CB 3.91Å
595	T	90.9	Very high	86.9	Confident	45 Å²	45	56.1 Å²	56.1	28%	0.276	28%	0.284	S	S	.	.			trans	-70.2	145.5	165.9	-53	0	0	0	0	110.8	A597 S598 N662 L663	T595-A597 HydrophobicContact CG2-CB 4.05Å; T595-A597 PolarHBondContact O-N 3.14Å; T595-S598 WeakPolarHBondContact O-CB 3.33Å; T595-S598 PolarHBondContact O-N 2.98Å; T595-N662 WeakPolarHBondContact OG1-CA 3.44Å; T595-N662 WeakPolarHBondContact OG1-CB 3.5Å; T595-N662 PolarHBondContact OG1-O 3.39Å; T595-L663 PolarHBondContact N-O 3.04Å
596	E	81.3	Confident	86.7	Confident	204 Å²	204	58.6 Å²	58.6	95%	0.953	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-23.8	174.9	-61.3	-175.3	160	0	0	113.7	S598	E596-S598 PolarHBondContact O-N 2.94Å
597	A	76.5	Confident	86.8	Confident	61 Å²	61	60 Å²	60	50%	0.504	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	1.3	175.6	0	0	0	0	0	114.9	T595 Q599	T595-A597 HydrophobicContact CG2-CB 4.05Å; T595-A597 PolarHBondContact O-N 3.14Å; A597-Q599 PolarHBondContact O-N 3.26Å; A597-Q599 VanDerWaalsContact O-N 3.08Å
598	S	79.1	Confident	86.9	Confident	12 Å²	12	59.9 Å²	59.9	8%	0.084	31%	0.31	C	S	.	.			trans	-77.3	90.5	-175.7	178.6	0	0	0	0	113.2	T595 E596 Y600 K601 L665	T595-S598 WeakPolarHBondContact O-CB 3.33Å; T595-S598 PolarHBondContact O-N 2.98Å; E596-S598 PolarHBondContact O-N 2.94Å; S598-Y600 PolarHBondContact O-N 3.29Å; S598-K601 PolarHBondContact O-N 3.21Å; S598-L665 VanDerWaalsContact OG-CB 3.31Å; S598-L665 WeakPolarHBondContact OG-CB 3.31Å
599	Q	74.8	Confident	86.8	Confident	161 Å²	161	60.7 Å²	60.7	75%	0.752	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-11.5	-167.7	-59.3	-179.1	-0.1	0	0	117.6	A597	A597-Q599 PolarHBondContact O-N 3.26Å; A597-Q599 VanDerWaalsContact O-N 3.08Å
600	Y	85.7	Confident	86.5	Confident	56 Å²	56	63.9 Å²	63.9	22%	0.22	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	15.1	-171.9	-53.7	-64.6	0	0	0	114.8	A438 S598 T604	A438-Y600 HydrophobicContact CB-CD2 4.2Å; A438-Y600 HydrophobicContact CB-CE2 3.78Å; A438-Y600 WeakPolarHBondContact O-CD1 3.48Å; A438-Y600 VanDerWaalsContact O-CE1 3.28Å; A438-Y600 WeakPolarHBondContact O-CE1 3.25Å; S598-Y600 PolarHBondContact O-N 3.29Å; Y600-T604 WeakPolarHBondContact O-CB 3.27Å; Y600-T604 PolarHBondContact O-N 3.36Å; Y600-T604 VanDerWaalsContact O-N 3.1Å; Y600-T604 PolarHBondContact O-OG1 2.95Å
601	K	86.4	Confident	86.2	Confident	72 Å²	72	64 Å²	64	31%	0.313	33%	0.326	S	S	.	.	H	α-helix	trans	-58.3	-56.9	-173	-176	168.7	177.4	167.3	0	112.5	F591 L594 S598 L603 T604 I605	F591-K601 HydrophobicContact CD1-CD 4.48Å; F591-K601 HydrophobicContact CD1-CG 4.12Å; F591-K601 HydrophobicContact CE1-CG 4.23Å; F591-K601 PolarHBondContact O-NZ 3.39Å; L594-K601 HydrophobicContact CD1-CD 4.27Å; L594-K601 HydrophobicContact CD1-CG 4.44Å; S598-K601 PolarHBondContact O-N 3.21Å; K601-L603 PolarHBondContact O-N 3.31Å; K601-T604 WeakPolarHBondContact O-CB 3.45Å; K601-T604 PolarHBondContact O-N 2.98Å; K601-T604 VanDerWaalsContact O-N 3.13Å; K601-I605 HydrophobicContact CG-CD1 3.99Å; K601-I605 WeakPolarHBondContact O-CG1 3.38Å; K601-I605 PolarHBondContact O-N 3.35Å
602	D	86.9	Confident	85.6	Confident	128 Å²	128	63.6 Å²	63.6	68%	0.684	33%	0.327	S	S	*	.	H	α-helix	trans	-69.4	-38.6	-170.5	-50.3	-34.8	0	0	0	112.9	T604 I605 A606	D602-T604 VanDerWaalsContact C-N 3.32Å; D602-T604 PolarHBondContact O-N 2.88Å; D602-I605 PolarHBondContact O-N 3.29Å; D602-A606 PolarHBondContact O-N 3.22Å; D602-A606 VanDerWaalsContact O-N 3.1Å
603	L	89.3	Confident	84.8	Confident	91 Å²	91	61.3 Å²	61.3	48%	0.476	32%	0.322	S	S	.	.	H	α-helix	trans	-60.1	-42.7	171.2	-71.2	170	0	0	0	111.4	K601 I605 A606 H607	K601-L603 PolarHBondContact O-N 3.31Å; L603-I605 VanDerWaalsContact C-N 3.34Å; L603-I605 PolarHBondContact O-N 3.09Å; L603-A606 PolarHBondContact O-N 2.95Å; L603-H607 PolarHBondContact O-CD2 3.26Å; L603-H607 PolarHBondContact O-N 3.1Å; L603-H607 PolarHBondContact O-ND1 3.41Å
604	T	90.1	Very high	84	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-66.3	-37	178.5	-55.3	0	0	0	0	111.4	T436 F591 Y600 K601 D602 H607 L608 L665 A668	T436-T604 HydrophobicContact CG2-CG2 3.89Å; F591-T604 HydrophobicContact CZ-CG2 4.23Å; Y600-T604 WeakPolarHBondContact O-CB 3.27Å; Y600-T604 PolarHBondContact O-N 3.36Å; Y600-T604 VanDerWaalsContact O-N 3.1Å; Y600-T604 PolarHBondContact O-OG1 2.95Å; K601-T604 WeakPolarHBondContact O-CB 3.45Å; K601-T604 PolarHBondContact O-N 2.98Å; K601-T604 VanDerWaalsContact O-N 3.13Å; D602-T604 VanDerWaalsContact C-N 3.32Å; D602-T604 PolarHBondContact O-N 2.88Å; T604-H607 PolarHBondContact O-N 3.04Å; T604-L608 HydrophobicContact CG2-CD1 3.98Å; T604-L608 HydrophobicContact CG2-CG 4.34Å; T604-L608 WeakPolarHBondContact O-CB 2.92Å; T604-L608 WeakPolarHBondContact O-CD1 3.45Å; T604-L608 WeakPolarHBondContact O-CG 3.48Å; T604-L608 PolarHBondContact O-N 2.99Å; T604-L665 HydrophobicContact CG2-CD2 4.1Å; T604-A668 HydrophobicContact CG2-CB 4.15Å
605	I	88.3	Confident	83.2	Confident	41 Å²	41	62.4 Å²	62.4	21%	0.21	33%	0.331	C	S	.	.	H	α-helix	trans	-60.2	-49	173.7	-67.9	165.1	0	0	0	110.8	F591 K601 D602 L603 H607 L608 E609	F591-I605 HydrophobicContact CD2-CD1 4.44Å; F591-I605 HydrophobicContact CD2-CG1 4.09Å; F591-I605 HydrophobicContact CE1-CG1 4.32Å; F591-I605 HydrophobicContact CE2-CD1 4.24Å; F591-I605 HydrophobicContact CE2-CG1 3.43Å; F591-I605 VanDerWaalsContact CE2-CG1 3.43Å; F591-I605 HydrophobicContact CZ-CD1 4.45Å; F591-I605 HydrophobicContact CZ-CG1 3.57Å; K601-I605 HydrophobicContact CG-CD1 3.99Å; K601-I605 WeakPolarHBondContact O-CG1 3.38Å; K601-I605 PolarHBondContact O-N 3.35Å; D602-I605 PolarHBondContact O-N 3.29Å; L603-I605 VanDerWaalsContact C-N 3.34Å; L603-I605 PolarHBondContact O-N 3.09Å; I605-H607 VanDerWaalsContact C-N 3.31Å; I605-H607 PolarHBondContact O-N 3.47Å; I605-L608 WeakPolarHBondContact O-CB 3.33Å; I605-L608 PolarHBondContact O-N 3.03Å; I605-L608 VanDerWaalsContact O-N 3.15Å; I605-E609 PolarHBondContact O-N 3.37Å
606	A	87.8	Confident	82.8	Confident	53 Å²	53	60.8 Å²	60.8	44%	0.438	32%	0.32	S	S	.	.	H	α-helix	trans	-60.6	-38.9	178.2	0	0	0	0	0	112.8	D602 L603 Q610	D602-A606 PolarHBondContact O-N 3.22Å; D602-A606 VanDerWaalsContact O-N 3.1Å; L603-A606 PolarHBondContact O-N 2.95Å; A606-Q610 PolarHBondContact O-N 3.48Å; A606-Q610 VanDerWaalsContact O-N 3.11Å
607	H	90.2	Very high	83	Confident	29 Å²	29	51.4 Å²	51.4	13%	0.134	28%	0.276	C	S	.	.	H	α-helix	trans	-69.5	-35.9	175.8	-58.4	158.5	0	0	0	112.5	T436 G439 T441 L603 T604 I605 Q610 F611	T436-H607 HydrophobicContact CG2-CB 4.01Å; T436-H607 PolarHBondContact OG1-ND1 2.94Å; G439-H607 PolarHBondContact O-CE1 2.84Å; T441-H607 HydrophobicContact CG2-CB 4.03Å; L603-H607 PolarHBondContact O-CD2 3.26Å; L603-H607 PolarHBondContact O-N 3.1Å; L603-H607 PolarHBondContact O-ND1 3.41Å; T604-H607 PolarHBondContact O-N 3.04Å; I605-H607 VanDerWaalsContact C-N 3.31Å; I605-H607 PolarHBondContact O-N 3.47Å; H607-Q610 PolarHBondContact O-N 3.36Å; H607-F611 HydrophobicContact CB-CE2 4.42Å; H607-F611 HydrophobicContact CB-CZ 4.41Å; H607-F611 WeakPolarHBondContact O-CD1 3.42Å; H607-F611 WeakPolarHBondContact O-CD2 3.46Å; H607-F611 WeakPolarHBondContact O-CG 3.37Å; H607-F611 PolarHBondContact O-N 3.44Å
608	L	87.1	Confident	83.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.9	-41.1	174.5	-73.8	162.8	0	0	0	112.1	D587 F591 T604 I605 F611 A612 T618 A668	D587-L608 HydrophobicContact CB-CD1 3.76Å; F591-L608 HydrophobicContact CE2-CD1 3.61Å; F591-L608 HydrophobicContact CZ-CD1 3.51Å; T604-L608 HydrophobicContact CG2-CD1 3.98Å; T604-L608 HydrophobicContact CG2-CG 4.34Å; T604-L608 WeakPolarHBondContact O-CB 2.92Å; T604-L608 WeakPolarHBondContact O-CD1 3.45Å; T604-L608 WeakPolarHBondContact O-CG 3.48Å; T604-L608 PolarHBondContact O-N 2.99Å; I605-L608 WeakPolarHBondContact O-CB 3.33Å; I605-L608 PolarHBondContact O-N 3.03Å; I605-L608 VanDerWaalsContact O-N 3.15Å; L608-F611 PolarHBondContact O-N 3.38Å; L608-A612 WeakPolarHBondContact O-CB 3.43Å; L608-A612 PolarHBondContact O-N 3.34Å; L608-T618 VanDerWaalsContact CD2-CB 3.46Å; L608-T618 HydrophobicContact CD2-CG2 3.61Å; L608-A668 HydrophobicContact CD2-CB 3.76Å; L608-A668 HydrophobicContact CG-CB 4.35Å
609	E	83	Confident	84.2	Confident	90 Å²	90	48 Å²	48	42%	0.421	25%	0.249	S	C	.	.	H	α-helix	trans	-60.7	-44.5	173.7	-75.1	176.7	-179	0	0	111	I605 A612 T613 S1148	I605-E609 PolarHBondContact O-N 3.37Å; E609-A612 PolarHBondContact O-N 3.03Å; E609-T613 PolarHBondContact O-N 3.46Å; E609-T613 PolarHBondContact O-OG1 3.15Å; E609-S1148 WeakPolarHBondContact CG-O 3.29Å
610	Q	83.4	Confident	85.1	Confident	82 Å²	82	40.4 Å²	40.4	38%	0.383	21%	0.213	S	C	.	.	H	α-helix	trans	-58.6	-52.5	173	-179.1	-177.7	-13.7	0	0	111.5	A606 H607 A612 T613 E614	A606-Q610 PolarHBondContact O-N 3.48Å; A606-Q610 VanDerWaalsContact O-N 3.11Å; H607-Q610 PolarHBondContact O-N 3.36Å; Q610-A612 PolarHBondContact O-N 3.35Å; Q610-T613 PolarHBondContact O-N 3.05Å; Q610-T613 PolarHBondContact O-OG1 3.35Å; Q610-E614 PolarHBondContact NE2-OE1 2.85Å; Q610-E614 PolarHBondContact O-N 2.82Å
611	F	85.6	Confident	85.6	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.009	20%	0.203	C	C	.	.	H	α-helix	trans	-59.8	-35.2	-179.6	-61.3	-19.9	0	0	0	112.3	K434 T436 T441 H607 L608 E614 G615 L616 T618 A670	K434-F611 HydrophobicContact CB-CD1 4.35Å; K434-F611 HydrophobicContact CB-CE1 3.79Å; K434-F611 HydrophobicContact CB-CZ 3.86Å; K434-F611 HydrophobicContact CD-CD1 3.99Å; K434-F611 HydrophobicContact CD-CE1 3.65Å; K434-F611 HydrophobicContact CG-CE1 4.34Å; T436-F611 HydrophobicContact CG2-CE2 4.02Å; T441-F611 HydrophobicContact CG2-CE1 4.44Å; T441-F611 HydrophobicContact CG2-CZ 4.08Å; H607-F611 HydrophobicContact CB-CE2 4.42Å; H607-F611 HydrophobicContact CB-CZ 4.41Å; H607-F611 WeakPolarHBondContact O-CD1 3.42Å; H607-F611 WeakPolarHBondContact O-CD2 3.46Å; H607-F611 WeakPolarHBondContact O-CG 3.37Å; H607-F611 PolarHBondContact O-N 3.44Å; L608-F611 PolarHBondContact O-N 3.38Å; F611-E614 PolarHBondContact O-N 3.18Å; F611-G615 PolarHBondContact O-N 3Å; F611-L616 HydrophobicContact CB-CB 4.4Å; F611-L616 HydrophobicContact CB-CD1 4.43Å; F611-L616 WeakPolarHBondContact O-CB 3.18Å; F611-L616 PolarHBondContact O-N 2.88Å; F611-T618 HydrophobicContact CB-CG2 3.85Å; F611-T618 HydrophobicContact CD2-CG2 4.48Å; F611-A670 HydrophobicContact CB-CB 4.06Å; F611-A670 HydrophobicContact CD1-CB 4.46Å; F611-A670 HydrophobicContact CD2-CB 3.62Å; F611-A670 HydrophobicContact CE2-CB 4.11Å; F611-A670 HydrophobicContact CG-CB 3.81Å
612	A	76.6	Confident	86	Confident	12 Å²	12	34.3 Å²	34.3	10%	0.099	19%	0.188	C	C	.	.	H	α-helix	trans	-67	-39.9	174.1	0	0	0	0	0	112.4	L608 E609 Q610 E614 G615	L608-A612 WeakPolarHBondContact O-CB 3.43Å; L608-A612 PolarHBondContact O-N 3.34Å; E609-A612 PolarHBondContact O-N 3.03Å; Q610-A612 PolarHBondContact O-N 3.35Å; A612-E614 VanDerWaalsContact C-N 3.28Å; A612-E614 PolarHBondContact O-N 2.83Å; A612-G615 WeakPolarHBondContact O-CA 3.39Å; A612-G615 PolarHBondContact O-N 3.24Å
613	T	73.7	Confident	86.3	Confident	88 Å²	88	31 Å²	31	54%	0.54	17%	0.166	S	C	.	.	H	α-helix	trans	-67.7	-26.2	173.9	57.4	0	0	0	0	113.8	E609 Q610 G615	E609-T613 PolarHBondContact O-N 3.46Å; E609-T613 PolarHBondContact O-OG1 3.15Å; Q610-T613 PolarHBondContact O-N 3.05Å; Q610-T613 PolarHBondContact O-OG1 3.35Å; T613-G615 PolarHBondContact O-N 2.89Å
614	E	74.9	Confident	86.5	Confident	74 Å²	74	27.9 Å²	27.9	35%	0.346	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-3.8	169.5	-66.4	177.8	-155.8	0	0	112.8	K434 Q610 F611 A612 L616	K434-E614 WeakPolarHBondContact CE-OE2 3.45Å; K434-E614 IonicContact NZ-OE1 2.71Å; K434-E614 PolarHBondContact NZ-OE1 3.32Å; K434-E614 IonicContact NZ-OE2 3.83Å; K434-E614 PolarHBondContact NZ-OE2 2.96Å; Q610-E614 PolarHBondContact NE2-OE1 2.85Å; Q610-E614 PolarHBondContact O-N 2.82Å; F611-E614 PolarHBondContact O-N 3.18Å; A612-E614 VanDerWaalsContact C-N 3.28Å; A612-E614 PolarHBondContact O-N 2.83Å; E614-L616 VanDerWaalsContact C-N 3.33Å; E614-L616 HydrophobicContact CB-CD1 4.31Å; E614-L616 HydrophobicContact CB-CG 4.1Å
615	G	75.3	Confident	86.7	Confident	10 Å²	10	30.8 Å²	30.8	10%	0.103	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.1	12.6	-179.7	0	0	0	0	0	114.9	F611 A612 T613	F611-G615 PolarHBondContact O-N 3Å; A612-G615 WeakPolarHBondContact O-CA 3.39Å; A612-G615 PolarHBondContact O-N 3.24Å; T613-G615 PolarHBondContact O-N 2.89Å
616	L	83.1	Confident	86.9	Confident	10 Å²	10	30.5 Å²	30.5	5%	0.052	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-78.3	143.4	-179.9	-55.4	175.6	0	0	0	111.3	K433 K434 F611 E614 T618 A670 E672	K433-L616 HydrophobicContact CB-CD2 4.34Å; K433-L616 HydrophobicContact CG-CD2 4.32Å; K434-L616 HydrophobicContact CD-CD1 4.23Å; K434-L616 HydrophobicContact CG-CD1 4.41Å; F611-L616 HydrophobicContact CB-CB 4.4Å; F611-L616 HydrophobicContact CB-CD1 4.43Å; F611-L616 WeakPolarHBondContact O-CB 3.18Å; F611-L616 PolarHBondContact O-N 2.88Å; E614-L616 VanDerWaalsContact C-N 3.33Å; E614-L616 HydrophobicContact CB-CD1 4.31Å; E614-L616 HydrophobicContact CB-CG 4.1Å; L616-T618 PolarHBondContact O-N 3.49Å; L616-A670 HydrophobicContact CB-CB 3.91Å; L616-A670 HydrophobicContact CD1-CB 3.76Å; L616-A670 HydrophobicContact CG-CB 4.47Å; L616-E672 HydrophobicContact CD2-CB 3.81Å; L616-E672 HydrophobicContact CD2-CG 4.19Å
617	R	85.8	Confident	87	Confident	7 Å²	7	35.3 Å²	35.3	3%	0.026	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	118.6	174.7	-54.4	178.4	171.5	-154.1	-3.6	109.6	M430 D519 A670 I671 D673 G1150 A1152 S1154	M430-R617 VanDerWaalsContact CE-NH2 3.35Å; D519-R617 IonicContact OD1-CZ 2.72Å; D519-R617 IonicContact OD1-NH1 3.6Å; D519-R617 PolarHBondContact OD1-NH1 2.73Å; D519-R617 IonicContact OD2-NH1 3.24Å; D519-R617 PolarHBondContact OD2-NH1 2.98Å; D519-R617 VanDerWaalsContact OD2-NH1 3.09Å; R617-A670 WeakPolarHBondContact O-CA 3.34Å; R617-I671 HydrophobicContact CB-CB 4.31Å; R617-I671 WeakPolarHBondContact CB-O 3.41Å; R617-I671 PolarHBondContact N-O 2.94Å; R617-I671 PolarHBondContact O-N 3.35Å; R617-D673 IonicContact CZ-OD2 2.68Å; R617-D673 IonicContact NE-OD2 2.69Å; R617-D673 IonicContact NH2-OD2 3.36Å; R617-D673 PolarHBondContact NH2-OD2 3.25Å; R617-G1150 WeakPolarHBondContact CA-O 3.48Å; R617-A1152 HydrophobicContact CB-CB 4.21Å; R617-A1152 HydrophobicContact CG-CB 4.01Å; R617-S1154 PolarHBondContact NH1-OG 2.89Å
618	T	88.6	Confident	87	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	147	-178.4	58.2	0	0	0	0	113.4	D587 L608 F611 L616 T669 G1150 Y1151	D587-T618 PolarHBondContact OD2-OG1 2.75Å; L608-T618 VanDerWaalsContact CD2-CB 3.46Å; L608-T618 HydrophobicContact CD2-CG2 3.61Å; F611-T618 HydrophobicContact CB-CG2 3.85Å; F611-T618 HydrophobicContact CD2-CG2 4.48Å; L616-T618 PolarHBondContact O-N 3.49Å; T618-T669 WeakPolarHBondContact CA-O 3.48Å; T618-G1150 PolarHBondContact N-O 3Å; T618-G1150 VanDerWaalsContact N-O 3.09Å; T618-Y1151 WeakPolarHBondContact O-CD2 3.48Å; T618-Y1151 WeakPolarHBondContact OG1-CA 3.47Å; T618-Y1151 PolarHBondContact OG1-N 3.49Å; T618-Y1151 VanDerWaalsContact OG1-N 3.14Å
619	L	92	Very high	87	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.016	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	126.3	172.8	-87.7	166.7	0	0	0	110	L523 F621 A668 T669 I671 Y1151 F1153	L523-L619 HydrophobicContact CD1-CD1 4.17Å; L619-F621 HydrophobicContact CB-CE2 3.97Å; L619-A668 CarbonylContact O-C 3.57Å; L619-A668 WeakPolarHBondContact O-CA 3.36Å; L619-A668 VanDerWaalsContact O-CB 3.29Å; L619-A668 WeakPolarHBondContact O-CB 3.28Å; L619-T669 PolarHBondContact N-O 2.83Å; L619-T669 PolarHBondContact O-N 3.35Å; L619-I671 HydrophobicContact CD1-CD1 4.35Å; L619-Y1151 HydrophobicContact CD2-CD2 4.25Å; L619-Y1151 HydrophobicContact CD2-CE2 3.78Å; L619-F1153 HydrophobicContact CD1-CD2 3.85Å; L619-F1153 HydrophobicContact CD1-CE2 4.09Å; L619-F1153 HydrophobicContact CD2-CD2 4.31Å
620	C	93.7	Very high	87.3	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	145.1	174.1	-80.5	0	0	0	0	111.9	K584 G585 I590	K584-C620 VanDerWaalsContact CA-O 3.27Å; K584-C620 WeakPolarHBondContact CA-O 3.38Å; G585-C620 PolarHBondContact N-O 2.8Å; G585-C620 VanDerWaalsContact N-O 3.07Å; G585-C620 PolarHBondContact O-N 2.68Å; I590-C620 HydrophobicContact CB-CB 3.92Å; I590-C620 HydrophobicContact CG1-CB 3.94Å; I590-C620 HydrophobicContact CG2-CB 4Å
621	F	95	Very high	87.6	Confident	1 Å²	1	34.6 Å²	34.6	0%	0.004	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	119	-178.5	-77.1	-114.9	0	0	0	109.9	F492 M495 M496 L523 K584 L619 L666 G667 T669	F492-F621 HydrophobicContact CD2-CB 3.99Å; F492-F621 HydrophobicContact CD2-CG 4.34Å; F492-F621 HydrophobicContact CE2-CB 3.81Å; F492-F621 HydrophobicContact CE2-CD2 4.2Å; F492-F621 AromaticContact CE2-CG 3.94Å; F492-F621 HydrophobicContact CE2-CG 3.94Å; M495-F621 HydrophobicContact CB-CD1 4.49Å; M495-F621 HydrophobicContact CE-CB 3.95Å; M495-F621 HydrophobicContact CE-CD1 3.55Å; M495-F621 HydrophobicContact CE-CE1 4.36Å; M495-F621 HydrophobicContact CE-CG 4.04Å; M495-F621 HydrophobicContact CG-CD1 3.89Å; M495-F621 HydrophobicContact CG-CE1 4.42Å; M495-F621 HydrophobicContact SD-CB 4.1Å; M495-F621 HydrophobicContact SD-CD1 3.8Å; M495-F621 HydrophobicContact SD-CG 4.43Å; M496-F621 HydrophobicContact CG-CD1 4.43Å; M496-F621 HydrophobicContact CG-CE1 3.73Å; M496-F621 HydrophobicContact CG-CZ 4.15Å; L523-F621 HydrophobicContact CD1-CZ 4.05Å; L523-F621 HydrophobicContact CD2-CE2 4.46Å; L523-F621 HydrophobicContact CD2-CZ 3.92Å; K584-F621 HydrophobicContact CB-CD1 4.47Å; K584-F621 HydrophobicContact CB-CE1 4.38Å; K584-F621 HydrophobicContact CB-CZ 4.39Å; K584-F621 HydrophobicContact CD-CZ 4.46Å; L619-F621 HydrophobicContact CB-CE2 3.97Å; F621-L666 PolarHBondContact O-N 2.71Å; F621-G667 PolarHBondContact N-O 2.93Å; F621-G667 PolarHBondContact O-N 3Å; F621-T669 HydrophobicContact CD2-CG2 3.97Å; F621-T669 HydrophobicContact CE2-CG2 3.47Å; F621-T669 VanDerWaalsContact CE2-CG2 3.47Å; F621-T669 WeakPolarHBondContact CE2-OG1 3.43Å; F621-T669 HydrophobicContact CZ-CG2 3.98Å
622	A	95	Very high	87.9	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	159.4	178.7	0	0	0	0	0	111.9	M495 C583 I590 L594 L663 M664	M495-A622 WeakPolarHBondContact CE-O 3.06Å; C583-A622 PolarHBondContact N-O 3.11Å; C583-A622 PolarHBondContact O-N 2.78Å; C583-A622 VanDerWaalsContact O-O 3.07Å; I590-A622 HydrophobicContact CG2-CB 3.92Å; L594-A622 HydrophobicContact CD2-CB 4.08Å; A622-L663 HydrophobicContact CB-CB 3.93Å; A622-L663 HydrophobicContact CB-CD1 4.38Å; A622-M664 CarbonylContact C-O 3.6Å; A622-M664 WeakPolarHBondContact CA-O 3.26Å; A622-M664 WeakPolarHBondContact CB-O 3.49Å
623	Y	94.5	Very high	88.6	Confident	58 Å²	58	44.3 Å²	44.3	23%	0.227	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	165.1	179.8	81.1	-73.6	0	0	0	112.3	R580 L581 M664 L666	R580-Y623 HydrophobicContact CG-CD2 4.07Å; L581-Y623 CarbonylContact O-C 3.53Å; L581-Y623 WeakPolarHBondContact O-CA 3.33Å; L581-Y623 WeakPolarHBondContact O-CB 3.36Å; Y623-M664 HydrophobicContact CD1-CB 4.24Å; Y623-M664 HydrophobicContact CE1-CB 3.95Å; Y623-M664 PolarHBondContact N-O 3.27Å; Y623-M664 PolarHBondContact O-N 2.9Å; Y623-L666 HydrophobicContact CD1-CD1 3.86Å; Y623-L666 HydrophobicContact CD1-CD2 3.85Å; Y623-L666 HydrophobicContact CD1-CG 3.69Å; Y623-L666 HydrophobicContact CE1-CD2 3.67Å; Y623-L666 HydrophobicContact CE1-CG 4.02Å
624	V	93.8	Very high	89.5	Confident	25 Å²	25	40.9 Å²	40.9	15%	0.152	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	139	166.3	62.5	0	0	0	0	110.3	R580 L581 L626 L663	R580-V624 WeakPolarHBondContact CA-O 2.85Å; L581-V624 HydrophobicContact CB-CG1 3.85Å; L581-V624 HydrophobicContact CD2-CG1 3.96Å; L581-V624 HydrophobicContact CG-CG1 4.38Å; L581-V624 PolarHBondContact N-O 3.48Å; L581-V624 PolarHBondContact O-N 2.93Å; V624-L626 HydrophobicContact CG1-CD2 3.99Å; V624-L663 HydrophobicContact CB-CD2 4.15Å; V624-L663 HydrophobicContact CG1-CD2 3.75Å
625	D	92.6	Very high	90.3	Very high	62 Å²	62	39 Å²	39	33%	0.332	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	126.2	169.7	-81.3	13.3	0	0	0	107.9	K578 R580	K578-D625 IonicContact NZ-OD2 3.33Å; K578-D625 PolarHBondContact NZ-OD2 3.02Å; R580-D625 IonicContact CZ-OD1 3.92Å; R580-D625 IonicContact NE-OD1 3.47Å; R580-D625 PolarHBondContact NE-OD1 3.31Å; R580-D625 IonicContact NH2-OD1 2.75Å; R580-D625 PolarHBondContact NH2-OD1 2.95Å; R580-D625 IonicContact NH2-OD2 3.76Å; R580-D625 PolarHBondContact NH2-OD2 2.72Å
626	L	92.1	Very high	91	Very high	35 Å²	35	44.9 Å²	44.9	18%	0.183	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	143.7	-176.1	-66.2	177.3	0	0	0	111.8	V571 L579 L581 V624 L659	V571-L626 HydrophobicContact CG1-CD1 4.25Å; L579-L626 HydrophobicContact CB-CB 4.02Å; L579-L626 PolarHBondContact O-N 3.24Å; L579-L626 VanDerWaalsContact O-N 3.09Å; L581-L626 HydrophobicContact CB-CD1 4.01Å; L581-L626 HydrophobicContact CB-CG 4.26Å; V624-L626 HydrophobicContact CG1-CD2 3.99Å; L626-L659 HydrophobicContact CD1-CD1 4.03Å; L626-L659 HydrophobicContact CD1-CD2 4.15Å; L626-L659 HydrophobicContact CD1-CG 4.24Å; L626-L659 HydrophobicContact CD2-CD1 4.18Å; L626-L659 HydrophobicContact CD2-CG 4.48Å
627	E	91.7	Very high	91.2	Very high	154 Å²	154	47.9 Å²	47.9	72%	0.72	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-78.2	135.6	167.1	-65.4	-168.9	174.3	0	0	111	G629 A630 Y631	E627-G629 VanDerWaalsContact C-N 3.26Å; E627-G629 PolarHBondContact O-N 2.8Å; E627-A630 HydrophobicContact CB-CB 4.44Å; E627-A630 PolarHBondContact O-N 2.93Å; E627-Y631 PolarHBondContact O-N 2.83Å
628	E	88.7	Confident	91.4	Very high	71 Å²	71	49.3 Å²	49.3	33%	0.332	25%	0.252	S	S	.	.	H	α-helix	trans	-58.5	-37.4	-179.7	-169.7	77.5	-132	0	0	111.7	R573 L579 Y631 Q632	R573-E628 IonicContact CZ-OE2 3.01Å; R573-E628 VanDerWaalsContact CZ-OE2 3.28Å; R573-E628 IonicContact NH1-OE2 3.83Å; R573-E628 PolarHBondContact NH1-OE2 3.09Å; R573-E628 IonicContact NH2-OE1 3.69Å; R573-E628 PolarHBondContact NH2-OE1 3.24Å; R573-E628 IonicContact NH2-OE2 3.25Å; R573-E628 PolarHBondContact NH2-OE2 2.84Å; L579-E628 HydrophobicContact CD1-CB 4.25Å; L579-E628 WeakPolarHBondContact CD1-OE2 3.38Å; E628-Y631 PolarHBondContact O-N 2.8Å; E628-Q632 HydrophobicContact CG-CG 4.26Å; E628-Q632 WeakPolarHBondContact O-CB 3.47Å; E628-Q632 WeakPolarHBondContact O-CG 3.33Å; E628-Q632 PolarHBondContact O-N 3.13Å; E628-Q632 PolarHBondContact OE1-NE2 2.91Å
629	G	88.4	Confident	91.3	Very high	49 Å²	49	53.2 Å²	53.2	51%	0.505	27%	0.273	S	S	.	.	H	α-helix	trans	-59.8	-53.5	176.3	0	0	0	0	0	112.8	E627 Y631 Q632 E633	E627-G629 VanDerWaalsContact C-N 3.26Å; E627-G629 PolarHBondContact O-N 2.8Å; G629-Y631 VanDerWaalsContact C-N 3.35Å; G629-Y631 PolarHBondContact O-N 3.47Å; G629-Q632 PolarHBondContact O-N 3.09Å; G629-E633 PolarHBondContact O-N 3.44Å
630	A	87.7	Confident	91.1	Very high	56 Å²	56	58.7 Å²	58.7	46%	0.463	29%	0.293	S	S	.	.	H	α-helix	trans	-62.1	-40.7	179.3	0	0	0	0	0	112.2	E627 E633 W634	E627-A630 HydrophobicContact CB-CB 4.44Å; E627-A630 PolarHBondContact O-N 2.93Å; A630-E633 PolarHBondContact O-N 3.39Å; A630-W634 WeakPolarHBondContact O-CB 3.46Å; A630-W634 PolarHBondContact O-N 3.09Å
631	Y	91	Very high	90.8	Very high	9 Å²	9	58.9 Å²	58.9	4%	0.035	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-40.9	175.3	171.3	-108.8	0	0	0	112.4	L556 N557 V571 L579 E627 E628 G629 E633 W634 L635	L556-Y631 HydrophobicContact CD1-CE1 4.23Å; N557-Y631 PolarHBondContact OD1-OH 2.91Å; V571-Y631 HydrophobicContact CG1-CD2 4.15Å; V571-Y631 HydrophobicContact CG1-CE2 3.86Å; L579-Y631 HydrophobicContact CD1-CD1 3.66Å; L579-Y631 HydrophobicContact CD1-CG 3.89Å; L579-Y631 HydrophobicContact CD2-CD1 4.47Å; E627-Y631 PolarHBondContact O-N 2.83Å; E628-Y631 PolarHBondContact O-N 2.8Å; G629-Y631 VanDerWaalsContact C-N 3.35Å; G629-Y631 PolarHBondContact O-N 3.47Å; Y631-E633 VanDerWaalsContact C-N 3.31Å; Y631-E633 PolarHBondContact O-N 2.96Å; Y631-W634 HydrophobicContact CD2-CE3 4.06Å; Y631-W634 AromaticContact CE2-CE3 3.93Å; Y631-W634 HydrophobicContact CE2-CE3 3.93Å; Y631-W634 HydrophobicContact CE2-CZ3 4.01Å; Y631-W634 PolarHBondContact O-N 3.42Å; Y631-L635 HydrophobicContact CE1-CD2 4.23Å; Y631-L635 VanDerWaalsContact O-CB 3.25Å; Y631-L635 WeakPolarHBondContact O-CB 3.35Å; Y631-L635 PolarHBondContact O-N 3.37Å
632	Q	91.3	Very high	90.1	Very high	81 Å²	81	60.5 Å²	60.5	38%	0.379	31%	0.306	S	S	.	.	H	α-helix	trans	-71.3	-23.1	177.9	-66.6	-71.5	-18.5	0	0	113.2	E628 G629 K636	E628-Q632 HydrophobicContact CG-CG 4.26Å; E628-Q632 WeakPolarHBondContact O-CB 3.47Å; E628-Q632 WeakPolarHBondContact O-CG 3.33Å; E628-Q632 PolarHBondContact O-N 3.13Å; E628-Q632 PolarHBondContact OE1-NE2 2.91Å; G629-Q632 PolarHBondContact O-N 3.09Å; Q632-K636 WeakPolarHBondContact O-CD 3.46Å; Q632-K636 VanDerWaalsContact O-CE 3.27Å; Q632-K636 WeakPolarHBondContact O-CE 3.37Å; Q632-K636 WeakPolarHBondContact O-CG 3.48Å
633	E	90.9	Very high	89.6	Confident	137 Å²	137	65.6 Å²	65.6	64%	0.64	34%	0.338	S	S	*	.	H	α-helix	trans	-76.4	-48.1	168.6	-69.9	-170.8	159.6	0	0	111.6	G629 A630 Y631 L635 K636 E637	G629-E633 PolarHBondContact O-N 3.44Å; A630-E633 PolarHBondContact O-N 3.39Å; Y631-E633 VanDerWaalsContact C-N 3.31Å; Y631-E633 PolarHBondContact O-N 2.96Å; E633-L635 VanDerWaalsContact C-N 3.29Å; E633-L635 PolarHBondContact O-N 3.03Å; E633-K636 WeakPolarHBondContact O-CB 3.48Å; E633-K636 PolarHBondContact O-N 3.09Å; E633-E637 PolarHBondContact O-N 2.93Å
634	W	93.1	Very high	89.1	Confident	17 Å²	17	65.2 Å²	65.2	6%	0.064	34%	0.338	C	S	.	.	H	α-helix	trans	-56.5	-41.5	174.2	177.4	87.1	0	0	0	112.3	N557 L559 A630 Y631 K636 E637 Y638 C655 Y656 L659	N557-W634 HydrophobicContact CB-CH2 4.32Å; N557-W634 HydrophobicContact CB-CZ3 4.39Å; L559-W634 HydrophobicContact CD2-CH2 3.77Å; L559-W634 HydrophobicContact CD2-CZ2 3.96Å; A630-W634 WeakPolarHBondContact O-CB 3.46Å; A630-W634 PolarHBondContact O-N 3.09Å; Y631-W634 HydrophobicContact CD2-CE3 4.06Å; Y631-W634 AromaticContact CE2-CE3 3.93Å; Y631-W634 HydrophobicContact CE2-CE3 3.93Å; Y631-W634 HydrophobicContact CE2-CZ3 4.01Å; Y631-W634 PolarHBondContact O-N 3.42Å; W634-K636 VanDerWaalsContact C-N 3.3Å; W634-K636 PolarHBondContact O-N 2.85Å; W634-E637 PolarHBondContact O-N 3.29Å; W634-E637 VanDerWaalsContact O-N 3.1Å; W634-Y638 HydrophobicContact CH2-CD1 4.49Å; W634-Y638 AromaticContact CH2-CD2 3.89Å; W634-Y638 HydrophobicContact CH2-CD2 3.89Å; W634-Y638 AromaticContact CH2-CG 3.82Å; W634-Y638 HydrophobicContact CH2-CG 3.82Å; W634-Y638 HydrophobicContact CZ2-CD2 4.1Å; W634-Y638 HydrophobicContact CZ2-CG 4.25Å; W634-Y638 HydrophobicContact CZ3-CG 4.21Å; W634-Y638 PolarHBondContact O-N 3.37Å; W634-C655 PolarHBondContact NE1-O 3.12Å; W634-Y656 HydrophobicContact CZ2-CD1 4.17Å; W634-L659 HydrophobicContact CB-CD1 4.24Å; W634-L659 HydrophobicContact CD2-CD1 4.13Å; W634-L659 HydrophobicContact CD2-CD2 4.26Å; W634-L659 HydrophobicContact CE3-CD2 4.44Å; W634-L659 HydrophobicContact CG-CD1 3.89Å; W634-L659 HydrophobicContact CZ2-CD2 4.39Å
635	L	91	Very high	88.3	Confident	33 Å²	33	72.4 Å²	72.4	17%	0.173	37%	0.374	C	S	.	.	H	α-helix	trans	-63.4	-33	-179.9	-177.8	61.5	0	0	0	112.7	Y631 E633 Y638 N639	Y631-L635 HydrophobicContact CE1-CD2 4.23Å; Y631-L635 VanDerWaalsContact O-CB 3.25Å; Y631-L635 WeakPolarHBondContact O-CB 3.35Å; Y631-L635 PolarHBondContact O-N 3.37Å; E633-L635 VanDerWaalsContact C-N 3.29Å; E633-L635 PolarHBondContact O-N 3.03Å; L635-Y638 HydrophobicContact CD1-CD1 4.24Å; L635-N639 VanDerWaalsContact O-CB 3.29Å; L635-N639 WeakPolarHBondContact O-CB 3.29Å; L635-N639 PolarHBondContact O-N 2.98Å; L635-N639 PolarHBondContact O-ND2 3.3Å; L635-N639 VanDerWaalsContact O-ND2 3.08Å
636	K	90.3	Very high	87.8	Confident	134 Å²	134	76.9 Å²	76.9	58%	0.583	39%	0.391	S	S	*	.	H	α-helix	trans	-65.4	-42.6	173.5	-66.7	160.7	-166.4	160.4	0	110.8	Q632 E633 W634 N639 R640	Q632-K636 WeakPolarHBondContact O-CD 3.46Å; Q632-K636 VanDerWaalsContact O-CE 3.27Å; Q632-K636 WeakPolarHBondContact O-CE 3.37Å; Q632-K636 WeakPolarHBondContact O-CG 3.48Å; E633-K636 WeakPolarHBondContact O-CB 3.48Å; E633-K636 PolarHBondContact O-N 3.09Å; W634-K636 VanDerWaalsContact C-N 3.3Å; W634-K636 PolarHBondContact O-N 2.85Å; K636-N639 PolarHBondContact O-N 3.24Å; K636-R640 WeakPolarHBondContact O-CB 3.39Å; K636-R640 PolarHBondContact O-N 2.85Å
637	E	88.8	Confident	87.2	Confident	73 Å²	73	80.3 Å²	80.3	34%	0.341	41%	0.409	S	S	.	.	H	α-helix	trans	-71.7	-41.8	179.9	-174.6	61.4	-174.2	0	0	111.8	E633 W634 N639 R640 V641	E633-E637 PolarHBondContact O-N 2.93Å; W634-E637 PolarHBondContact O-N 3.29Å; W634-E637 VanDerWaalsContact O-N 3.1Å; E637-N639 VanDerWaalsContact C-N 3.34Å; E637-N639 PolarHBondContact O-N 2.88Å; E637-R640 VanDerWaalsContact CD-NE 3.35Å; E637-R640 WeakPolarHBondContact O-CB 3.38Å; E637-R640 PolarHBondContact O-N 2.55Å; E637-R640 IonicContact OE1-CZ 3.45Å; E637-R640 IonicContact OE1-NE 2.82Å; E637-R640 PolarHBondContact OE1-NE 3.38Å; E637-R640 IonicContact OE1-NH2 3.83Å; E637-R640 PolarHBondContact OE1-NH2 3.04Å; E637-R640 IonicContact OE2-CZ 2.76Å; E637-R640 IonicContact OE2-NE 2.84Å; E637-R640 PolarHBondContact OE2-NE 3.33Å; E637-R640 IonicContact OE2-NH2 3.57Å; E637-V641 HydrophobicContact CG-CG2 4.46Å; E637-V641 WeakPolarHBondContact O-CB 3.3Å; E637-V641 WeakPolarHBondContact O-CG2 3.34Å; E637-V641 PolarHBondContact O-N 3.38Å
638	Y	88.6	Confident	86.7	Confident	37 Å²	37	79.2 Å²	79.2	15%	0.145	40%	0.399	C	S	.	.	H	α-helix	trans	-56.6	-47.1	170.4	171.3	-98.7	0	0	0	111.5	N557 W634 L635 R640 V641 S642 L652 Y656	N557-Y638 VanDerWaalsContact ND2-CE1 3.33Å; N557-Y638 WeakPolarHBondContact ND2-CE1 3.4Å; W634-Y638 HydrophobicContact CH2-CD1 4.49Å; W634-Y638 AromaticContact CH2-CD2 3.89Å; W634-Y638 HydrophobicContact CH2-CD2 3.89Å; W634-Y638 AromaticContact CH2-CG 3.82Å; W634-Y638 HydrophobicContact CH2-CG 3.82Å; W634-Y638 HydrophobicContact CZ2-CD2 4.1Å; W634-Y638 HydrophobicContact CZ2-CG 4.25Å; W634-Y638 HydrophobicContact CZ3-CG 4.21Å; W634-Y638 PolarHBondContact O-N 3.37Å; L635-Y638 HydrophobicContact CD1-CD1 4.24Å; Y638-R640 PolarHBondContact O-N 2.88Å; Y638-V641 PolarHBondContact O-N 2.96Å; Y638-S642 VanDerWaalsContact O-CB 3.23Å; Y638-S642 WeakPolarHBondContact O-CB 3.39Å; Y638-S642 PolarHBondContact O-N 2.67Å; Y638-S642 PolarHBondContact O-OG 2.83Å; Y638-L652 HydrophobicContact CD2-CD2 3.83Å; Y638-L652 HydrophobicContact CE2-CD2 3.72Å; Y638-Y656 AromaticContact CD2-CE1 3.93Å; Y638-Y656 HydrophobicContact CD2-CE1 3.93Å; Y638-Y656 AromaticContact CE2-CE1 3.76Å; Y638-Y656 HydrophobicContact CE2-CE1 3.76Å
639	N	88.1	Confident	86.2	Confident	82 Å²	82	80.7 Å²	80.7	44%	0.439	41%	0.412	S	S	.	.	H	α-helix	trans	-61	-45.1	176.5	-74.4	-27	0	0	0	111.1	L635 K636 E637 S642 T643	L635-N639 VanDerWaalsContact O-CB 3.29Å; L635-N639 WeakPolarHBondContact O-CB 3.29Å; L635-N639 PolarHBondContact O-N 2.98Å; L635-N639 PolarHBondContact O-ND2 3.3Å; L635-N639 VanDerWaalsContact O-ND2 3.08Å; K636-N639 PolarHBondContact O-N 3.24Å; E637-N639 VanDerWaalsContact C-N 3.34Å; E637-N639 PolarHBondContact O-N 2.88Å; N639-S642 PolarHBondContact O-OG 3.34Å; N639-T643 PolarHBondContact O-N 3.41Å
640	R	87.1	Confident	86	Confident	118 Å²	118	83.9 Å²	83.9	45%	0.445	41%	0.414	S	S	.	.	H	α-helix	trans	-55.4	-55.3	175.1	-166.5	-168.8	70.4	66.4	3	111.2	K636 E637 Y638 T643 E644	K636-R640 WeakPolarHBondContact O-CB 3.39Å; K636-R640 PolarHBondContact O-N 2.85Å; E637-R640 VanDerWaalsContact CD-NE 3.35Å; E637-R640 WeakPolarHBondContact O-CB 3.38Å; E637-R640 PolarHBondContact O-N 2.55Å; E637-R640 IonicContact OE1-CZ 3.45Å; E637-R640 IonicContact OE1-NE 2.82Å; E637-R640 PolarHBondContact OE1-NE 3.38Å; E637-R640 IonicContact OE1-NH2 3.83Å; E637-R640 PolarHBondContact OE1-NH2 3.04Å; E637-R640 IonicContact OE2-CZ 2.76Å; E637-R640 IonicContact OE2-NE 2.84Å; E637-R640 PolarHBondContact OE2-NE 3.33Å; E637-R640 IonicContact OE2-NH2 3.57Å; Y638-R640 PolarHBondContact O-N 2.88Å; R640-T643 PolarHBondContact O-N 3.25Å; R640-T643 PolarHBondContact O-OG1 3.39Å; R640-E644 IonicContact CZ-OE1 3.85Å; R640-E644 IonicContact NH1-OE1 3.75Å; R640-E644 PolarHBondContact NH1-OE1 2.75Å; R640-E644 IonicContact NH2-OE1 3.9Å
641	V	86.9	Confident	85.9	Confident	4 Å²	4	83.6 Å²	83.6	2%	0.024	40%	0.403	C	S	.	.	H	α-helix	trans	-65.8	-39	-176.7	172.8	0	0	0	0	112.4	E637 Y638 T643 E644 K651 L652	E637-V641 HydrophobicContact CG-CG2 4.46Å; E637-V641 WeakPolarHBondContact O-CB 3.3Å; E637-V641 WeakPolarHBondContact O-CG2 3.34Å; E637-V641 PolarHBondContact O-N 3.38Å; Y638-V641 PolarHBondContact O-N 2.96Å; V641-T643 PolarHBondContact O-N 3.14Å; V641-T643 VanDerWaalsContact O-N 3.15Å; V641-E644 WeakPolarHBondContact O-CB 3.42Å; V641-E644 PolarHBondContact O-N 3.23Å; V641-K651 HydrophobicContact CG1-CB 3.53Å; V641-L652 HydrophobicContact CB-CD2 4.44Å; V641-L652 HydrophobicContact CG1-CD2 3.86Å; V641-L652 HydrophobicContact CG1-CG 3.95Å
642	S	81.2	Confident	85.7	Confident	35 Å²	35	84.3 Å²	84.3	25%	0.245	41%	0.407	C	S	.	.	H	α-helix	trans	-61.5	-23.1	178.9	73.3	0	0	0	0	113.6	Y638 N639 R648	Y638-S642 VanDerWaalsContact O-CB 3.23Å; Y638-S642 WeakPolarHBondContact O-CB 3.39Å; Y638-S642 PolarHBondContact O-N 2.67Å; Y638-S642 PolarHBondContact O-OG 2.83Å; N639-S642 PolarHBondContact O-OG 3.34Å; S642-R648 WeakPolarHBondContact O-CD 3.43Å
643	T	84.3	Confident	85.4	Confident	108 Å²	108	81.9 Å²	81.9	66%	0.663	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-4.5	175.7	65.1	0	0	0	0	114.2	N639 R640 V641	N639-T643 PolarHBondContact O-N 3.41Å; R640-T643 PolarHBondContact O-N 3.25Å; R640-T643 PolarHBondContact O-OG1 3.39Å; V641-T643 PolarHBondContact O-N 3.14Å; V641-T643 VanDerWaalsContact O-N 3.15Å
644	E	84.3	Confident	85.3	Confident	50 Å²	50	80.3 Å²	80.3	23%	0.234	39%	0.388	C	S	.	.			trans	-72	140	178.1	-71.8	-164.1	-145.4	0	0	112.6	R640 V641 R648 K651	R640-E644 IonicContact CZ-OE1 3.85Å; R640-E644 IonicContact NH1-OE1 3.75Å; R640-E644 PolarHBondContact NH1-OE1 2.75Å; R640-E644 IonicContact NH2-OE1 3.9Å; V641-E644 WeakPolarHBondContact O-CB 3.42Å; V641-E644 PolarHBondContact O-N 3.23Å; E644-R648 WeakPolarHBondContact O-CB 3.3Å; E644-R648 WeakPolarHBondContact O-CD 3.23Å; E644-R648 WeakPolarHBondContact O-CG 3.42Å; E644-K651 WeakPolarHBondContact OE2-CD 3.18Å; E644-K651 WeakPolarHBondContact OE2-CE 3.44Å; E644-K651 IonicContact OE2-NZ 2.64Å; E644-K651 PolarHBondContact OE2-NZ 3.05Å
645	L	76.9	Confident	85.2	Confident	175 Å²	175	79.8 Å²	79.8	92%	0.916	39%	0.387	S	S	*	.	S	Bend	trans	-91.1	-12	-178	-67.4	170.1	0	0	0	114.1
646	K	80.6	Confident	85.2	Confident	157 Å²	157	79 Å²	79	68%	0.683	38%	0.382	S	S	*	.	S	Bend	trans	-124.2	132.9	-179.3	-71.9	-168.7	175.4	-171.4	0	110.8	R648 K651	K646-R648 PolarHBondContact O-N 3.31Å; K646-K651 PolarHBondContact O-NZ 2.84Å
647	D	80.3	Confident	85.2	Confident	107 Å²	107	74.9 Å²	74.9	57%	0.572	37%	0.365	S	S	*	.	S	Bend	trans	57.9	23.5	174.4	-35.6	-51	0	0	0	113.1	T649 Q650 K651	D647-T649 VanDerWaalsContact C-N 3.27Å; D647-T649 PolarHBondContact O-N 2.88Å; D647-Q650 PolarHBondContact O-N 2.97Å; D647-Q650 VanDerWaalsContact O-N 3.15Å; D647-K651 PolarHBondContact O-N 2.78Å; D647-K651 IonicContact OD2-NZ 3.99Å
648	R	80.5	Confident	85.2	Confident	131 Å²	131	76.6 Å²	76.6	49%	0.494	38%	0.375	S	S	.	.	H	α-helix	trans	-52.4	-43.7	-173.2	-171.2	-175.2	65.9	174	-1.1	112.2	S642 E644 K646 L652	S642-R648 WeakPolarHBondContact O-CD 3.43Å; E644-R648 WeakPolarHBondContact O-CB 3.3Å; E644-R648 WeakPolarHBondContact O-CD 3.23Å; E644-R648 WeakPolarHBondContact O-CG 3.42Å; K646-R648 PolarHBondContact O-N 3.31Å; R648-L652 HydrophobicContact CG-CD1 4.01Å; R648-L652 HydrophobicContact CG-CG 4.4Å; R648-L652 WeakPolarHBondContact O-CB 3.37Å; R648-L652 VanDerWaalsContact O-CG 3.24Å; R648-L652 WeakPolarHBondContact O-CG 3.16Å; R648-L652 PolarHBondContact O-N 3.17Å
649	T	79.5	Confident	85.3	Confident	101 Å²	101	75.7 Å²	75.7	62%	0.62	37%	0.373	S	S	*	.	H	α-helix	trans	-60.8	-52.3	-179.6	-46.3	0	0	0	0	110.9	D647 K651 L652 E653	D647-T649 VanDerWaalsContact C-N 3.27Å; D647-T649 PolarHBondContact O-N 2.88Å; T649-K651 PolarHBondContact O-N 2.77Å; T649-L652 WeakPolarHBondContact O-CB 3.47Å; T649-L652 PolarHBondContact O-N 2.92Å; T649-E653 WeakPolarHBondContact O-CG 3.47Å; T649-E653 PolarHBondContact O-N 3.38Å
650	Q	84.1	Confident	85.4	Confident	116 Å²	116	71.8 Å²	71.8	54%	0.542	35%	0.352	S	S	.	.	H	α-helix	trans	-61.7	-45.3	179.7	-176.5	-175.2	-29.7	0	0	111.7	D647 L652 E653 E654	D647-Q650 PolarHBondContact O-N 2.97Å; D647-Q650 VanDerWaalsContact O-N 3.15Å; Q650-L652 VanDerWaalsContact C-N 3.3Å; Q650-L652 PolarHBondContact O-N 2.94Å; Q650-E653 WeakPolarHBondContact O-CA 3.48Å; Q650-E653 WeakPolarHBondContact O-CB 3.49Å; Q650-E653 PolarHBondContact O-N 3.46Å; Q650-E653 VanDerWaalsContact O-N 3.08Å; Q650-E654 WeakPolarHBondContact CG-OE1 3.15Å; Q650-E654 PolarHBondContact NE2-OE1 3.35Å; Q650-E654 WeakPolarHBondContact O-CG 3.35Å; Q650-E654 PolarHBondContact O-N 2.85Å
651	K	85.9	Confident	85.5	Confident	51 Å²	51	70.6 Å²	70.6	22%	0.222	35%	0.35	C	S	.	.	H	α-helix	trans	-65.5	-32.5	178.7	-66.3	169.5	-176.8	159.6	0	112.6	V641 E644 K646 D647 T649 C655	V641-K651 HydrophobicContact CG1-CB 3.53Å; E644-K651 WeakPolarHBondContact OE2-CD 3.18Å; E644-K651 WeakPolarHBondContact OE2-CE 3.44Å; E644-K651 IonicContact OE2-NZ 2.64Å; E644-K651 PolarHBondContact OE2-NZ 3.05Å; K646-K651 PolarHBondContact O-NZ 2.84Å; D647-K651 PolarHBondContact O-N 2.78Å; D647-K651 IonicContact OD2-NZ 3.99Å; T649-K651 PolarHBondContact O-N 2.77Å; K651-C655 VanDerWaalsContact O-CB 3.28Å; K651-C655 WeakPolarHBondContact O-CB 3.19Å; K651-C655 PolarHBondContact O-N 3.12Å
652	L	85.5	Confident	85.7	Confident	23 Å²	23	75.8 Å²	75.8	12%	0.12	38%	0.378	C	S	.	.	H	α-helix	trans	-66	-42.8	170.3	-76.7	172.9	0	0	0	110.9	Y638 V641 R648 T649 Q650 E654 C655 Y656	Y638-L652 HydrophobicContact CD2-CD2 3.83Å; Y638-L652 HydrophobicContact CE2-CD2 3.72Å; V641-L652 HydrophobicContact CB-CD2 4.44Å; V641-L652 HydrophobicContact CG1-CD2 3.86Å; V641-L652 HydrophobicContact CG1-CG 3.95Å; R648-L652 HydrophobicContact CG-CD1 4.01Å; R648-L652 HydrophobicContact CG-CG 4.4Å; R648-L652 WeakPolarHBondContact O-CB 3.37Å; R648-L652 VanDerWaalsContact O-CG 3.24Å; R648-L652 WeakPolarHBondContact O-CG 3.16Å; R648-L652 PolarHBondContact O-N 3.17Å; T649-L652 WeakPolarHBondContact O-CB 3.47Å; T649-L652 PolarHBondContact O-N 2.92Å; Q650-L652 VanDerWaalsContact C-N 3.3Å; Q650-L652 PolarHBondContact O-N 2.94Å; L652-E654 PolarHBondContact O-N 3.47Å; L652-C655 WeakPolarHBondContact O-CB 3.24Å; L652-C655 PolarHBondContact O-N 2.69Å; L652-Y656 HydrophobicContact CB-CE1 4.37Å; L652-Y656 HydrophobicContact CB-CE2 4.19Å; L652-Y656 HydrophobicContact CD2-CE1 4.31Å; L652-Y656 WeakPolarHBondContact O-CD1 3.24Å; L652-Y656 VanDerWaalsContact O-CD2 3.31Å; L652-Y656 WeakPolarHBondContact O-CD2 3.48Å; L652-Y656 PolarHBondContact O-N 3.18Å
653	E	86.7	Confident	86.3	Confident	30 Å²	30	74.1 Å²	74.1	14%	0.14	37%	0.366	C	S	.	.	H	α-helix	trans	-60	-42.9	174.2	-65.2	-163.3	123.6	0	0	112.2	S562 N564 R565 T649 Q650 Y656 E657	S562-E653 VanDerWaalsContact CB-OE1 3.31Å; S562-E653 WeakPolarHBondContact CB-OE1 3.43Å; S562-E653 PolarHBondContact OG-OE1 3.46Å; N564-E653 PolarHBondContact ND2-OE2 3Å; R565-E653 WeakPolarHBondContact CD-OE1 3.33Å; R565-E653 HydrophobicContact CG-CB 4.41Å; R565-E653 HydrophobicContact CG-CG 4.36Å; T649-E653 WeakPolarHBondContact O-CG 3.47Å; T649-E653 PolarHBondContact O-N 3.38Å; Q650-E653 WeakPolarHBondContact O-CA 3.48Å; Q650-E653 WeakPolarHBondContact O-CB 3.49Å; Q650-E653 PolarHBondContact O-N 3.46Å; Q650-E653 VanDerWaalsContact O-N 3.08Å; E653-Y656 PolarHBondContact O-N 2.92Å; E653-E657 PolarHBondContact O-N 3.06Å; E653-E657 VanDerWaalsContact O-N 3.1Å
654	E	87.8	Confident	86.7	Confident	105 Å²	105	72 Å²	72	49%	0.491	35%	0.35	S	S	.	.	H	α-helix	trans	-62.2	-41.2	173.1	-70.1	168.2	-167.5	0	0	112	Q650 L652 E657	Q650-E654 WeakPolarHBondContact CG-OE1 3.15Å; Q650-E654 PolarHBondContact NE2-OE1 3.35Å; Q650-E654 WeakPolarHBondContact O-CG 3.35Å; Q650-E654 PolarHBondContact O-N 2.85Å; L652-E654 PolarHBondContact O-N 3.47Å; E654-E657 PolarHBondContact O-N 3.1Å
655	C	90.1	Very high	87.1	Confident	5 Å²	5	70.2 Å²	70.2	3%	0.034	34%	0.342	C	S	.	.	H	α-helix	trans	-65.5	-38.1	175.4	-172.9	0	0	0	0	112.2	W634 K651 L652 L658	W634-C655 PolarHBondContact NE1-O 3.12Å; K651-C655 VanDerWaalsContact O-CB 3.28Å; K651-C655 WeakPolarHBondContact O-CB 3.19Å; K651-C655 PolarHBondContact O-N 3.12Å; L652-C655 WeakPolarHBondContact O-CB 3.24Å; L652-C655 PolarHBondContact O-N 2.69Å; C655-L658 WeakPolarHBondContact O-CB 3.16Å; C655-L658 PolarHBondContact O-N 3.38Å
656	Y	91.1	Very high	87.9	Confident	17 Å²	17	62.2 Å²	62.2	7%	0.067	30%	0.3	C	S	.	.	H	α-helix	trans	-65	-40.5	176	-58.1	-21	0	0	0	111.5	L559 W634 Y638 L652 E653 L658 L659 E660	L559-Y656 HydrophobicContact CB-CD1 4.35Å; L559-Y656 HydrophobicContact CB-CD2 4.36Å; L559-Y656 HydrophobicContact CB-CG 4.22Å; L559-Y656 HydrophobicContact CD1-CD1 4.3Å; L559-Y656 HydrophobicContact CD1-CG 4.38Å; L559-Y656 HydrophobicContact CD2-CD1 3.72Å; L559-Y656 HydrophobicContact CD2-CE1 3.79Å; L559-Y656 HydrophobicContact CD2-CG 4.41Å; L559-Y656 HydrophobicContact CG-CD1 4.33Å; W634-Y656 HydrophobicContact CZ2-CD1 4.17Å; Y638-Y656 AromaticContact CD2-CE1 3.93Å; Y638-Y656 HydrophobicContact CD2-CE1 3.93Å; Y638-Y656 AromaticContact CE2-CE1 3.76Å; Y638-Y656 HydrophobicContact CE2-CE1 3.76Å; L652-Y656 HydrophobicContact CB-CE1 4.37Å; L652-Y656 HydrophobicContact CB-CE2 4.19Å; L652-Y656 HydrophobicContact CD2-CE1 4.31Å; L652-Y656 WeakPolarHBondContact O-CD1 3.24Å; L652-Y656 VanDerWaalsContact O-CD2 3.31Å; L652-Y656 WeakPolarHBondContact O-CD2 3.48Å; L652-Y656 PolarHBondContact O-N 3.18Å; E653-Y656 PolarHBondContact O-N 2.92Å; Y656-L658 PolarHBondContact O-N 3.11Å; Y656-L658 VanDerWaalsContact O-N 3.11Å; Y656-L659 PolarHBondContact O-N 3.06Å; Y656-E660 WeakPolarHBondContact O-CG 3.36Å; Y656-E660 PolarHBondContact O-N 2.91Å; Y656-E660 VanDerWaalsContact O-N 3.15Å
657	E	89.9	Confident	88.5	Confident	47 Å²	47	54.8 Å²	54.8	22%	0.22	27%	0.268	C	S	.	.	H	α-helix	trans	-63	-14	176.3	-164.3	65.5	-115	0	0	113.7	R567 R593 E653 E654 K661	R567-E657 IonicContact CZ-OE2 2.85Å; R567-E657 IonicContact NH1-OE2 3.54Å; R567-E657 PolarHBondContact NH1-OE2 3.37Å; R567-E657 IonicContact NH2-OE1 3.15Å; R567-E657 IonicContact NH2-OE2 2.71Å; R567-E657 PolarHBondContact NH2-OE2 2.69Å; R593-E657 IonicContact CZ-OE1 2.83Å; R593-E657 IonicContact CZ-OE2 3.58Å; R593-E657 IonicContact NE-OE1 3.67Å; R593-E657 PolarHBondContact NE-OE1 3.35Å; R593-E657 IonicContact NE-OE2 3.25Å; R593-E657 PolarHBondContact NE-OE2 3.11Å; R593-E657 VanDerWaalsContact NH2-CD 3.29Å; R593-E657 IonicContact NH2-OE1 2.75Å; R593-E657 PolarHBondContact NH2-OE1 2.87Å; R593-E657 VanDerWaalsContact NH2-OE1 3.13Å; R593-E657 IonicContact NH2-OE2 2.69Å; R593-E657 PolarHBondContact NH2-OE2 3.28Å; E653-E657 PolarHBondContact O-N 3.06Å; E653-E657 VanDerWaalsContact O-N 3.1Å; E654-E657 PolarHBondContact O-N 3.1Å; E657-K661 WeakPolarHBondContact O-CD 3.5Å; E657-K661 WeakPolarHBondContact O-CE 3.48Å; E657-K661 PolarHBondContact O-NZ 3.05Å
658	L	89.7	Confident	89.2	Confident	109 Å²	109	49.7 Å²	49.7	57%	0.571	24%	0.24	S	C	*	.	H	α-helix	trans	-74.8	-35	171.1	-60.8	179.2	0	0	0	112.7	C655 Y656	C655-L658 WeakPolarHBondContact O-CB 3.16Å; C655-L658 PolarHBondContact O-N 3.38Å; Y656-L658 PolarHBondContact O-N 3.11Å; Y656-L658 VanDerWaalsContact O-N 3.11Å
659	L	90.1	Very high	89.8	Confident	18 Å²	18	43.4 Å²	43.4	9%	0.094	22%	0.217	C	C	.	.	H	α-helix	trans	-90.4	-29.3	-176.1	-158.1	76.7	0	0	0	112.4	L559 V571 L581 L626 W634 Y656 K661	L559-L659 HydrophobicContact CD1-CD2 4.31Å; V571-L659 HydrophobicContact CG2-CD2 3.61Å; L581-L659 HydrophobicContact CD1-CD2 4.23Å; L581-L659 HydrophobicContact CD2-CD2 4.29Å; L581-L659 HydrophobicContact CD2-CG 4.16Å; L581-L659 WeakPolarHBondContact CD2-O 3.2Å; L626-L659 HydrophobicContact CD1-CD1 4.03Å; L626-L659 HydrophobicContact CD1-CD2 4.15Å; L626-L659 HydrophobicContact CD1-CG 4.24Å; L626-L659 HydrophobicContact CD2-CD1 4.18Å; L626-L659 HydrophobicContact CD2-CG 4.48Å; W634-L659 HydrophobicContact CB-CD1 4.24Å; W634-L659 HydrophobicContact CD2-CD1 4.13Å; W634-L659 HydrophobicContact CD2-CD2 4.26Å; W634-L659 HydrophobicContact CE3-CD2 4.44Å; W634-L659 HydrophobicContact CG-CD1 3.89Å; W634-L659 HydrophobicContact CZ2-CD2 4.39Å; Y656-L659 PolarHBondContact O-N 3.06Å; L659-K661 PolarHBondContact O-N 2.89Å
660	E	91.6	Very high	90.3	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-85.8	44.8	-171.1	-64.4	176.2	136.7	0	0	113.5	L559 R565 R567 S569 L581 R593 Y656	L559-E660 HydrophobicContact CD1-CG 4Å; R565-E660 IonicContact CZ-OE2 2.72Å; R565-E660 IonicContact NE-OE2 3.37Å; R565-E660 PolarHBondContact NE-OE2 3.35Å; R565-E660 VanDerWaalsContact NH2-CD 3.26Å; R565-E660 IonicContact NH2-OE1 2.79Å; R565-E660 PolarHBondContact NH2-OE1 3.28Å; R565-E660 IonicContact NH2-OE2 3.75Å; R565-E660 PolarHBondContact NH2-OE2 2.93Å; R567-E660 IonicContact CZ-OE2 2.69Å; R567-E660 IonicContact NE-OE1 2.69Å; R567-E660 IonicContact NE-OE2 3.47Å; R567-E660 PolarHBondContact NE-OE2 3.38Å; R567-E660 IonicContact NH2-OE2 2.83Å; R567-E660 PolarHBondContact NH2-OE2 3.47Å; S569-E660 WeakPolarHBondContact CB-OE1 3.31Å; S569-E660 PolarHBondContact OG-OE1 3.49Å; L581-E660 HydrophobicContact CD2-CG 4.2Å; R593-E660 WeakPolarHBondContact CD-O 3.32Å; R593-E660 WeakPolarHBondContact CG-O 3.3Å; Y656-E660 WeakPolarHBondContact O-CG 3.36Å; Y656-E660 PolarHBondContact O-N 2.91Å; Y656-E660 VanDerWaalsContact O-N 3.15Å
661	K	89.3	Confident	90.5	Very high	94 Å²	94	33.1 Å²	33.1	41%	0.409	16%	0.162	S	C	.	.			trans	-124.5	160.8	-176.8	-74	169.8	173.9	140.5	0	111.9	E657 L659 L663	E657-K661 WeakPolarHBondContact O-CD 3.5Å; E657-K661 WeakPolarHBondContact O-CE 3.48Å; E657-K661 PolarHBondContact O-NZ 3.05Å; L659-K661 PolarHBondContact O-N 2.89Å; K661-L663 VanDerWaalsContact C-N 3.26Å; K661-L663 PolarHBondContact O-N 2.89Å
662	N	91.2	Very high	90.5	Very high	112 Å²	112	33.2 Å²	33.2	60%	0.599	16%	0.163	S	C	*	.	S	Bend	trans	55.5	40.3	178.8	-56.4	-30.3	0	0	0	113	R593 T595	R593-N662 PolarHBondContact O-N 2.91Å; R593-N662 VanDerWaalsContact O-N 3.13Å; T595-N662 WeakPolarHBondContact OG1-CA 3.44Å; T595-N662 WeakPolarHBondContact OG1-CB 3.5Å; T595-N662 PolarHBondContact OG1-O 3.39Å
663	L	92.8	Very high	90.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-72.7	151.8	-178.2	-56.8	177.4	0	0	0	111.5	L581 C583 I590 R593 L594 T595 A622 V624 K661	L581-L663 HydrophobicContact CD2-CD2 4.22Å; C583-L663 HydrophobicContact CB-CD1 3.98Å; C583-L663 HydrophobicContact CB-CD2 4.47Å; I590-L663 HydrophobicContact CD1-CD1 4.46Å; R593-L663 HydrophobicContact CB-CD1 3.99Å; R593-L663 HydrophobicContact CB-CG 4.42Å; R593-L663 PolarHBondContact O-N 2.72Å; L594-L663 CarbonylContact C-O 3.57Å; L594-L663 VanDerWaalsContact CA-O 3.25Å; L594-L663 WeakPolarHBondContact CA-O 3.27Å; L594-L663 HydrophobicContact CD2-CB 4.07Å; L594-L663 WeakPolarHBondContact CD2-O 3.21Å; T595-L663 PolarHBondContact N-O 3.04Å; A622-L663 HydrophobicContact CB-CB 3.93Å; A622-L663 HydrophobicContact CB-CD1 4.38Å; V624-L663 HydrophobicContact CB-CD2 4.15Å; V624-L663 HydrophobicContact CG1-CD2 3.75Å; K661-L663 VanDerWaalsContact C-N 3.26Å; K661-L663 PolarHBondContact O-N 2.89Å
664	M	92.5	Very high	90.3	Very high	65 Å²	65	36.6 Å²	36.6	32%	0.32	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.4	173.4	-67.1	-62.2	-67.9	0	0	109.7	A622 Y623	A622-M664 CarbonylContact C-O 3.6Å; A622-M664 WeakPolarHBondContact CA-O 3.26Å; A622-M664 WeakPolarHBondContact CB-O 3.49Å; Y623-M664 HydrophobicContact CD1-CB 4.24Å; Y623-M664 HydrophobicContact CE1-CB 3.95Å; Y623-M664 PolarHBondContact N-O 3.27Å; Y623-M664 PolarHBondContact O-N 2.9Å
665	L	93.9	Very high	90.4	Very high	12 Å²	12	33.1 Å²	33.1	6%	0.063	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	125.3	-178	-172.9	68.8	0	0	0	111.1	F591 L594 S598 T604	F591-L665 HydrophobicContact CE1-CD1 4.38Å; F591-L665 HydrophobicContact CE1-CD2 3.99Å; L594-L665 HydrophobicContact CD1-CB 3.88Å; L594-L665 HydrophobicContact CD1-CD1 4.46Å; L594-L665 HydrophobicContact CD1-CD2 4.18Å; L594-L665 HydrophobicContact CD1-CG 4.41Å; L594-L665 HydrophobicContact CD2-CB 3.91Å; S598-L665 VanDerWaalsContact OG-CB 3.31Å; S598-L665 WeakPolarHBondContact OG-CB 3.31Å; T604-L665 HydrophobicContact CG2-CD2 4.1Å
666	L	92.9	Very high	90.3	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.031	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-41.3	168.6	-68.1	167.1	0	0	0	110.9	A438 Q488 E491 F492 M495 F621 Y623	A438-L666 PolarHBondContact N-O 2.83Å; Q488-L666 HydrophobicContact CB-CD2 4.47Å; E491-L666 HydrophobicContact CB-CD1 4.47Å; E491-L666 HydrophobicContact CB-CD2 4.03Å; E491-L666 HydrophobicContact CG-CD1 3.96Å; E491-L666 HydrophobicContact CG-CD2 3.9Å; F492-L666 HydrophobicContact CB-CB 4.39Å; F492-L666 HydrophobicContact CD2-CB 3.91Å; M495-L666 HydrophobicContact SD-CD1 3.94Å; F621-L666 PolarHBondContact O-N 2.71Å; Y623-L666 HydrophobicContact CD1-CD1 3.86Å; Y623-L666 HydrophobicContact CD1-CD2 3.85Å; Y623-L666 HydrophobicContact CD1-CG 3.69Å; Y623-L666 HydrophobicContact CE1-CD2 3.67Å; Y623-L666 HydrophobicContact CE1-CG 4.02Å
667	G	93.7	Very high	90.1	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164	-159.9	-173.8	0	0	0	0	0	113.3	T436 F621	T436-G667 CarbonylContact O-C 3.57Å; T436-G667 WeakPolarHBondContact O-CA 3.49Å; F621-G667 PolarHBondContact N-O 2.93Å; F621-G667 PolarHBondContact O-N 3Å
668	A	93.7	Very high	90.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	153.7	174.6	0	0	0	0	0	112	C435 T436 T604 L608 L619	C435-A668 CarbonylContact C-O 3.17Å; C435-A668 VanDerWaalsContact CA-O 3.3Å; C435-A668 WeakPolarHBondContact CA-O 3.34Å; C435-A668 WeakPolarHBondContact CB-O 3.27Å; T436-A668 HydrophobicContact CG2-CB 3.83Å; T436-A668 PolarHBondContact N-O 2.93Å; T436-A668 PolarHBondContact O-N 3.12Å; T604-A668 HydrophobicContact CG2-CB 4.15Å; L608-A668 HydrophobicContact CD2-CB 3.76Å; L608-A668 HydrophobicContact CG-CB 4.35Å; L619-A668 CarbonylContact O-C 3.57Å; L619-A668 WeakPolarHBondContact O-CA 3.36Å; L619-A668 VanDerWaalsContact O-CB 3.29Å; L619-A668 WeakPolarHBondContact O-CB 3.28Å
669	T	92.9	Very high	90.3	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	152.5	176.8	63.5	0	0	0	0	110.9	F432 F492 M496 L523 T618 L619 F621	F432-T669 HydrophobicContact CE2-CG2 3.53Å; F432-T669 HydrophobicContact CZ-CG2 4.18Å; F492-T669 HydrophobicContact CE1-CG2 4.02Å; F492-T669 HydrophobicContact CE2-CG2 4.35Å; F492-T669 HydrophobicContact CZ-CG2 3.45Å; F492-T669 VanDerWaalsContact CZ-CG2 3.45Å; M496-T669 HydrophobicContact SD-CG2 4.28Å; L523-T669 HydrophobicContact CD2-CG2 3.83Å; T618-T669 WeakPolarHBondContact CA-O 3.48Å; L619-T669 PolarHBondContact N-O 2.83Å; L619-T669 PolarHBondContact O-N 3.35Å; F621-T669 HydrophobicContact CD2-CG2 3.97Å; F621-T669 HydrophobicContact CE2-CG2 3.47Å; F621-T669 VanDerWaalsContact CE2-CG2 3.47Å; F621-T669 WeakPolarHBondContact CE2-OG1 3.43Å; F621-T669 HydrophobicContact CZ-CG2 3.98Å
670	A	90	Very high	90.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	120.6	174	0	0	0	0	0	110.6	K433 K434 F611 L616 R617	K433-A670 PolarHBondContact N-O 3.37Å; K434-A670 HydrophobicContact CB-CB 4.09Å; K434-A670 PolarHBondContact N-O 2.95Å; K434-A670 PolarHBondContact O-N 2.82Å; F611-A670 HydrophobicContact CB-CB 4.06Å; F611-A670 HydrophobicContact CD1-CB 4.46Å; F611-A670 HydrophobicContact CD2-CB 3.62Å; F611-A670 HydrophobicContact CE2-CB 4.11Å; F611-A670 HydrophobicContact CG-CB 3.81Å; L616-A670 HydrophobicContact CB-CB 3.91Å; L616-A670 HydrophobicContact CD1-CB 3.76Å; L616-A670 HydrophobicContact CG-CB 4.47Å; R617-A670 WeakPolarHBondContact O-CA 3.34Å
671	I	88.5	Confident	90.4	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.7	-174.4	-58.4	175.5	0	0	0	109.4	M430 H431 D519 A522 L523 R617 L619	M430-I671 HydrophobicContact CB-CG2 3.8Å; H431-I671 CarbonylContact O-C 3.5Å; H431-I671 WeakPolarHBondContact O-CA 3.43Å; D519-I671 HydrophobicContact CB-CD1 4.08Å; A522-I671 HydrophobicContact CB-CG2 4.46Å; L523-I671 HydrophobicContact CD1-CD1 4.47Å; L523-I671 HydrophobicContact CD2-CD1 4.27Å; L523-I671 HydrophobicContact CG-CD1 4.06Å; R617-I671 HydrophobicContact CB-CB 4.31Å; R617-I671 WeakPolarHBondContact CB-O 3.41Å; R617-I671 PolarHBondContact N-O 2.94Å; R617-I671 PolarHBondContact O-N 3.35Å; L619-I671 HydrophobicContact CD1-CD1 4.35Å
672	E	85.9	Confident	90.7	Very high	53 Å²	53	30.1 Å²	30.1	25%	0.248	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	117	177.8	-174.3	-176.6	173.3	0	0	110.4	M430 H431 K433 L616 R674	M430-E672 WeakPolarHBondContact CA-O 3.4Å; H431-E672 PolarHBondContact N-O 2.89Å; H431-E672 PolarHBondContact O-N 3.34Å; K433-E672 HydrophobicContact CB-CB 4.1Å; K433-E672 WeakPolarHBondContact CD-OE2 3.31Å; K433-E672 WeakPolarHBondContact CE-OE2 3.22Å; K433-E672 HydrophobicContact CG-CB 4.42Å; K433-E672 IonicContact NZ-OE1 2.83Å; K433-E672 IonicContact NZ-OE2 2.73Å; K433-E672 PolarHBondContact NZ-OE2 3.26Å; L616-E672 HydrophobicContact CD2-CB 3.81Å; L616-E672 HydrophobicContact CD2-CG 4.19Å; E672-R674 PolarHBondContact O-N 3.38Å
673	D	84.2	Confident	90.8	Very high	9 Å²	9	24.9 Å²	24.9	5%	0.048	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	89.1	164.7	-175.9	-3.2	0	0	0	107.4	K421 T426 M430 R617 L675 I707	K421-D673 IonicContact NZ-OD2 3.84Å; K421-D673 PolarHBondContact NZ-OD2 3.32Å; T426-D673 WeakPolarHBondContact CB-OD1 3.48Å; T426-D673 WeakPolarHBondContact CG2-OD1 3.39Å; T426-D673 PolarHBondContact OG1-OD1 2.87Å; M430-D673 HydrophobicContact CE-CB 4.16Å; M430-D673 HydrophobicContact SD-CB 3.64Å; R617-D673 IonicContact CZ-OD2 2.68Å; R617-D673 IonicContact NE-OD2 2.69Å; R617-D673 IonicContact NH2-OD2 3.36Å; R617-D673 PolarHBondContact NH2-OD2 3.25Å; D673-L675 PolarHBondContact O-N 2.83Å; D673-I707 HydrophobicContact CB-CD1 4.15Å
674	R	84.7	Confident	90.7	Very high	115 Å²	115	26.6 Å²	26.6	43%	0.434	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	124.5	-161.1	-178.7	176.2	172.7	-171.1	-2.5	112.1	T426 C427 I429 E672	T426-R674 CarbonylContact C-O 3.53Å; T426-R674 WeakPolarHBondContact CA-O 3.42Å; T426-R674 WeakPolarHBondContact CB-O 3.17Å; C427-R674 PolarHBondContact N-O 3.18Å; I429-R674 PolarHBondContact O-N 2.8Å; E672-R674 PolarHBondContact O-N 3.38Å
675	L	88.8	Confident	90.7	Very high	32 Å²	32	23.9 Å²	23.9	17%	0.168	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	151.1	173.8	-59.8	-173.2	0	0	0	112.2	L425 T426 D673 V679 P680 I707	L425-L675 WeakPolarHBondContact O-CA 3.3Å; T426-L675 HydrophobicContact CG2-CD2 4.02Å; D673-L675 PolarHBondContact O-N 2.83Å; L675-V679 HydrophobicContact CD1-CG1 4.46Å; L675-P680 HydrophobicContact CD1-CG 3.66Å; L675-I707 HydrophobicContact CD2-CD1 4.01Å; L675-I707 HydrophobicContact CD2-CG2 4.2Å
676	Q	88.4	Confident	90.7	Very high	18 Å²	18	23.3 Å²	23.3	8%	0.084	14%	0.137	C	C	.	.	P	Polyproline II helix	trans	-63.3	153.8	165.8	-60.7	-167.4	3.8	0	0	111	G423 T424 L425 G678 V679	G423-Q676 PolarHBondContact O-NE2 3.17Å; T424-Q676 PolarHBondContact O-NE2 3.12Å; L425-Q676 PolarHBondContact O-N 3.29Å; Q676-G678 PolarHBondContact O-N 2.98Å; Q676-V679 HydrophobicContact CB-CG2 3.7Å; Q676-V679 WeakPolarHBondContact O-CG2 3.33Å; Q676-V679 PolarHBondContact O-N 3.21Å
677	A	88.1	Confident	90.6	Very high	62 Å²	62	24.8 Å²	24.8	51%	0.512	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	128.7	-179	0	0	0	0	0	112.1	V679 S850	A677-V679 VanDerWaalsContact C-N 3.31Å; A677-V679 PolarHBondContact O-N 2.84Å; A677-S850 WeakPolarHBondContact O-CB 3.16Å; A677-S850 PolarHBondContact O-OG 3.23Å
678	G	88.8	Confident	90.4	Very high	33 Å²	33	30.2 Å²	30.2	34%	0.34	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	-2.7	176.7	0	0	0	0	0	116.4	Q676 D681 T682	Q676-G678 PolarHBondContact O-N 2.98Å; G678-D681 PolarHBondContact O-N 2.89Å; G678-T682 PolarHBondContact O-N 2.63Å
679	V	93.9	Very high	90.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-51.3	-49.2	-176.4	164.7	0	0	0	0	114.3	L425 L675 Q676 A677 D681 T682 I683 C711 F849	L425-V679 HydrophobicContact CD2-CG1 3.79Å; L675-V679 HydrophobicContact CD1-CG1 4.46Å; Q676-V679 HydrophobicContact CB-CG2 3.7Å; Q676-V679 WeakPolarHBondContact O-CG2 3.33Å; Q676-V679 PolarHBondContact O-N 3.21Å; A677-V679 VanDerWaalsContact C-N 3.31Å; A677-V679 PolarHBondContact O-N 2.84Å; V679-D681 VanDerWaalsContact C-N 3.32Å; V679-D681 PolarHBondContact O-N 2.91Å; V679-T682 PolarHBondContact O-N 2.82Å; V679-I683 HydrophobicContact CG1-CD1 3.78Å; V679-I683 WeakPolarHBondContact O-CB 3.5Å; V679-I683 WeakPolarHBondContact O-CG1 3.26Å; V679-I683 PolarHBondContact O-N 3.08Å; V679-C711 HydrophobicContact CG1-CB 4.46Å; V679-C711 VanDerWaalsContact CG1-SG 3.57Å; V679-F849 HydrophobicContact CB-CD1 4.5Å; V679-F849 HydrophobicContact CG2-CB 3.89Å; V679-F849 HydrophobicContact CG2-CD1 3.86Å; V679-F849 HydrophobicContact CG2-CG 4.07Å
680	P	91.5	Very high	90.1	Very high	21 Å²	21	31.1 Å²	31.1	14%	0.136	17%	0.174	C	C	.	.	H	α-helix	trans	-65.2	-34.3	-178	-21.8	34	0	0	0	113.6	L675 A684 R712	L675-P680 HydrophobicContact CD1-CG 3.66Å; P680-A684 WeakPolarHBondContact O-CB 3.23Å; P680-A684 PolarHBondContact O-N 2.84Å; P680-R712 HydrophobicContact CB-CG 4.22Å
681	D	92.5	Very high	90.2	Very high	87 Å²	87	31.3 Å²	31.3	47%	0.465	18%	0.175	S	C	.	.	H	α-helix	trans	-78.5	-40.4	-178.6	-59.6	-52.1	0	0	0	110.7	G678 V679 A684 T685 R712	G678-D681 PolarHBondContact O-N 2.89Å; V679-D681 VanDerWaalsContact C-N 3.32Å; V679-D681 PolarHBondContact O-N 2.91Å; D681-A684 PolarHBondContact O-N 3.39Å; D681-T685 WeakPolarHBondContact O-CB 3.29Å; D681-T685 PolarHBondContact O-N 3.5Å; D681-T685 PolarHBondContact O-OG1 2.92Å; D681-R712 IonicContact OD1-CZ 2.77Å; D681-R712 IonicContact OD1-NH1 3.23Å; D681-R712 PolarHBondContact OD1-NH1 2.91Å
682	T	94.9	Very high	90.4	Very high	6 Å²	6	32.4 Å²	32.4	4%	0.037	18%	0.179	C	C	.	.	H	α-helix	trans	-63.5	-40.8	171.5	-70.7	0	0	0	0	112.3	G678 V679 T685 L686 F849 E853	G678-T682 PolarHBondContact O-N 2.63Å; V679-T682 PolarHBondContact O-N 2.82Å; T682-T685 PolarHBondContact O-N 2.98Å; T682-L686 HydrophobicContact CG2-CD1 3.74Å; T682-L686 HydrophobicContact CG2-CG 4.18Å; T682-L686 WeakPolarHBondContact O-CB 3.35Å; T682-L686 VanDerWaalsContact O-CG 3.25Å; T682-L686 WeakPolarHBondContact O-CG 3.36Å; T682-L686 PolarHBondContact O-N 3.46Å; T682-F849 HydrophobicContact CG2-CD1 4.11Å; T682-F849 HydrophobicContact CG2-CE1 3.88Å; T682-E853 VanDerWaalsContact CA-OE2 3.27Å; T682-E853 WeakPolarHBondContact CA-OE2 3.1Å; T682-E853 HydrophobicContact CG2-CB 3.87Å; T682-E853 PolarHBondContact OG1-OE2 2.69Å
683	I	94.3	Very high	90.8	Very high	1 Å²	1	30 Å²	30	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-59.7	-48.9	172.3	-78.4	172.2	0	0	0	110.7	L425 V679 T685 L686 M687 I693 C711 L713 F849	L425-I683 HydrophobicContact CD2-CD1 4.01Å; V679-I683 HydrophobicContact CG1-CD1 3.78Å; V679-I683 WeakPolarHBondContact O-CB 3.5Å; V679-I683 WeakPolarHBondContact O-CG1 3.26Å; V679-I683 PolarHBondContact O-N 3.08Å; I683-T685 VanDerWaalsContact C-N 3.27Å; I683-T685 PolarHBondContact O-N 2.89Å; I683-L686 PolarHBondContact O-N 3.37Å; I683-M687 HydrophobicContact CG2-SD 3.96Å; I683-M687 WeakPolarHBondContact O-CB 3.37Å; I683-M687 VanDerWaalsContact O-CG 3.3Å; I683-M687 WeakPolarHBondContact O-CG 3.22Å; I683-M687 PolarHBondContact O-N 3.46Å; I683-I693 HydrophobicContact CB-CD1 4.33Å; I683-I693 HydrophobicContact CG1-CD1 4.11Å; I683-I693 HydrophobicContact CG2-CD1 4.09Å; I683-C711 HydrophobicContact CD1-CB 3.69Å; I683-C711 WeakPolarHBondContact CG2-O 3.26Å; I683-L713 HydrophobicContact CG2-CB 4.34Å; I683-F849 HydrophobicContact CD1-CE1 4.4Å; I683-F849 HydrophobicContact CD1-CZ 4.47Å; I683-F849 HydrophobicContact CG1-CE1 3.91Å; I683-F849 HydrophobicContact CG1-CZ 4.13Å
684	A	91.2	Very high	91.4	Very high	37 Å²	37	29.6 Å²	29.6	31%	0.306	17%	0.166	S	C	.	.	H	α-helix	trans	-60.4	-35.8	176.2	0	0	0	0	0	112.6	P680 D681 R688	P680-A684 WeakPolarHBondContact O-CB 3.23Å; P680-A684 PolarHBondContact O-N 2.84Å; D681-A684 PolarHBondContact O-N 3.39Å; A684-R688 WeakPolarHBondContact O-CB 3.44Å; A684-R688 VanDerWaalsContact O-CG 3.24Å; A684-R688 WeakPolarHBondContact O-CG 3.27Å; A684-R688 PolarHBondContact O-N 3.31Å; A684-R688 PolarHBondContact O-NE 3.43Å
685	T	92	Very high	91.9	Very high	7 Å²	7	24.5 Å²	24.5	4%	0.043	15%	0.147	C	C	.	.	H	α-helix	trans	-69.7	-45.8	176.8	-64.5	0	0	0	0	112.8	D681 T682 I683 R688 A689 E853 L857 P936	D681-T685 WeakPolarHBondContact O-CB 3.29Å; D681-T685 PolarHBondContact O-N 3.5Å; D681-T685 PolarHBondContact O-OG1 2.92Å; T682-T685 PolarHBondContact O-N 2.98Å; I683-T685 VanDerWaalsContact C-N 3.27Å; I683-T685 PolarHBondContact O-N 2.89Å; T685-R688 WeakPolarHBondContact O-CB 3.39Å; T685-R688 PolarHBondContact O-N 3.14Å; T685-R688 PolarHBondContact OG1-NH2 2.92Å; T685-A689 PolarHBondContact O-N 2.81Å; T685-E853 WeakPolarHBondContact CB-OE2 3.14Å; T685-E853 HydrophobicContact CG2-CG 3.66Å; T685-E853 WeakPolarHBondContact CG2-OE1 3.12Å; T685-L857 HydrophobicContact CG2-CD1 3.58Å; T685-P936 HydrophobicContact CG2-CB 4.2Å; T685-P936 HydrophobicContact CG2-CG 3.58Å
686	L	93.9	Very high	92.1	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.4	-37.4	176.9	-65.2	171.1	0	0	0	111.7	L417 T682 I683 A689 G690 I691 I693 L852 L856	L417-L686 HydrophobicContact CD2-CD1 4.05Å; T682-L686 HydrophobicContact CG2-CD1 3.74Å; T682-L686 HydrophobicContact CG2-CG 4.18Å; T682-L686 WeakPolarHBondContact O-CB 3.35Å; T682-L686 VanDerWaalsContact O-CG 3.25Å; T682-L686 WeakPolarHBondContact O-CG 3.36Å; T682-L686 PolarHBondContact O-N 3.46Å; I683-L686 PolarHBondContact O-N 3.37Å; L686-A689 WeakPolarHBondContact O-CB 3.29Å; L686-A689 PolarHBondContact O-N 3.04Å; L686-G690 PolarHBondContact O-N 3.08Å; L686-I691 HydrophobicContact CB-CB 4.47Å; L686-I691 HydrophobicContact CB-CD1 4.22Å; L686-I691 HydrophobicContact CD2-CD1 3.63Å; L686-I691 WeakPolarHBondContact O-CB 3.36Å; L686-I691 PolarHBondContact O-N 3.29Å; L686-I693 HydrophobicContact CB-CD1 4.17Å; L686-L852 HydrophobicContact CD1-CD2 4.06Å; L686-L852 HydrophobicContact CD1-CG 4.38Å; L686-L856 HydrophobicContact CD2-CD1 3.95Å
687	M	91	Very high	92.1	Very high	38 Å²	38	22.1 Å²	22.1	19%	0.187	14%	0.136	C	C	.	.	H	α-helix	trans	-65.7	-40.5	171.9	-68.2	179.7	85.7	0	0	111.9	I683 A689 G690 I693 L713 K781	I683-M687 HydrophobicContact CG2-SD 3.96Å; I683-M687 WeakPolarHBondContact O-CB 3.37Å; I683-M687 VanDerWaalsContact O-CG 3.3Å; I683-M687 WeakPolarHBondContact O-CG 3.22Å; I683-M687 PolarHBondContact O-N 3.46Å; M687-A689 VanDerWaalsContact C-N 3.28Å; M687-A689 PolarHBondContact O-N 3.37Å; M687-G690 PolarHBondContact O-N 3.43Å; M687-I693 HydrophobicContact CG-CD1 3.94Å; M687-I693 HydrophobicContact CG-CG1 4.27Å; M687-L713 HydrophobicContact CE-CD1 4.28Å; M687-L713 HydrophobicContact SD-CD1 4.06Å; M687-K781 HydrophobicContact CE-CD 4.48Å; M687-K781 HydrophobicContact CE-CG 3.88Å
688	R	89.5	Confident	91.7	Very high	115 Å²	115	21.4 Å²	21.4	43%	0.434	13%	0.134	S	C	.	.	H	α-helix	trans	-59.8	-37.4	171.7	-77	-178.3	-60.6	146.2	0.6	112.1	A684 T685 G690 P936 R940	A684-R688 WeakPolarHBondContact O-CB 3.44Å; A684-R688 VanDerWaalsContact O-CG 3.24Å; A684-R688 WeakPolarHBondContact O-CG 3.27Å; A684-R688 PolarHBondContact O-N 3.31Å; A684-R688 PolarHBondContact O-NE 3.43Å; T685-R688 WeakPolarHBondContact O-CB 3.39Å; T685-R688 PolarHBondContact O-N 3.14Å; T685-R688 PolarHBondContact OG1-NH2 2.92Å; R688-G690 PolarHBondContact O-N 3.1Å; R688-P936 HydrophobicContact CB-CB 4.32Å; R688-P936 HydrophobicContact CB-CG 4.35Å; R688-R940 PolarHBondContact O-NH2 2.69Å
689	A	90	Very high	91	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.6	-24.2	174	0	0	0	0	0	113	T685 L686 M687 I691 L857 P936 Y939 R940	T685-A689 PolarHBondContact O-N 2.81Å; L686-A689 WeakPolarHBondContact O-CB 3.29Å; L686-A689 PolarHBondContact O-N 3.04Å; M687-A689 VanDerWaalsContact C-N 3.28Å; M687-A689 PolarHBondContact O-N 3.37Å; A689-I691 HydrophobicContact CB-CD1 4.4Å; A689-L857 HydrophobicContact CB-CD2 3.75Å; A689-P936 WeakPolarHBondContact CA-O 3.49Å; A689-P936 HydrophobicContact CB-CB 3.82Å; A689-Y939 HydrophobicContact CB-CD1 4.1Å; A689-Y939 HydrophobicContact CB-CG 4.48Å; A689-R940 WeakPolarHBondContact O-CG 3.47Å; A689-R940 PolarHBondContact O-NE 3.46Å
690	G	89.6	Confident	90	Very high	19 Å²	19	23.9 Å²	23.9	20%	0.196	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	26.9	-174.4	0	0	0	0	0	113.4	L686 M687 R688 Q943	L686-G690 PolarHBondContact O-N 3.08Å; M687-G690 PolarHBondContact O-N 3.43Å; R688-G690 PolarHBondContact O-N 3.1Å; G690-Q943 PolarHBondContact O-NE2 2.9Å
691	I	93.3	Very high	89.5	Confident	4 Å²	4	24.4 Å²	24.4	2%	0.021	14%	0.138	C	C	.	.			trans	-90.7	125.2	168.7	-60.7	162.7	0	0	0	107.7	L417 L686 A689 L856 Y939	L417-I691 HydrophobicContact CB-CG2 3.81Å; L686-I691 HydrophobicContact CB-CB 4.47Å; L686-I691 HydrophobicContact CB-CD1 4.22Å; L686-I691 HydrophobicContact CD2-CD1 3.63Å; L686-I691 WeakPolarHBondContact O-CB 3.36Å; L686-I691 PolarHBondContact O-N 3.29Å; A689-I691 HydrophobicContact CB-CD1 4.4Å; I691-L856 HydrophobicContact CD1-CD1 4.08Å; I691-Y939 HydrophobicContact CD1-CD1 4.27Å; I691-Y939 HydrophobicContact CD1-CE1 3.74Å; I691-Y939 HydrophobicContact CG1-CD1 4.36Å; I691-Y939 HydrophobicContact CG1-CE1 3.88Å
692	K	92.4	Very high	88.7	Confident	23 Å²	23	23.1 Å²	23.1	10%	0.1	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	131.6	172	-70.8	-162	169.7	-156.3	0	109.5	K415 Y416 L417 L778 C780	K415-K692 PolarHBondContact O-N 3.07Å; Y416-K692 WeakPolarHBondContact CA-O 3.43Å; Y416-K692 HydrophobicContact CD1-CB 3.87Å; Y416-K692 HydrophobicContact CE1-CB 3.88Å; Y416-K692 HydrophobicContact CE1-CD 3.85Å; Y416-K692 HydrophobicContact CE1-CG 4.3Å; L417-K692 PolarHBondContact N-O 2.78Å; K692-L778 PolarHBondContact NZ-O 3.33Å; K692-C780 PolarHBondContact NZ-O 2.98Å
693	I	94.7	Very high	87.9	Confident	2 Å²	2	23.1 Å²	23.1	1%	0.01	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.8	-176	-49.9	-176.4	0	0	0	109.4	L417 I683 L686 M687 L713	L417-I693 HydrophobicContact CB-CG1 4.32Å; L417-I693 HydrophobicContact CD2-CD1 4.2Å; L417-I693 HydrophobicContact CD2-CG1 4.18Å; L417-I693 HydrophobicContact CD2-CG2 4.17Å; L417-I693 HydrophobicContact CG-CG2 4.33Å; L417-I693 WeakPolarHBondContact O-CA 3.46Å; I683-I693 HydrophobicContact CB-CD1 4.33Å; I683-I693 HydrophobicContact CG1-CD1 4.11Å; I683-I693 HydrophobicContact CG2-CD1 4.09Å; L686-I693 HydrophobicContact CB-CD1 4.17Å; M687-I693 HydrophobicContact CG-CD1 3.94Å; M687-I693 HydrophobicContact CG-CG1 4.27Å; I693-L713 HydrophobicContact CB-CD1 3.93Å; I693-L713 HydrophobicContact CG2-CD1 4.3Å
694	W	95.9	Very high	87.4	Confident	1 Å²	1	23.2 Å²	23.2	0%	0.004	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126.5	178.5	-69.3	26.5	0	0	0	108.1	L417 F418 S419 A777 V783 I796 V800	L417-W694 PolarHBondContact O-N 2.81Å; F418-W694 WeakPolarHBondContact CA-O 3.43Å; F418-W694 HydrophobicContact CD1-CB 3.82Å; F418-W694 HydrophobicContact CD1-CE3 4.32Å; F418-W694 HydrophobicContact CD1-CG 4.38Å; F418-W694 HydrophobicContact CE1-CB 4.08Å; F418-W694 AromaticContact CE1-CD2 3.87Å; F418-W694 HydrophobicContact CE1-CD2 3.87Å; F418-W694 AromaticContact CE1-CE3 3.58Å; F418-W694 HydrophobicContact CE1-CE3 3.58Å; F418-W694 HydrophobicContact CE1-CG 4.14Å; F418-W694 HydrophobicContact CE1-CZ3 4.25Å; S419-W694 PolarHBondContact N-O 2.74Å; W694-A777 HydrophobicContact CH2-CB 3.48Å; W694-A777 VanDerWaalsContact CH2-CB 3.48Å; W694-A777 HydrophobicContact CZ2-CB 3.74Å; W694-A777 HydrophobicContact CZ3-CB 4.26Å; W694-V783 CarbonylContact C-O 3.52Å; W694-V783 VanDerWaalsContact CA-O 3.3Å; W694-V783 WeakPolarHBondContact CA-O 3.46Å; W694-V783 HydrophobicContact CB-CB 4.31Å; W694-V783 HydrophobicContact CD2-CB 3.75Å; W694-V783 HydrophobicContact CD2-CG1 4.2Å; W694-V783 HydrophobicContact CD2-CG2 3.87Å; W694-V783 HydrophobicContact CE3-CB 4.21Å; W694-V783 HydrophobicContact CE3-CG1 4.13Å; W694-V783 HydrophobicContact CE3-CG2 4.46Å; W694-V783 HydrophobicContact CG-CB 3.76Å; W694-V783 HydrophobicContact CG-CG2 4.13Å; W694-V783 HydrophobicContact CZ2-CG2 4.03Å; W694-I796 HydrophobicContact CE3-CG2 3.93Å; W694-I796 HydrophobicContact CZ3-CG2 3.82Å; W694-V800 HydrophobicContact CH2-CG2 3.68Å; W694-V800 HydrophobicContact CZ2-CG2 4.4Å; W694-V800 HydrophobicContact CZ3-CG2 3.82Å
695	V	95.6	Very high	87	Confident	8 Å²	8	22 Å²	22	5%	0.048	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	123.8	179.2	177.5	0	0	0	0	109.2	S419 K421 L425 L713 V783 I784 C785	S419-V695 CarbonylContact O-C 3.54Å; S419-V695 WeakPolarHBondContact O-CA 3.4Å; K421-V695 HydrophobicContact CB-CG1 4.12Å; L425-V695 HydrophobicContact CD1-CG1 4.49Å; L425-V695 HydrophobicContact CD1-CG2 4.06Å; V695-L713 HydrophobicContact CG2-CD2 3.53Å; V695-V783 PolarHBondContact N-O 3.34Å; V695-I784 CarbonylContact O-C 3.5Å; V695-I784 WeakPolarHBondContact O-CA 3.35Å; V695-C785 PolarHBondContact O-N 2.82Å
696	L	93.6	Very high	86.5	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	82	-171.7	-57.7	-169	0	0	0	110.8	F418 S419 C785 V788 K793 I796 V797 M820	F418-L696 HydrophobicContact CB-CD1 4.29Å; F418-L696 HydrophobicContact CD1-CD1 3.75Å; F418-L696 HydrophobicContact CD1-CG 4.26Å; F418-L696 HydrophobicContact CG-CD1 4.39Å; S419-L696 PolarHBondContact O-N 3.01Å; L696-C785 HydrophobicContact CD2-CB 3.69Å; L696-C785 VanDerWaalsContact CD2-SG 3.57Å; L696-V788 HydrophobicContact CB-CG2 4.23Å; L696-K793 HydrophobicContact CB-CD 4.41Å; L696-K793 HydrophobicContact CB-CG 4.23Å; L696-K793 HydrophobicContact CD1-CB 4.47Å; L696-K793 WeakPolarHBondContact O-CD 3.29Å; L696-K793 WeakPolarHBondContact O-CE 3.33Å; L696-K793 PolarHBondContact O-NZ 3.03Å; L696-I796 HydrophobicContact CD1-CB 4.18Å; L696-I796 HydrophobicContact CD1-CD1 4.1Å; L696-I796 HydrophobicContact CD1-CG2 4.06Å; L696-I796 HydrophobicContact CD2-CD1 3.86Å; L696-I796 HydrophobicContact CD2-CG2 4.37Å; L696-V797 HydrophobicContact CD1-CG2 4.49Å; L696-M820 HydrophobicContact CB-SD 4.37Å; L696-M820 HydrophobicContact CD1-SD 3.9Å
697	T	87.8	Confident	86	Confident	1 Å²	1	22.5 Å²	22.5	1%	0.006	12%	0.12	C	C	.	.			trans	-112.2	148.8	-168.6	-172.5	0	0	0	0	114.6	D420 K421 D699 A704 C785 C786 R787 V788	D420-T697 WeakPolarHBondContact OD1-CA 3.37Å; K421-T697 HydrophobicContact CB-CG2 4.31Å; T697-D699 HydrophobicContact CG2-CB 4.02Å; T697-D699 PolarHBondContact O-N 2.89Å; T697-D699 PolarHBondContact OG1-N 2.97Å; T697-A704 HydrophobicContact CG2-CB 3.84Å; T697-C785 PolarHBondContact N-O 3.44Å; T697-C786 CarbonylContact O-C 3.56Å; T697-R787 PolarHBondContact O-N 3.38Å; T697-V788 WeakPolarHBondContact O-CG2 3.3Å; T697-V788 PolarHBondContact O-N 2.92Å
698	G	79.5	Confident	85.9	Confident	46 Å²	46	20.8 Å²	20.8	47%	0.474	11%	0.113	S	C	.	.	S	Bend	trans	-73	-11.8	168.4	0	0	0	0	0	114.1	R787	G698-R787 WeakPolarHBondContact O-CA 3.39Å
699	D	74.4	Confident	85.6	Confident	35 Å²	35	17.5 Å²	17.5	19%	0.187	10%	0.101	C	C	.	.	S	Bend	trans	-65.9	162.1	-175.5	-91.8	8.8	0	0	0	114.3	K421 T697 T703 R787	K421-D699 WeakPolarHBondContact CD-OD2 3.45Å; K421-D699 WeakPolarHBondContact CE-OD2 3.4Å; K421-D699 IonicContact NZ-OD2 3Å; K421-D699 PolarHBondContact NZ-OD2 3.43Å; T697-D699 HydrophobicContact CG2-CB 4.02Å; T697-D699 PolarHBondContact O-N 2.89Å; T697-D699 PolarHBondContact OG1-N 2.97Å; D699-T703 WeakPolarHBondContact OD2-CG2 3.39Å; D699-R787 WeakPolarHBondContact O-CG 3.42Å; D699-R787 PolarHBondContact O-N 3.07Å
700	K	71.8	Confident	85.4	Confident	50 Å²	50	19.2 Å²	19.2	22%	0.217	11%	0.113	C	C	.	.			trans	-62.5	147.7	169.4	-60.2	-176.7	-178.1	-177.2	0	110.1	S563 E702 T703 A704 E1157	S563-K700 PolarHBondContact OG-NZ 3.06Å; K700-E702 VanDerWaalsContact C-N 3.31Å; K700-E702 PolarHBondContact O-N 3.14Å; K700-T703 PolarHBondContact O-N 2.87Å; K700-A704 PolarHBondContact O-N 3.08Å; K700-E1157 IonicContact NZ-OE1 2.7Å; K700-E1157 PolarHBondContact NZ-OE1 3.18Å
701	Q	80.7	Confident	85.3	Confident	32 Å²	32	18.4 Å²	18.4	15%	0.15	10%	0.104	C	C	.	.	H	α-helix	trans	-61.4	-39.1	-170.9	175.6	-179.9	-21.4	0	0	112.6	T703 A704 I705 N724 I755 C786	Q701-T703 PolarHBondContact O-N 3.36Å; Q701-A704 PolarHBondContact O-N 2.85Å; Q701-I705 HydrophobicContact CG-CD1 3.82Å; Q701-I705 HydrophobicContact CG-CG1 4.41Å; Q701-I705 WeakPolarHBondContact O-CG1 3.09Å; Q701-I705 PolarHBondContact O-N 3.39Å; Q701-N724 PolarHBondContact OE1-ND2 3.44Å; Q701-I755 HydrophobicContact CG-CG2 3.87Å; Q701-C786 HydrophobicContact CB-CB 4.15Å
702	E	77.1	Confident	85	Confident	61 Å²	61	24.7 Å²	24.7	29%	0.285	13%	0.127	S	C	.	.	H	α-helix	trans	-57.1	-49.3	178.4	-55.9	97.1	135.1	0	0	110.7	K566 K700 A704 I705 N706 Y1151	K566-E702 IonicContact NZ-OE1 3.09Å; K566-E702 PolarHBondContact NZ-OE1 2.9Å; K700-E702 VanDerWaalsContact C-N 3.31Å; K700-E702 PolarHBondContact O-N 3.14Å; E702-A704 PolarHBondContact O-N 2.67Å; E702-I705 PolarHBondContact O-N 3.09Å; E702-N706 PolarHBondContact O-N 3.01Å; E702-N706 PolarHBondContact O-OD1 3.32Å; E702-Y1151 WeakPolarHBondContact CB-O 3.3Å
703	T	77.4	Confident	84.8	Confident	6 Å²	6	23.7 Å²	23.7	4%	0.037	12%	0.123	C	C	.	.	H	α-helix	trans	-60.5	-43.4	176	-46.3	0	0	0	0	112.5	D699 K700 Q701 I705 N706 I707	D699-T703 WeakPolarHBondContact OD2-CG2 3.39Å; K700-T703 PolarHBondContact O-N 2.87Å; Q701-T703 PolarHBondContact O-N 3.36Å; T703-I705 VanDerWaalsContact C-N 3.34Å; T703-I705 PolarHBondContact O-N 2.84Å; T703-N706 PolarHBondContact O-N 3.28Å; T703-I707 PolarHBondContact O-N 2.97Å
704	A	83.9	Confident	84.4	Confident	3 Å²	3	23.8 Å²	23.8	3%	0.025	12%	0.124	C	C	.	.	H	α-helix	trans	-67.1	-34.7	-178.3	0	0	0	0	0	112.5	T697 K700 Q701 E702 G708 I784	T697-A704 HydrophobicContact CG2-CB 3.84Å; K700-A704 PolarHBondContact O-N 3.08Å; Q701-A704 PolarHBondContact O-N 2.85Å; E702-A704 PolarHBondContact O-N 2.67Å; A704-G708 PolarHBondContact O-N 3.31Å; A704-I784 HydrophobicContact CB-CG2 3.78Å
705	I	83.8	Confident	83.8	Confident	11 Å²	11	26.5 Å²	26.5	6%	0.056	14%	0.141	C	C	.	.	H	α-helix	trans	-69.2	-45.8	173.4	-69.7	170.9	0	0	0	110.8	Q701 E702 T703 I707 G708 Y709 I755	Q701-I705 HydrophobicContact CG-CD1 3.82Å; Q701-I705 HydrophobicContact CG-CG1 4.41Å; Q701-I705 WeakPolarHBondContact O-CG1 3.09Å; Q701-I705 PolarHBondContact O-N 3.39Å; E702-I705 PolarHBondContact O-N 3.09Å; T703-I705 VanDerWaalsContact C-N 3.34Å; T703-I705 PolarHBondContact O-N 2.84Å; I705-I707 PolarHBondContact O-N 3.21Å; I705-G708 WeakPolarHBondContact O-CA 3.49Å; I705-G708 PolarHBondContact O-N 3.39Å; I705-Y709 HydrophobicContact CG2-CD2 3.93Å; I705-Y709 HydrophobicContact CG2-CE2 3.66Å; I705-Y709 WeakPolarHBondContact O-CD2 3.35Å; I705-Y709 PolarHBondContact O-N 3.4Å; I705-I755 HydrophobicContact CD1-CG1 4.43Å; I705-I755 HydrophobicContact CD1-CG2 4.46Å; I705-I755 HydrophobicContact CG1-CG1 4.26Å
706	N	80.3	Confident	82.8	Confident	9 Å²	9	32.5 Å²	32.5	5%	0.048	17%	0.168	C	C	.	.	H	α-helix	trans	-58.1	-49.4	178.2	-71.9	7.9	0	0	0	111.2	E702 T703 G708 Y709 S710 G1150	E702-N706 PolarHBondContact O-N 3.01Å; E702-N706 PolarHBondContact O-OD1 3.32Å; T703-N706 PolarHBondContact O-N 3.28Å; N706-G708 VanDerWaalsContact C-N 3.27Å; N706-G708 PolarHBondContact O-N 2.71Å; N706-Y709 PolarHBondContact O-N 2.85Å; N706-Y709 VanDerWaalsContact O-N 3.1Å; N706-S710 PolarHBondContact O-N 3.37Å; N706-S710 PolarHBondContact O-OG 2.88Å; N706-S710 VanDerWaalsContact O-OG 3.09Å; N706-G1150 PolarHBondContact ND2-O 3.37Å
707	I	84.9	Confident	81.8	Confident	8 Å²	8	35.8 Å²	35.8	4%	0.041	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-33.3	174.3	-64.3	-56.8	0	0	0	111.8	K421 T426 D673 L675 T703 I705 Y709 S710 C711	K421-I707 HydrophobicContact CD-CB 4.42Å; K421-I707 HydrophobicContact CD-CG1 4Å; K421-I707 HydrophobicContact CG-CB 4.15Å; K421-I707 HydrophobicContact CG-CG1 4.22Å; K421-I707 HydrophobicContact CG-CG2 3.82Å; T426-I707 HydrophobicContact CG2-CD1 3.76Å; T426-I707 HydrophobicContact CG2-CG1 4.08Å; T426-I707 HydrophobicContact CG2-CG2 4.33Å; D673-I707 HydrophobicContact CB-CD1 4.15Å; L675-I707 HydrophobicContact CD2-CD1 4.01Å; L675-I707 HydrophobicContact CD2-CG2 4.2Å; T703-I707 PolarHBondContact O-N 2.97Å; I705-I707 PolarHBondContact O-N 3.21Å; I707-Y709 VanDerWaalsContact C-N 3.29Å; I707-Y709 PolarHBondContact O-N 2.94Å; I707-S710 PolarHBondContact O-N 2.75Å; I707-C711 WeakPolarHBondContact O-CB 3.44Å; I707-C711 PolarHBondContact O-N 3.04Å; I707-C711 PolarHBondContact O-SG 3.48Å; I707-C711 VanDerWaalsContact O-SG 3.39Å
708	G	87.6	Confident	81.6	Confident	3 Å²	3	36.5 Å²	36.5	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-56.4	-39.3	171.5	0	0	0	0	0	113.5	A704 I705 N706 L713 V714	A704-G708 PolarHBondContact O-N 3.31Å; I705-G708 WeakPolarHBondContact O-CA 3.49Å; I705-G708 PolarHBondContact O-N 3.39Å; N706-G708 VanDerWaalsContact C-N 3.27Å; N706-G708 PolarHBondContact O-N 2.71Å; G708-L713 PolarHBondContact O-N 2.92Å; G708-V714 PolarHBondContact O-N 3.45Å
709	Y	84.3	Confident	81.8	Confident	45 Å²	45	38 Å²	38	18%	0.176	21%	0.209	C	C	.	.	H	α-helix	trans	-75	-47.8	172.8	-75.4	-70.1	0	0	0	112.5	I705 N706 I707 C711 R712 V714 H716	I705-Y709 HydrophobicContact CG2-CD2 3.93Å; I705-Y709 HydrophobicContact CG2-CE2 3.66Å; I705-Y709 WeakPolarHBondContact O-CD2 3.35Å; I705-Y709 PolarHBondContact O-N 3.4Å; N706-Y709 PolarHBondContact O-N 2.85Å; N706-Y709 VanDerWaalsContact O-N 3.1Å; I707-Y709 VanDerWaalsContact C-N 3.29Å; I707-Y709 PolarHBondContact O-N 2.94Å; Y709-C711 VanDerWaalsContact C-N 3.28Å; Y709-C711 PolarHBondContact O-N 2.65Å; Y709-R712 WeakPolarHBondContact O-CA 3.17Å; Y709-R712 PolarHBondContact O-N 3.36Å; Y709-V714 HydrophobicContact CD1-CB 4.22Å; Y709-V714 HydrophobicContact CD1-CG1 4.14Å; Y709-V714 HydrophobicContact CE1-CB 4.2Å; Y709-V714 HydrophobicContact CE1-CG1 3.61Å; Y709-V714 HydrophobicContact CE2-CG1 4.34Å; Y709-H716 AromaticContact CD1-CE1 3.9Å; Y709-H716 AromaticContact CE1-CE1 3.94Å; Y709-H716 AromaticContact CE1-ND1 3.67Å
710	S	84.3	Confident	82.4	Confident	36 Å²	36	38.5 Å²	38.5	25%	0.252	21%	0.211	S	C	.	.	H	α-helix	trans	-58.6	-38.7	-179.8	-51.4	0	0	0	0	112.5	N706 I707 R712	N706-S710 PolarHBondContact O-N 3.37Å; N706-S710 PolarHBondContact O-OG 2.88Å; N706-S710 VanDerWaalsContact O-OG 3.09Å; I707-S710 PolarHBondContact O-N 2.75Å; S710-R712 PolarHBondContact O-N 3.4Å
711	C	87.7	Confident	83.3	Confident	2 Å²	2	37 Å²	37	1%	0.014	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-2.3	174.6	-73.1	0	0	0	0	114.3	V679 I683 I707 Y709 L713	V679-C711 HydrophobicContact CG1-CB 4.46Å; V679-C711 VanDerWaalsContact CG1-SG 3.57Å; I683-C711 HydrophobicContact CD1-CB 3.69Å; I683-C711 WeakPolarHBondContact CG2-O 3.26Å; I707-C711 WeakPolarHBondContact O-CB 3.44Å; I707-C711 PolarHBondContact O-N 3.04Å; I707-C711 PolarHBondContact O-SG 3.48Å; I707-C711 VanDerWaalsContact O-SG 3.39Å; Y709-C711 VanDerWaalsContact C-N 3.28Å; Y709-C711 PolarHBondContact O-N 2.65Å; C711-L713 HydrophobicContact CB-CB 4.49Å; C711-L713 PolarHBondContact O-N 3.24Å; C711-L713 VanDerWaalsContact O-N 3.1Å
712	R	87.3	Confident	83.8	Confident	136 Å²	136	38.3 Å²	38.3	51%	0.513	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	19.2	-172.3	-53.1	176.2	-173.5	145.6	-1.5	114.7	P680 D681 Y709 S710	P680-R712 HydrophobicContact CB-CG 4.22Å; D681-R712 IonicContact OD1-CZ 2.77Å; D681-R712 IonicContact OD1-NH1 3.23Å; D681-R712 PolarHBondContact OD1-NH1 2.91Å; Y709-R712 WeakPolarHBondContact O-CA 3.17Å; Y709-R712 PolarHBondContact O-N 3.36Å; S710-R712 PolarHBondContact O-N 3.4Å
713	L	88.8	Confident	84.4	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.01	20%	0.199	C	C	.	.	S	Bend	trans	-69.5	-39.9	174.2	175.7	64.2	0	0	0	110.5	I683 M687 I693 V695 G708 C711 A782 I784	I683-L713 HydrophobicContact CG2-CB 4.34Å; M687-L713 HydrophobicContact CE-CD1 4.28Å; M687-L713 HydrophobicContact SD-CD1 4.06Å; I693-L713 HydrophobicContact CB-CD1 3.93Å; I693-L713 HydrophobicContact CG2-CD1 4.3Å; V695-L713 HydrophobicContact CG2-CD2 3.53Å; G708-L713 PolarHBondContact O-N 2.92Å; C711-L713 HydrophobicContact CB-CB 4.49Å; C711-L713 PolarHBondContact O-N 3.24Å; C711-L713 VanDerWaalsContact O-N 3.1Å; L713-A782 HydrophobicContact CD1-CB 3.71Å; L713-A782 HydrophobicContact CD2-CB 4.41Å; L713-A782 HydrophobicContact CG-CB 3.77Å; L713-I784 HydrophobicContact CD2-CG1 4.44Å
714	V	86.4	Confident	84.9	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.024	22%	0.216	C	C	.	.	S	Bend	trans	-105.1	144.1	169.1	-173.6	0	0	0	0	108	G708 Y709 L720 A753 I784	G708-V714 PolarHBondContact O-N 3.45Å; Y709-V714 HydrophobicContact CD1-CB 4.22Å; Y709-V714 HydrophobicContact CD1-CG1 4.14Å; Y709-V714 HydrophobicContact CE1-CB 4.2Å; Y709-V714 HydrophobicContact CE1-CG1 3.61Å; Y709-V714 HydrophobicContact CE2-CG1 4.34Å; V714-L720 HydrophobicContact CG1-CD2 3.66Å; V714-A753 HydrophobicContact CG1-CB 4.48Å; V714-A753 HydrophobicContact CG2-CB 4.19Å; V714-I784 HydrophobicContact CG2-CD1 3.91Å
715	T	81.8	Confident	85.2	Confident	59 Å²	59	40.8 Å²	40.8	36%	0.362	23%	0.226	S	C	.	.			trans	-132	153.3	175.8	65.8	0	0	0	0	109.8	G717 M718	T715-G717 PolarHBondContact O-N 3.44Å; T715-M718 HydrophobicContact CG2-CE 4.18Å; T715-M718 WeakPolarHBondContact O-CB 3.3Å; T715-M718 PolarHBondContact O-N 3.36Å; T715-M718 WeakPolarHBondContact OG1-CG 3.38Å
716	H	74.7	Confident	85.4	Confident	134 Å²	134	46.4 Å²	46.4	62%	0.62	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-11	-176.7	-52.4	-71	0	0	0	114.9	Y709	Y709-H716 AromaticContact CD1-CE1 3.9Å; Y709-H716 AromaticContact CE1-CE1 3.94Å; Y709-H716 AromaticContact CE1-ND1 3.67Å
717	G	73.8	Confident	85.8	Confident	69 Å²	69	48.5 Å²	48.5	71%	0.711	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.6	172.7	0	0	0	0	0	115.3	T715	T715-G717 PolarHBondContact O-N 3.44Å
718	M	82.6	Confident	86	Confident	15 Å²	15	50.5 Å²	50.5	7%	0.074	28%	0.282	C	S	.	.	S	Bend	trans	-95.4	138.8	176.8	-62.8	170.3	-179.1	0	0	110.6	T715 E751 K781	T715-M718 HydrophobicContact CG2-CE 4.18Å; T715-M718 WeakPolarHBondContact O-CB 3.3Å; T715-M718 PolarHBondContact O-N 3.36Å; T715-M718 WeakPolarHBondContact OG1-CG 3.38Å; M718-E751 WeakPolarHBondContact CA-O 3.42Å; M718-E751 HydrophobicContact CG-CB 4.43Å; M718-K781 HydrophobicContact CE-CD 3.98Å
719	S	84.9	Confident	86.1	Confident	78 Å²	78	55.5 Å²	55.5	55%	0.545	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	134.3	170.7	-56.3	0	0	0	0	110.5	E751 L752 A753	S719-E751 PolarHBondContact N-O 3.2Å; S719-L752 WeakPolarHBondContact O-CA 3.46Å; S719-A753 PolarHBondContact O-N 3.08Å
720	L	87.6	Confident	86.3	Confident	46 Å²	46	54.8 Å²	54.8	24%	0.241	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	134.6	174.6	-50.1	-171.4	0	0	0	110	V714 A753 I755 V1147	V714-L720 HydrophobicContact CG1-CD2 3.66Å; L720-A753 HydrophobicContact CD2-CB 4Å; L720-I755 HydrophobicContact CB-CD1 3.91Å; L720-I755 HydrophobicContact CD1-CD1 4.4Å; L720-I755 HydrophobicContact CD2-CD1 4.17Å; L720-I755 HydrophobicContact CG-CD1 4.37Å; L720-V1147 HydrophobicContact CD1-CG2 4.44Å
721	I	90.3	Very high	86.6	Confident	18 Å²	18	53 Å²	53	9%	0.092	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	109.7	166.7	-60.7	178.3	0	0	0	106.1	V723 L752 A753 L754 I755 L776	I721-V723 HydrophobicContact CG2-CG2 3.9Å; I721-L752 HydrophobicContact CD1-CD1 4.21Å; I721-A753 PolarHBondContact N-O 3.4Å; I721-L754 HydrophobicContact CB-CD1 4.15Å; I721-L754 HydrophobicContact CG2-CD1 3.86Å; I721-I755 PolarHBondContact O-N 2.91Å; I721-L776 HydrophobicContact CD1-CD1 4.21Å
722	I	90	Very high	86.7	Confident	59 Å²	59	56.8 Å²	56.8	30%	0.303	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	128.6	177.7	-60.3	171	0	0	0	107.7	I755	I722-I755 WeakPolarHBondContact CA-O 3.29Å; I722-I755 HydrophobicContact CG1-CB 4.25Å; I722-I755 HydrophobicContact CG1-CD1 4.22Å
723	V	89.3	Confident	86.8	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.006	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	95.2	-177.5	-167.4	0	0	0	0	109.2	I721 E725 T734 L735 L754 I755 T760	I721-V723 HydrophobicContact CG2-CG2 3.9Å; V723-E725 HydrophobicContact CG1-CG 4.38Å; V723-T734 HydrophobicContact CG1-CG2 4.01Å; V723-L735 HydrophobicContact CG1-CD2 4.38Å; V723-L754 HydrophobicContact CG2-CD1 3.82Å; V723-I755 PolarHBondContact N-O 3.38Å; V723-T760 HydrophobicContact CG1-CG2 4Å; V723-T760 PolarHBondContact O-OG1 2.71Å
724	N	88.8	Confident	86.8	Confident	73 Å²	73	54.3 Å²	54.3	39%	0.39	32%	0.318	S	S	.	.			trans	-127.3	108.8	-177.8	-64.9	10	0	0	0	108.4	Q701 T760	Q701-N724 PolarHBondContact OE1-ND2 3.44Å; N724-T760 WeakPolarHBondContact CA-OG1 3.33Å
725	E	90.1	Very high	86.9	Confident	48 Å²	48	54.1 Å²	54.1	22%	0.224	32%	0.317	C	S	.	.			trans	-144.7	122.6	-167.1	-61.2	-71.5	-176.9	0	0	111.2	V723 S727 A730 T734 T760	V723-E725 HydrophobicContact CG1-CG 4.38Å; E725-S727 PolarHBondContact O-N 2.86Å; E725-A730 HydrophobicContact CB-CB 4.37Å; E725-A730 VanDerWaalsContact OE2-CB 3.29Å; E725-A730 WeakPolarHBondContact OE2-CB 3.37Å; E725-T734 VanDerWaalsContact OE1-CB 3.24Å; E725-T734 WeakPolarHBondContact OE1-CB 3.22Å; E725-T734 PolarHBondContact OE1-OG1 3.28Å; E725-T760 HydrophobicContact CB-CG2 3.93Å; E725-T760 HydrophobicContact CG-CG2 4.26Å; E725-T760 PolarHBondContact N-OG1 2.91Å; E725-T760 PolarHBondContact O-OG1 3.35Å
726	D	87.7	Confident	87.2	Confident	130 Å²	130	54.8 Å²	54.8	70%	0.695	32%	0.321	S	S	*	.	S	Bend	trans	-75	-4.7	-178.1	-68.9	-64.9	0	0	0	114.7	Q759 Y763	D726-Q759 PolarHBondContact OD1-NE2 3.3Å; D726-Y763 PolarHBondContact O-OH 3.05Å
727	S	89.8	Confident	87.8	Confident	52 Å²	52	52.7 Å²	52.7	36%	0.364	32%	0.318	S	S	.	.	S	Bend	trans	-142.3	154.4	-175.7	73.7	0	0	0	0	114.1	E725 D729 A730 T731	E725-S727 PolarHBondContact O-N 2.86Å; S727-D729 PolarHBondContact O-N 3.29Å; S727-A730 VanDerWaalsContact OG-CB 3.26Å; S727-A730 WeakPolarHBondContact OG-CB 3.03Å; S727-A730 PolarHBondContact OG-N 3.23Å; S727-T731 WeakPolarHBondContact O-CB 3.37Å; S727-T731 PolarHBondContact O-N 3.04Å; S727-T731 PolarHBondContact O-OG1 3.09Å
728	L	88.5	Confident	88.4	Confident	51 Å²	51	52 Å²	52	27%	0.267	30%	0.296	S	S	.	.	H	α-helix	trans	-64.5	-38.8	-179.8	-172.5	150.4	0	0	0	112.6	T731 R732 Y763 L769	L728-T731 WeakPolarHBondContact O-CB 3.38Å; L728-T731 PolarHBondContact O-N 3.31Å; L728-R732 VanDerWaalsContact CD2-NH2 3.28Å; L728-R732 PolarHBondContact O-N 3.38Å; L728-Y763 HydrophobicContact CB-CD1 3.82Å; L728-Y763 HydrophobicContact CB-CE1 4.48Å; L728-Y763 HydrophobicContact CB-CG 4.12Å; L728-Y763 HydrophobicContact CD1-CD1 4.35Å; L728-Y763 HydrophobicContact CG-CD1 4.46Å; L728-L769 HydrophobicContact CD2-CD1 4.45Å; L728-L769 HydrophobicContact CG-CD1 4.21Å
729	D	88.9	Confident	88.5	Confident	107 Å²	107	52.3 Å²	52.3	57%	0.572	30%	0.3	S	S	*	.	H	α-helix	trans	-72.5	-37.7	-179	-62.9	-51.5	0	0	0	112.2	S727 R732 A733	S727-D729 PolarHBondContact O-N 3.29Å; D729-R732 PolarHBondContact O-N 3.48Å; D729-R732 IonicContact OD1-CZ 2.66Å; D729-R732 IonicContact OD1-NH1 3.18Å; D729-R732 PolarHBondContact OD1-NH1 2.77Å; D729-R732 IonicContact OD1-NH2 3.92Å; D729-A733 PolarHBondContact O-N 2.92Å
730	A	89.8	Confident	88.5	Confident	30 Å²	30	52.8 Å²	52.8	25%	0.248	30%	0.303	C	S	.	.	H	α-helix	trans	-65.4	-44.8	170.7	0	0	0	0	0	111.2	E725 S727 R732 A733 T734	E725-A730 HydrophobicContact CB-CB 4.37Å; E725-A730 VanDerWaalsContact OE2-CB 3.29Å; E725-A730 WeakPolarHBondContact OE2-CB 3.37Å; S727-A730 VanDerWaalsContact OG-CB 3.26Å; S727-A730 WeakPolarHBondContact OG-CB 3.03Å; S727-A730 PolarHBondContact OG-N 3.23Å; A730-R732 VanDerWaalsContact C-N 3.28Å; A730-R732 PolarHBondContact O-N 3.04Å; A730-A733 PolarHBondContact O-N 2.82Å; A730-A733 VanDerWaalsContact O-N 3.07Å; A730-T734 PolarHBondContact O-N 2.82Å; A730-T734 PolarHBondContact O-OG1 3.25Å
731	T	89.9	Confident	88.3	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-53.9	-43.8	171.7	-52.7	0	0	0	0	111.5	S727 L728 L735 T760 A764 L769	S727-T731 WeakPolarHBondContact O-CB 3.37Å; S727-T731 PolarHBondContact O-N 3.04Å; S727-T731 PolarHBondContact O-OG1 3.09Å; L728-T731 WeakPolarHBondContact O-CB 3.38Å; L728-T731 PolarHBondContact O-N 3.31Å; T731-L735 HydrophobicContact CG2-CD1 3.85Å; T731-L735 HydrophobicContact CG2-CG 4.31Å; T731-L735 VanDerWaalsContact O-CB 3.32Å; T731-L735 WeakPolarHBondContact O-CB 3.3Å; T731-L735 VanDerWaalsContact O-CG 3.27Å; T731-L735 WeakPolarHBondContact O-CG 3.27Å; T731-L735 PolarHBondContact O-N 2.99Å; T731-T760 HydrophobicContact CG2-CG2 3.77Å; T731-A764 HydrophobicContact CG2-CB 4.25Å; T731-L769 HydrophobicContact CG2-CD1 3.84Å
732	R	90.2	Very high	87.8	Confident	80 Å²	80	54 Å²	54	30%	0.302	32%	0.315	S	S	.	.	H	α-helix	trans	-61.9	-47.8	175.9	-169.4	-177.5	-58	105	-9.5	111.3	L728 D729 A730 T736 E768 L769	L728-R732 VanDerWaalsContact CD2-NH2 3.28Å; L728-R732 PolarHBondContact O-N 3.38Å; D729-R732 PolarHBondContact O-N 3.48Å; D729-R732 IonicContact OD1-CZ 2.66Å; D729-R732 IonicContact OD1-NH1 3.18Å; D729-R732 PolarHBondContact OD1-NH1 2.77Å; D729-R732 IonicContact OD1-NH2 3.92Å; A730-R732 VanDerWaalsContact C-N 3.28Å; A730-R732 PolarHBondContact O-N 3.04Å; R732-T736 WeakPolarHBondContact O-CB 3.31Å; R732-T736 PolarHBondContact O-N 2.95Å; R732-T736 PolarHBondContact O-OG1 2.92Å; R732-E768 IonicContact CZ-OE2 2.65Å; R732-E768 IonicContact NE-OE2 2.71Å; R732-E768 IonicContact NH2-OE2 3.83Å; R732-E768 PolarHBondContact NH2-OE2 3.12Å; R732-L769 HydrophobicContact CB-CD1 4.22Å; R732-L769 HydrophobicContact CB-CD2 3.71Å; R732-L769 HydrophobicContact CG-CD2 3.56Å
733	A	88.9	Confident	87.3	Confident	54 Å²	54	53.3 Å²	53.3	45%	0.446	32%	0.322	S	S	.	.	H	α-helix	trans	-61.8	-47.9	-178.5	0	0	0	0	0	111.9	D729 A730 T736 T737	D729-A733 PolarHBondContact O-N 2.92Å; A730-A733 PolarHBondContact O-N 2.82Å; A730-A733 VanDerWaalsContact O-N 3.07Å; A733-T736 PolarHBondContact O-N 2.8Å; A733-T737 WeakPolarHBondContact O-CB 3.37Å; A733-T737 PolarHBondContact O-N 3.36Å; A733-T737 PolarHBondContact O-OG1 3.24Å
734	T	89.3	Confident	86.5	Confident	32 Å²	32	60.4 Å²	60.4	20%	0.196	36%	0.36	C	S	.	.	H	α-helix	trans	-68.2	-46.4	-178.1	-64.4	0	0	0	0	111.8	V723 E725 A730 T736 T737 H738	V723-T734 HydrophobicContact CG1-CG2 4.01Å; E725-T734 VanDerWaalsContact OE1-CB 3.24Å; E725-T734 WeakPolarHBondContact OE1-CB 3.22Å; E725-T734 PolarHBondContact OE1-OG1 3.28Å; A730-T734 PolarHBondContact O-N 2.82Å; A730-T734 PolarHBondContact O-OG1 3.25Å; T734-T736 PolarHBondContact O-N 3.5Å; T734-T737 PolarHBondContact O-N 3.34Å; T734-H738 PolarHBondContact O-CD2 2.93Å; T734-H738 PolarHBondContact O-N 3.32Å
735	L	87.8	Confident	85.7	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-60.2	-44.2	173.8	-71.2	177.2	0	0	0	112.2	V723 T731 T737 H738 C739 A764 L769 F773 L776	V723-L735 HydrophobicContact CG1-CD2 4.38Å; T731-L735 HydrophobicContact CG2-CD1 3.85Å; T731-L735 HydrophobicContact CG2-CG 4.31Å; T731-L735 VanDerWaalsContact O-CB 3.32Å; T731-L735 WeakPolarHBondContact O-CB 3.3Å; T731-L735 VanDerWaalsContact O-CG 3.27Å; T731-L735 WeakPolarHBondContact O-CG 3.27Å; T731-L735 PolarHBondContact O-N 2.99Å; L735-T737 VanDerWaalsContact C-N 3.31Å; L735-T737 PolarHBondContact O-N 2.86Å; L735-H738 PolarHBondContact O-N 3.22Å; L735-C739 WeakPolarHBondContact O-CB 3.46Å; L735-C739 PolarHBondContact O-N 2.78Å; L735-C739 PolarHBondContact O-SG 3.07Å; L735-C739 VanDerWaalsContact O-SG 3.41Å; L735-A764 HydrophobicContact CD1-CB 4.17Å; L735-L769 HydrophobicContact CD1-CB 4.37Å; L735-F773 HydrophobicContact CD1-CB 4.17Å; L735-L776 HydrophobicContact CD2-CD2 3.65Å
736	T	87.5	Confident	84.9	Confident	72 Å²	72	59.4 Å²	59.4	44%	0.442	36%	0.36	S	S	.	.	H	α-helix	trans	-63.5	-38.8	178.3	-57.4	0	0	0	0	111.4	R732 A733 T734 S740	R732-T736 WeakPolarHBondContact O-CB 3.31Å; R732-T736 PolarHBondContact O-N 2.95Å; R732-T736 PolarHBondContact O-OG1 2.92Å; A733-T736 PolarHBondContact O-N 2.8Å; T734-T736 PolarHBondContact O-N 3.5Å; T736-S740 VanDerWaalsContact O-CB 3.32Å; T736-S740 WeakPolarHBondContact O-CB 3.5Å; T736-S740 PolarHBondContact O-N 3.24Å; T736-S740 PolarHBondContact O-OG 3.26Å
737	T	88.5	Confident	83.9	Confident	90 Å²	90	60.8 Å²	60.8	55%	0.552	36%	0.355	S	S	*	.	H	α-helix	trans	-63.7	-47.5	177.1	-61	0	0	0	0	111.4	A733 T734 L735 S740 S741	A733-T737 WeakPolarHBondContact O-CB 3.37Å; A733-T737 PolarHBondContact O-N 3.36Å; A733-T737 PolarHBondContact O-OG1 3.24Å; T734-T737 PolarHBondContact O-N 3.34Å; L735-T737 VanDerWaalsContact C-N 3.31Å; L735-T737 PolarHBondContact O-N 2.86Å; T737-S740 PolarHBondContact O-N 2.96Å; T737-S741 WeakPolarHBondContact O-CB 3.28Å; T737-S741 PolarHBondContact O-N 3.27Å
738	H	86.4	Confident	83.2	Confident	56 Å²	56	64.3 Å²	64.3	26%	0.259	36%	0.364	S	S	.	.	H	α-helix	trans	-66.3	-41.3	177.8	-72.9	-63.4	0	0	0	112.9	T734 L735 S740 S741 L742 L776	T734-H738 PolarHBondContact O-CD2 2.93Å; T734-H738 PolarHBondContact O-N 3.32Å; L735-H738 PolarHBondContact O-N 3.22Å; H738-S740 VanDerWaalsContact C-N 3.35Å; H738-S740 PolarHBondContact O-N 3.01Å; H738-S741 PolarHBondContact O-N 3.04Å; H738-L742 PolarHBondContact O-N 3.18Å; H738-L742 VanDerWaalsContact O-N 3.09Å; H738-L776 HydrophobicContact CB-CD1 3.99Å; H738-L776 HydrophobicContact CB-CD2 4.14Å
739	C	84.9	Confident	82.3	Confident	21 Å²	21	68 Å²	68	14%	0.142	38%	0.38	C	S	.	.	H	α-helix	trans	-62.9	-39.7	174.3	-73.1	0	0	0	0	112.5	L735 L742 G743 L746	L735-C739 WeakPolarHBondContact O-CB 3.46Å; L735-C739 PolarHBondContact O-N 2.78Å; L735-C739 PolarHBondContact O-SG 3.07Å; L735-C739 VanDerWaalsContact O-SG 3.41Å; C739-L742 PolarHBondContact O-N 3.45Å; C739-G743 PolarHBondContact O-N 3.37Å; C739-L746 HydrophobicContact CB-CD1 4.2Å
740	S	85.1	Confident	81.9	Confident	87 Å²	87	64.8 Å²	64.8	61%	0.608	36%	0.363	S	S	*	.	H	α-helix	trans	-68.5	-36.8	176.6	-56.9	0	0	0	0	112.3	T736 T737 H738 L742 G743	T736-S740 VanDerWaalsContact O-CB 3.32Å; T736-S740 WeakPolarHBondContact O-CB 3.5Å; T736-S740 PolarHBondContact O-N 3.24Å; T736-S740 PolarHBondContact O-OG 3.26Å; T737-S740 PolarHBondContact O-N 2.96Å; H738-S740 VanDerWaalsContact C-N 3.35Å; H738-S740 PolarHBondContact O-N 3.01Å; S740-L742 VanDerWaalsContact C-N 3.3Å; S740-L742 PolarHBondContact O-N 3.13Å; S740-G743 PolarHBondContact O-N 3.4Å
741	S	83.4	Confident	81.5	Confident	68 Å²	68	68.2 Å²	68.2	48%	0.476	37%	0.374	S	S	.	.	H	α-helix	trans	-65	-32	175.1	-170.1	0	0	0	0	112.8	T737 H738	T737-S741 WeakPolarHBondContact O-CB 3.28Å; T737-S741 PolarHBondContact O-N 3.27Å; H738-S741 PolarHBondContact O-N 3.04Å
742	L	79.9	Confident	81.5	Confident	23 Å²	23	69.5 Å²	69.5	12%	0.12	38%	0.381	C	S	.	.	H	α-helix	trans	-73.6	-36.7	175.5	-79.8	164.3	0	0	0	113.2	H738 C739 S740 D744 S745 L746 L752 L776	H738-L742 PolarHBondContact O-N 3.18Å; H738-L742 VanDerWaalsContact O-N 3.09Å; C739-L742 PolarHBondContact O-N 3.45Å; S740-L742 VanDerWaalsContact C-N 3.3Å; S740-L742 PolarHBondContact O-N 3.13Å; L742-D744 PolarHBondContact O-N 2.87Å; L742-S745 WeakPolarHBondContact O-CA 3Å; L742-S745 WeakPolarHBondContact O-CB 3.43Å; L742-S745 PolarHBondContact O-N 2.87Å; L742-S745 PolarHBondContact O-OG 2.84Å; L742-L746 HydrophobicContact CB-CB 4.45Å; L742-L746 HydrophobicContact CB-CD1 4.16Å; L742-L746 HydrophobicContact CD1-CD1 3.94Å; L742-L752 HydrophobicContact CD2-CD1 3.79Å; L742-L776 HydrophobicContact CD1-CD1 3.59Å
743	G	79.1	Confident	81.5	Confident	44 Å²	44	65.7 Å²	65.7	45%	0.454	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	51.3	-124.8	177.7	0	0	0	0	0	112.9	C739 S740 S745 L746	C739-G743 PolarHBondContact O-N 3.37Å; S740-G743 PolarHBondContact O-N 3.4Å; G743-S745 PolarHBondContact O-N 3.36Å; G743-L746 VanDerWaalsContact O-CB 3.27Å; G743-L746 WeakPolarHBondContact O-CB 3.3Å; G743-L746 PolarHBondContact O-N 3.48Å
744	D	71.3	Confident	81.8	Confident	149 Å²	149	63.1 Å²	63.1	80%	0.797	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-60	-11.7	176.2	-73.3	-31.6	0	0	0	114.5	L742 K748	L742-D744 PolarHBondContact O-N 2.87Å; D744-K748 WeakPolarHBondContact O-CD 3.32Å; D744-K748 VanDerWaalsContact O-CE 3.23Å; D744-K748 WeakPolarHBondContact O-CE 3.34Å; D744-K748 PolarHBondContact O-NZ 3.3Å
745	S	72.4	Confident	82	Confident	49 Å²	49	61.7 Å²	61.7	34%	0.343	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-88.2	-5	177	-45.2	0	0	0	0	113.3	L742 G743 K748 N750	L742-S745 WeakPolarHBondContact O-CA 3Å; L742-S745 WeakPolarHBondContact O-CB 3.43Å; L742-S745 PolarHBondContact O-N 2.87Å; L742-S745 PolarHBondContact O-OG 2.84Å; G743-S745 PolarHBondContact O-N 3.36Å; S745-K748 WeakPolarHBondContact O-CB 3.38Å; S745-K748 PolarHBondContact O-N 3.43Å; S745-N750 PolarHBondContact O-ND2 2.9Å; S745-N750 VanDerWaalsContact O-ND2 3.08Å
746	L	72.8	Confident	82.2	Confident	52 Å²	52	61.7 Å²	61.7	27%	0.272	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	140.5	175.4	-160.7	74.5	0	0	0	110.7	C739 L742 G743 K748 D775 S779	C739-L746 HydrophobicContact CB-CD1 4.2Å; L742-L746 HydrophobicContact CB-CB 4.45Å; L742-L746 HydrophobicContact CB-CD1 4.16Å; L742-L746 HydrophobicContact CD1-CD1 3.94Å; G743-L746 VanDerWaalsContact O-CB 3.27Å; G743-L746 WeakPolarHBondContact O-CB 3.3Å; G743-L746 PolarHBondContact O-N 3.48Å; L746-K748 PolarHBondContact O-N 2.9Å; L746-K748 VanDerWaalsContact O-N 3.07Å; L746-D775 HydrophobicContact CD1-CB 4.41Å; L746-D775 HydrophobicContact CD2-CB 4.22Å; L746-D775 HydrophobicContact CG-CB 4.32Å; L746-S779 WeakPolarHBondContact CA-OG 3.24Å
747	R	68.3	Low	82.3	Confident	158 Å²	158	59.5 Å²	59.5	60%	0.596	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	2.8	-171	-57.6	179.2	175.8	160.7	5.6	115.8	D775 S779	R747-D775 IonicContact CZ-OD1 3.72Å; R747-D775 VanDerWaalsContact CZ-OD1 3.23Å; R747-D775 IonicContact CZ-OD2 2.81Å; R747-D775 IonicContact NE-OD1 2.79Å; R747-D775 PolarHBondContact NE-OD1 2.55Å; R747-D775 IonicContact NE-OD2 3.8Å; R747-D775 IonicContact NH2-OD1 2.84Å; R747-D775 PolarHBondContact NH2-OD1 2.76Å; R747-D775 IonicContact NH2-OD2 3.44Å; R747-D775 PolarHBondContact NH2-OD2 2.91Å; R747-S779 PolarHBondContact N-OG 3.29Å
748	K	74.2	Confident	82.1	Confident	127 Å²	127	55.5 Å²	55.5	55%	0.552	30%	0.299	S	S	*	.	S	Bend	trans	-92.3	157	169.2	-63	174.4	-173.5	157	0	109.6	D744 S745 L746 N750 S779	D744-K748 WeakPolarHBondContact O-CD 3.32Å; D744-K748 VanDerWaalsContact O-CE 3.23Å; D744-K748 WeakPolarHBondContact O-CE 3.34Å; D744-K748 PolarHBondContact O-NZ 3.3Å; S745-K748 WeakPolarHBondContact O-CB 3.38Å; S745-K748 PolarHBondContact O-N 3.43Å; L746-K748 PolarHBondContact O-N 2.9Å; L746-K748 VanDerWaalsContact O-N 3.07Å; K748-N750 PolarHBondContact O-N 3.21Å; K748-N750 PolarHBondContact O-ND2 2.88Å; K748-S779 CarbonylContact O-C 3.55Å; K748-S779 VanDerWaalsContact O-CA 3.28Å; K748-S779 WeakPolarHBondContact O-CA 3.47Å; K748-S779 VanDerWaalsContact O-O 3.04Å
749	E	69.6	Low	82.1	Confident	129 Å²	129	57.1 Å²	57.1	60%	0.603	31%	0.306	S	S	*	.			trans	-83.3	112	-178.7	-170.4	171.2	-175.6	0	0	110.7
750	N	79.7	Confident	82.4	Confident	39 Å²	39	56.2 Å²	56.2	21%	0.209	30%	0.3	C	S	.	.			trans	-111.9	156.3	179.7	-54.2	-76.4	0	0	0	110.3	S745 K748 L752 S779 K781	S745-N750 PolarHBondContact O-ND2 2.9Å; S745-N750 VanDerWaalsContact O-ND2 3.08Å; K748-N750 PolarHBondContact O-N 3.21Å; K748-N750 PolarHBondContact O-ND2 2.88Å; N750-L752 HydrophobicContact CB-CB 4.5Å; N750-L752 HydrophobicContact CB-CD1 3.73Å; N750-L752 HydrophobicContact CB-CG 3.79Å; N750-L752 PolarHBondContact O-N 3.38Å; N750-S779 PolarHBondContact N-O 3.3Å; N750-S779 PolarHBondContact ND2-O 3.48Å; N750-S779 VanDerWaalsContact ND2-O 3.11Å; N750-K781 WeakPolarHBondContact O-CB 3.45Å
751	E	83.3	Confident	82.6	Confident	101 Å²	101	52 Å²	52	47%	0.472	27%	0.271	S	S	.	.	S	Bend	trans	-76	61.2	174.9	-63.7	-65.6	158.1	0	0	111.2	M718 S719 K781	M718-E751 WeakPolarHBondContact CA-O 3.42Å; M718-E751 HydrophobicContact CG-CB 4.43Å; S719-E751 PolarHBondContact N-O 3.2Å; E751-K781 IonicContact OE1-NZ 3.5Å; E751-K781 PolarHBondContact OE1-NZ 3.42Å; E751-K781 WeakPolarHBondContact OE2-CD 3.3Å; E751-K781 IonicContact OE2-NZ 3.7Å; E751-K781 PolarHBondContact OE2-NZ 3.35Å
752	L	89.3	Confident	82.8	Confident	28 Å²	28	55.9 Å²	55.9	15%	0.147	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	142.1	-176.4	-58.5	175.6	0	0	0	109.9	S719 I721 L742 N750 C780 K781	S719-L752 WeakPolarHBondContact O-CA 3.46Å; I721-L752 HydrophobicContact CD1-CD1 4.21Å; L742-L752 HydrophobicContact CD2-CD1 3.79Å; N750-L752 HydrophobicContact CB-CB 4.5Å; N750-L752 HydrophobicContact CB-CD1 3.73Å; N750-L752 HydrophobicContact CB-CG 3.79Å; N750-L752 PolarHBondContact O-N 3.38Å; L752-C780 WeakPolarHBondContact O-CB 3.4Å; L752-K781 PolarHBondContact O-N 2.92Å
753	A	90.7	Very high	83.4	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	129.5	170	0	0	0	0	0	109.8	V714 S719 L720 I721 A782	V714-A753 HydrophobicContact CG1-CB 4.48Å; V714-A753 HydrophobicContact CG2-CB 4.19Å; S719-A753 PolarHBondContact O-N 3.08Å; L720-A753 HydrophobicContact CD2-CB 4Å; I721-A753 PolarHBondContact N-O 3.4Å; A753-A782 WeakPolarHBondContact CA-O 3.45Å; A753-A782 HydrophobicContact CB-CB 4.3Å
754	L	93.7	Very high	83.9	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	128.8	175.7	178.5	63.6	0	0	0	109.9	I721 V723 F773 L776 A777 C780 A782 V783 I784	I721-L754 HydrophobicContact CB-CD1 4.15Å; I721-L754 HydrophobicContact CG2-CD1 3.86Å; V723-L754 HydrophobicContact CG2-CD1 3.82Å; L754-F773 HydrophobicContact CD2-CD2 4.49Å; L754-F773 HydrophobicContact CD2-CE2 3.97Å; L754-L776 HydrophobicContact CD1-CD2 3.99Å; L754-L776 HydrophobicContact CD1-CG 4.39Å; L754-L776 HydrophobicContact CD2-CD2 4.45Å; L754-L776 HydrophobicContact CD2-CG 4.31Å; L754-A777 HydrophobicContact CD2-CB 3.85Å; L754-C780 HydrophobicContact CB-CB 4.3Å; L754-A782 PolarHBondContact N-O 3.47Å; L754-A782 VanDerWaalsContact N-O 3.12Å; L754-V783 HydrophobicContact CB-CG1 4.31Å; L754-V783 HydrophobicContact CB-CG2 4.31Å; L754-V783 HydrophobicContact CD2-CG1 4.29Å; L754-V783 HydrophobicContact CG-CG1 4.45Å; L754-V783 CarbonylContact O-C 3.36Å; L754-V783 WeakPolarHBondContact O-CA 3.25Å; L754-I784 PolarHBondContact O-N 3.46Å
755	I	93.4	Very high	84.7	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.3	171.6	-56.9	92.7	0	0	0	108.1	Q701 I705 L720 I721 I722 V723 I784	Q701-I755 HydrophobicContact CG-CG2 3.87Å; I705-I755 HydrophobicContact CD1-CG1 4.43Å; I705-I755 HydrophobicContact CD1-CG2 4.46Å; I705-I755 HydrophobicContact CG1-CG1 4.26Å; L720-I755 HydrophobicContact CB-CD1 3.91Å; L720-I755 HydrophobicContact CD1-CD1 4.4Å; L720-I755 HydrophobicContact CD2-CD1 4.17Å; L720-I755 HydrophobicContact CG-CD1 4.37Å; I721-I755 PolarHBondContact O-N 2.91Å; I722-I755 WeakPolarHBondContact CA-O 3.29Å; I722-I755 HydrophobicContact CG1-CB 4.25Å; I722-I755 HydrophobicContact CG1-CD1 4.22Å; V723-I755 PolarHBondContact N-O 3.38Å; I755-I784 WeakPolarHBondContact CA-O 3.08Å; I755-I784 HydrophobicContact CG1-CB 4.4Å
756	I	93.3	Very high	85.5	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	141.8	178.8	-173	169.3	0	0	0	109.6	T760 L761 A764 F773 I784 C785 C786	I756-T760 HydrophobicContact CD1-CG2 4.2Å; I756-T760 HydrophobicContact CG1-CG2 4.25Å; I756-L761 HydrophobicContact CD1-CB 4.27Å; I756-L761 HydrophobicContact CD1-CD1 4.27Å; I756-L761 HydrophobicContact CG1-CB 4.38Å; I756-A764 HydrophobicContact CD1-CB 3.95Å; I756-F773 HydrophobicContact CD1-CD2 4.04Å; I756-F773 HydrophobicContact CD1-CE2 3.64Å; I756-F773 HydrophobicContact CD1-CZ 4.35Å; I756-F773 HydrophobicContact CG2-CE2 4.14Å; I756-F773 HydrophobicContact CG2-CZ 4.35Å; I756-I784 PolarHBondContact N-O 2.89Å; I756-I784 VanDerWaalsContact N-O 3.14Å; I756-C785 HydrophobicContact CG2-CB 4.19Å; I756-C785 VanDerWaalsContact CG2-SG 3.56Å; I756-C785 WeakPolarHBondContact O-CA 3.1Å; I756-C786 PolarHBondContact O-N 2.75Å
757	D	88.9	Confident	86	Confident	26 Å²	26	54.8 Å²	54.8	14%	0.139	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	162.1	177.6	100	-67.2	0	0	0	112.5	Q759 T760 L761 C786	D757-Q759 VanDerWaalsContact C-N 3.28Å; D757-Q759 PolarHBondContact O-N 3.11Å; D757-Q759 WeakPolarHBondContact OD2-CB 3.48Å; D757-Q759 PolarHBondContact OD2-N 3.21Å; D757-T760 PolarHBondContact O-N 3.06Å; D757-T760 WeakPolarHBondContact OD1-CB 3.48Å; D757-T760 PolarHBondContact OD1-N 2.93Å; D757-T760 PolarHBondContact OD1-OG1 2.81Å; D757-L761 WeakPolarHBondContact O-CB 3.15Å; D757-L761 PolarHBondContact O-N 3.28Å; D757-C786 CarbonylContact C-O 3.49Å; D757-C786 WeakPolarHBondContact CA-O 3.29Å
758	G	84.9	Confident	86.7	Confident	7 Å²	7	53.3 Å²	53.3	7%	0.072	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-27.4	-178.8	0	0	0	0	0	114.8	K762 C786 Q792	G758-K762 PolarHBondContact O-N 2.86Å; G758-C786 PolarHBondContact N-O 3.22Å; G758-Q792 PolarHBondContact O-NE2 3.1Å
759	Q	85.7	Confident	87.3	Confident	90 Å²	90	47.6 Å²	47.6	42%	0.421	22%	0.224	S	C	.	.	H	α-helix	trans	-74.3	-51	176.6	-168	176	-54.9	0	0	110.8	D726 D757 L761 K762 Y763	D726-Q759 PolarHBondContact OD1-NE2 3.3Å; D757-Q759 VanDerWaalsContact C-N 3.28Å; D757-Q759 PolarHBondContact O-N 3.11Å; D757-Q759 WeakPolarHBondContact OD2-CB 3.48Å; D757-Q759 PolarHBondContact OD2-N 3.21Å; Q759-L761 VanDerWaalsContact C-N 3.29Å; Q759-L761 PolarHBondContact O-N 2.87Å; Q759-K762 VanDerWaalsContact O-CB 3.24Å; Q759-K762 WeakPolarHBondContact O-CB 3.26Å; Q759-K762 PolarHBondContact O-N 2.9Å; Q759-K762 VanDerWaalsContact O-N 3.14Å; Q759-Y763 HydrophobicContact CG-CE2 4.47Å
760	T	90.9	Very high	88.3	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-38.9	176	-49.3	0	0	0	0	111.6	V723 N724 E725 T731 I756 D757 K762 Y763 A764	V723-T760 HydrophobicContact CG1-CG2 4Å; V723-T760 PolarHBondContact O-OG1 2.71Å; N724-T760 WeakPolarHBondContact CA-OG1 3.33Å; E725-T760 HydrophobicContact CB-CG2 3.93Å; E725-T760 HydrophobicContact CG-CG2 4.26Å; E725-T760 PolarHBondContact N-OG1 2.91Å; E725-T760 PolarHBondContact O-OG1 3.35Å; T731-T760 HydrophobicContact CG2-CG2 3.77Å; I756-T760 HydrophobicContact CD1-CG2 4.2Å; I756-T760 HydrophobicContact CG1-CG2 4.25Å; D757-T760 PolarHBondContact O-N 3.06Å; D757-T760 WeakPolarHBondContact OD1-CB 3.48Å; D757-T760 PolarHBondContact OD1-N 2.93Å; D757-T760 PolarHBondContact OD1-OG1 2.81Å; T760-K762 PolarHBondContact O-N 3.13Å; T760-Y763 PolarHBondContact O-N 3.29Å; T760-A764 PolarHBondContact O-N 3.48Å
761	L	90.1	Very high	88.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.4	-34	176.5	-177.3	71.4	0	0	0	112.3	I756 D757 Q759 Y763 A764 L765 F773 V788 Q792 I796	I756-L761 HydrophobicContact CD1-CB 4.27Å; I756-L761 HydrophobicContact CD1-CD1 4.27Å; I756-L761 HydrophobicContact CG1-CB 4.38Å; D757-L761 WeakPolarHBondContact O-CB 3.15Å; D757-L761 PolarHBondContact O-N 3.28Å; Q759-L761 VanDerWaalsContact C-N 3.29Å; Q759-L761 PolarHBondContact O-N 2.87Å; L761-Y763 VanDerWaalsContact C-N 3.28Å; L761-Y763 PolarHBondContact O-N 3.46Å; L761-A764 PolarHBondContact O-N 3.33Å; L761-L765 HydrophobicContact CD1-CD1 4.02Å; L761-L765 HydrophobicContact CD1-CD2 4.34Å; L761-L765 HydrophobicContact CD1-CG 3.85Å; L761-L765 HydrophobicContact CD2-CD1 4.15Å; L761-L765 HydrophobicContact CG-CD1 3.74Å; L761-L765 HydrophobicContact CG-CG 3.99Å; L761-L765 WeakPolarHBondContact O-CB 3.43Å; L761-L765 WeakPolarHBondContact O-CG 3.47Å; L761-L765 PolarHBondContact O-N 2.97Å; L761-F773 HydrophobicContact CD1-CE1 3.74Å; L761-F773 HydrophobicContact CD1-CE2 4.39Å; L761-F773 HydrophobicContact CD1-CZ 3.64Å; L761-V788 HydrophobicContact CD2-CB 4.46Å; L761-V788 HydrophobicContact CD2-CG1 3.47Å; L761-V788 VanDerWaalsContact CD2-CG1 3.47Å; L761-Q792 HydrophobicContact CD2-CB 4.04Å; L761-Q792 HydrophobicContact CD2-CG 4.44Å; L761-I796 HydrophobicContact CD1-CD1 4.24Å; L761-I796 HydrophobicContact CD1-CG1 4.29Å; L761-I796 HydrophobicContact CD2-CD1 3.55Å; L761-I796 HydrophobicContact CD2-CG1 4.2Å
762	K	88.3	Confident	89	Confident	149 Å²	149	44 Å²	44	65%	0.648	21%	0.208	S	C	*	.	H	α-helix	trans	-60	-38	174.8	-171.7	-176	177.5	-178.2	0	111.8	G758 Q759 T760	G758-K762 PolarHBondContact O-N 2.86Å; Q759-K762 VanDerWaalsContact O-CB 3.24Å; Q759-K762 WeakPolarHBondContact O-CB 3.26Å; Q759-K762 PolarHBondContact O-N 2.9Å; Q759-K762 VanDerWaalsContact O-N 3.14Å; T760-K762 PolarHBondContact O-N 3.13Å
763	Y	90.6	Very high	89.1	Confident	63 Å²	63	42.7 Å²	42.7	25%	0.247	20%	0.201	C	C	.	.	H	α-helix	trans	-78	-41.4	173.6	-53.5	-56.2	0	0	0	111.8	D726 L728 Q759 T760 L761 L765 S766	D726-Y763 PolarHBondContact O-OH 3.05Å; L728-Y763 HydrophobicContact CB-CD1 3.82Å; L728-Y763 HydrophobicContact CB-CE1 4.48Å; L728-Y763 HydrophobicContact CB-CG 4.12Å; L728-Y763 HydrophobicContact CD1-CD1 4.35Å; L728-Y763 HydrophobicContact CG-CD1 4.46Å; Q759-Y763 HydrophobicContact CG-CE2 4.47Å; T760-Y763 PolarHBondContact O-N 3.29Å; L761-Y763 VanDerWaalsContact C-N 3.28Å; L761-Y763 PolarHBondContact O-N 3.46Å; Y763-L765 VanDerWaalsContact C-N 3.3Å; Y763-L765 PolarHBondContact O-N 2.89Å; Y763-S766 WeakPolarHBondContact O-CB 3.47Å; Y763-S766 PolarHBondContact O-N 2.86Å; Y763-S766 PolarHBondContact O-OG 2.91Å
764	A	89.9	Confident	89.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.9	-30.1	-179.9	0	0	0	0	0	113.4	T731 L735 I756 T760 L761 S766 L769 R770 F773	T731-A764 HydrophobicContact CG2-CB 4.25Å; L735-A764 HydrophobicContact CD1-CB 4.17Å; I756-A764 HydrophobicContact CD1-CB 3.95Å; T760-A764 PolarHBondContact O-N 3.48Å; L761-A764 PolarHBondContact O-N 3.33Å; A764-S766 VanDerWaalsContact C-N 3.31Å; A764-L769 CarbonylContact O-C 3.47Å; A764-L769 VanDerWaalsContact O-C 3.31Å; A764-R770 VanDerWaalsContact O-CA 3.22Å; A764-R770 WeakPolarHBondContact O-CA 3.41Å; A764-R770 PolarHBondContact O-N 3.36Å; A764-R770 VanDerWaalsContact O-N 3.1Å; A764-F773 HydrophobicContact CB-CB 4.1Å; A764-F773 HydrophobicContact CB-CD1 4.47Å; A764-F773 HydrophobicContact CB-CD2 4.14Å; A764-F773 HydrophobicContact CB-CG 3.98Å
765	L	88.1	Confident	88.9	Confident	6 Å²	6	43.6 Å²	43.6	3%	0.031	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-5.9	173.5	-70	174.7	0	0	0	113.6	L761 Y763 R770 F773 E795 I796 M799	L761-L765 HydrophobicContact CD1-CD1 4.02Å; L761-L765 HydrophobicContact CD1-CD2 4.34Å; L761-L765 HydrophobicContact CD1-CG 3.85Å; L761-L765 HydrophobicContact CD2-CD1 4.15Å; L761-L765 HydrophobicContact CG-CD1 3.74Å; L761-L765 HydrophobicContact CG-CG 3.99Å; L761-L765 WeakPolarHBondContact O-CB 3.43Å; L761-L765 WeakPolarHBondContact O-CG 3.47Å; L761-L765 PolarHBondContact O-N 2.97Å; Y763-L765 VanDerWaalsContact C-N 3.3Å; Y763-L765 PolarHBondContact O-N 2.89Å; L765-R770 VanDerWaalsContact O-CZ 3.23Å; L765-R770 PolarHBondContact O-NE 2.62Å; L765-R770 PolarHBondContact O-NH2 2.83Å; L765-F773 HydrophobicContact CD2-CD1 4.47Å; L765-F773 HydrophobicContact CD2-CE1 4.38Å; L765-E795 HydrophobicContact CD1-CB 4.17Å; L765-I796 HydrophobicContact CD1-CG1 4.37Å; L765-I796 HydrophobicContact CD2-CG1 4.42Å; L765-M799 HydrophobicContact CD2-CE 4.35Å; L765-M799 HydrophobicContact CD2-SD 3.96Å
766	S	88.9	Confident	88.7	Confident	32 Å²	32	43.6 Å²	43.6	22%	0.224	21%	0.206	C	C	.	.	S	Bend	trans	-60.7	154	173.9	71.8	0	0	0	0	111.9	Y763 A764 E768 L769 R770	Y763-S766 WeakPolarHBondContact O-CB 3.47Å; Y763-S766 PolarHBondContact O-N 2.86Å; Y763-S766 PolarHBondContact O-OG 2.91Å; A764-S766 VanDerWaalsContact C-N 3.31Å; S766-E768 PolarHBondContact O-N 2.89Å; S766-E768 VanDerWaalsContact O-N 3.1Å; S766-L769 PolarHBondContact O-N 3.39Å; S766-L769 VanDerWaalsContact O-N 3.13Å; S766-R770 VanDerWaalsContact O-CB 3.25Å; S766-R770 WeakPolarHBondContact O-CB 3.47Å; S766-R770 PolarHBondContact O-N 3.05Å
767	F	83.3	Confident	88.6	Confident	192 Å²	192	43.5 Å²	43.5	84%	0.842	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-37.3	-172.1	179.7	-100.8	0	0	0	113.9
768	E	84.1	Confident	88.6	Confident	128 Å²	128	43.4 Å²	43.4	60%	0.598	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-42	-180	-61.8	178.2	-165.7	0	0	113.3	R732 S766	R732-E768 IonicContact CZ-OE2 2.65Å; R732-E768 IonicContact NE-OE2 2.71Å; R732-E768 IonicContact NH2-OE2 3.83Å; R732-E768 PolarHBondContact NH2-OE2 3.12Å; S766-E768 PolarHBondContact O-N 2.89Å; S766-E768 VanDerWaalsContact O-N 3.1Å
769	L	87.4	Confident	88.8	Confident	7 Å²	7	43 Å²	43	4%	0.037	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-20.8	-170.7	-54.8	-169.2	0	0	0	113.2	L728 T731 R732 L735 A764 S766 Q771 A772 F773	L728-L769 HydrophobicContact CD2-CD1 4.45Å; L728-L769 HydrophobicContact CG-CD1 4.21Å; T731-L769 HydrophobicContact CG2-CD1 3.84Å; R732-L769 HydrophobicContact CB-CD1 4.22Å; R732-L769 HydrophobicContact CB-CD2 3.71Å; R732-L769 HydrophobicContact CG-CD2 3.56Å; L735-L769 HydrophobicContact CD1-CB 4.37Å; A764-L769 CarbonylContact O-C 3.47Å; A764-L769 VanDerWaalsContact O-C 3.31Å; S766-L769 PolarHBondContact O-N 3.39Å; S766-L769 VanDerWaalsContact O-N 3.13Å; L769-Q771 PolarHBondContact O-N 2.85Å; L769-Q771 VanDerWaalsContact O-N 3.12Å; L769-A772 PolarHBondContact O-N 2.78Å; L769-F773 PolarHBondContact O-N 3.34Å
770	R	89.1	Confident	88.9	Confident	82 Å²	82	38.8 Å²	38.8	31%	0.309	18%	0.181	S	C	.	.	H	α-helix	trans	-50.2	-40.7	-175.6	-173.5	178.4	-66.1	-165.6	-7.3	113.7	A764 L765 S766 L774 M799	A764-R770 VanDerWaalsContact O-CA 3.22Å; A764-R770 WeakPolarHBondContact O-CA 3.41Å; A764-R770 PolarHBondContact O-N 3.36Å; A764-R770 VanDerWaalsContact O-N 3.1Å; L765-R770 VanDerWaalsContact O-CZ 3.23Å; L765-R770 PolarHBondContact O-NE 2.62Å; L765-R770 PolarHBondContact O-NH2 2.83Å; S766-R770 VanDerWaalsContact O-CB 3.25Å; S766-R770 WeakPolarHBondContact O-CB 3.47Å; S766-R770 PolarHBondContact O-N 3.05Å; R770-L774 VanDerWaalsContact O-CB 3.24Å; R770-L774 WeakPolarHBondContact O-CB 3.35Å; R770-L774 PolarHBondContact O-N 3.04Å; R770-M799 HydrophobicContact CG-CG 3.93Å; R770-M799 HydrophobicContact CG-SD 3.54Å; R770-M799 VanDerWaalsContact CG-SD 3.54Å
771	Q	88.9	Confident	88.8	Confident	80 Å²	80	40.8 Å²	40.8	37%	0.374	19%	0.19	S	C	.	.	H	α-helix	trans	-72.6	-39.4	179.8	-174.7	56.1	59.6	0	0	112.3	L769 D775	L769-Q771 PolarHBondContact O-N 2.85Å; L769-Q771 VanDerWaalsContact O-N 3.12Å; Q771-D775 PolarHBondContact NE2-OD1 3.25Å; Q771-D775 VanDerWaalsContact NE2-OD1 3.15Å; Q771-D775 PolarHBondContact NE2-OD2 3.15Å; Q771-D775 WeakPolarHBondContact O-CB 3.37Å; Q771-D775 VanDerWaalsContact O-CG 3.28Å; Q771-D775 PolarHBondContact O-N 3.28Å
772	A	88.9	Confident	88.8	Confident	31 Å²	31	40.8 Å²	40.8	26%	0.256	19%	0.19	S	C	.	.	H	α-helix	trans	-69.3	-42.5	177.1	0	0	0	0	0	111.7	L769 D775 L776	L769-A772 PolarHBondContact O-N 2.78Å; A772-D775 PolarHBondContact O-N 2.98Å; A772-L776 PolarHBondContact O-N 2.78Å
773	F	92.2	Very high	89.1	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.4	-47.8	172.7	171.8	-116.3	0	0	0	111.8	L735 L754 I756 L761 A764 L765 L769 D775 L776 A777 M799	L735-F773 HydrophobicContact CD1-CB 4.17Å; L754-F773 HydrophobicContact CD2-CD2 4.49Å; L754-F773 HydrophobicContact CD2-CE2 3.97Å; I756-F773 HydrophobicContact CD1-CD2 4.04Å; I756-F773 HydrophobicContact CD1-CE2 3.64Å; I756-F773 HydrophobicContact CD1-CZ 4.35Å; I756-F773 HydrophobicContact CG2-CE2 4.14Å; I756-F773 HydrophobicContact CG2-CZ 4.35Å; L761-F773 HydrophobicContact CD1-CE1 3.74Å; L761-F773 HydrophobicContact CD1-CE2 4.39Å; L761-F773 HydrophobicContact CD1-CZ 3.64Å; A764-F773 HydrophobicContact CB-CB 4.1Å; A764-F773 HydrophobicContact CB-CD1 4.47Å; A764-F773 HydrophobicContact CB-CD2 4.14Å; A764-F773 HydrophobicContact CB-CG 3.98Å; L765-F773 HydrophobicContact CD2-CD1 4.47Å; L765-F773 HydrophobicContact CD2-CE1 4.38Å; L769-F773 PolarHBondContact O-N 3.34Å; F773-D775 VanDerWaalsContact C-N 3.34Å; F773-D775 PolarHBondContact O-N 3.23Å; F773-L776 PolarHBondContact O-N 3.36Å; F773-A777 WeakPolarHBondContact O-CB 3.2Å; F773-A777 PolarHBondContact O-N 3.27Å; F773-M799 HydrophobicContact CD1-CE 3.91Å; F773-M799 HydrophobicContact CD1-SD 4.15Å; F773-M799 HydrophobicContact CE1-CE 3.75Å
774	L	91.1	Very high	89.3	Confident	4 Å²	4	30.7 Å²	30.7	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-59.4	-43.3	176.8	178	63.8	0	0	0	111.8	R770 A777 L778 M799 V800 H803 V804	R770-L774 VanDerWaalsContact O-CB 3.24Å; R770-L774 WeakPolarHBondContact O-CB 3.35Å; R770-L774 PolarHBondContact O-N 3.04Å; L774-A777 PolarHBondContact O-N 3.03Å; L774-L778 HydrophobicContact CD1-CD1 3.99Å; L774-L778 HydrophobicContact CD1-CG 3.97Å; L774-L778 HydrophobicContact CD2-CD1 4.48Å; L774-L778 HydrophobicContact CG-CD1 3.82Å; L774-L778 HydrophobicContact CG-CG 4.24Å; L774-L778 VanDerWaalsContact O-CB 3.29Å; L774-L778 WeakPolarHBondContact O-CB 3.12Å; L774-L778 WeakPolarHBondContact O-CG 3.3Å; L774-L778 PolarHBondContact O-N 2.89Å; L774-M799 HydrophobicContact CB-CE 4.49Å; L774-M799 HydrophobicContact CB-SD 4.2Å; L774-M799 HydrophobicContact CD1-CE 4.12Å; L774-V800 HydrophobicContact CD1-CG2 4.06Å; L774-H803 HydrophobicContact CD2-CB 3.44Å; L774-H803 VanDerWaalsContact CD2-CB 3.44Å; L774-V804 HydrophobicContact CD1-CG2 4.08Å; L774-V804 HydrophobicContact CD2-CG2 4.44Å
775	D	89.1	Confident	89.4	Confident	16 Å²	16	30.7 Å²	30.7	9%	0.086	15%	0.147	C	C	.	.	H	α-helix	trans	-69.2	-34.9	-179.1	-72.7	-30.4	0	0	0	113	L746 R747 Q771 A772 F773 S779	L746-D775 HydrophobicContact CD1-CB 4.41Å; L746-D775 HydrophobicContact CD2-CB 4.22Å; L746-D775 HydrophobicContact CG-CB 4.32Å; R747-D775 IonicContact CZ-OD1 3.72Å; R747-D775 VanDerWaalsContact CZ-OD1 3.23Å; R747-D775 IonicContact CZ-OD2 2.81Å; R747-D775 IonicContact NE-OD1 2.79Å; R747-D775 PolarHBondContact NE-OD1 2.55Å; R747-D775 IonicContact NE-OD2 3.8Å; R747-D775 IonicContact NH2-OD1 2.84Å; R747-D775 PolarHBondContact NH2-OD1 2.76Å; R747-D775 IonicContact NH2-OD2 3.44Å; R747-D775 PolarHBondContact NH2-OD2 2.91Å; Q771-D775 PolarHBondContact NE2-OD1 3.25Å; Q771-D775 VanDerWaalsContact NE2-OD1 3.15Å; Q771-D775 PolarHBondContact NE2-OD2 3.15Å; Q771-D775 WeakPolarHBondContact O-CB 3.37Å; Q771-D775 VanDerWaalsContact O-CG 3.28Å; Q771-D775 PolarHBondContact O-N 3.28Å; A772-D775 PolarHBondContact O-N 2.98Å; F773-D775 VanDerWaalsContact C-N 3.34Å; F773-D775 PolarHBondContact O-N 3.23Å; D775-S779 PolarHBondContact O-N 2.95Å; D775-S779 PolarHBondContact O-OG 3.42Å
776	L	90	Very high	89.5	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.1	-50.1	169.6	-177.5	60.1	0	0	0	111.4	I721 L735 H738 L742 L754 A772 F773 L778 S779 C780	I721-L776 HydrophobicContact CD1-CD1 4.21Å; L735-L776 HydrophobicContact CD2-CD2 3.65Å; H738-L776 HydrophobicContact CB-CD1 3.99Å; H738-L776 HydrophobicContact CB-CD2 4.14Å; L742-L776 HydrophobicContact CD1-CD1 3.59Å; L754-L776 HydrophobicContact CD1-CD2 3.99Å; L754-L776 HydrophobicContact CD1-CG 4.39Å; L754-L776 HydrophobicContact CD2-CD2 4.45Å; L754-L776 HydrophobicContact CD2-CG 4.31Å; A772-L776 PolarHBondContact O-N 2.78Å; F773-L776 PolarHBondContact O-N 3.36Å; L776-L778 VanDerWaalsContact C-N 3.35Å; L776-L778 PolarHBondContact O-N 2.92Å; L776-S779 VanDerWaalsContact O-CB 3.32Å; L776-S779 WeakPolarHBondContact O-CB 3.08Å; L776-S779 PolarHBondContact O-N 3.17Å; L776-C780 PolarHBondContact O-N 3.45Å; L776-C780 PolarHBondContact O-SG 3.45Å
777	A	91	Very high	89.2	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.1	-36.3	-178.9	0	0	0	0	0	112.8	W694 L754 F773 L774 S779 C780 V783	W694-A777 HydrophobicContact CH2-CB 3.48Å; W694-A777 VanDerWaalsContact CH2-CB 3.48Å; W694-A777 HydrophobicContact CZ2-CB 3.74Å; W694-A777 HydrophobicContact CZ3-CB 4.26Å; L754-A777 HydrophobicContact CD2-CB 3.85Å; F773-A777 WeakPolarHBondContact O-CB 3.2Å; F773-A777 PolarHBondContact O-N 3.27Å; L774-A777 PolarHBondContact O-N 3.03Å; A777-S779 VanDerWaalsContact C-N 3.27Å; A777-S779 PolarHBondContact O-N 3.34Å; A777-C780 PolarHBondContact O-N 3.43Å; A777-V783 HydrophobicContact CB-CG2 4.18Å
778	L	88.9	Confident	89.2	Confident	23 Å²	23	26.3 Å²	26.3	12%	0.12	12%	0.12	C	C	.	.	H	α-helix	trans	-66.1	-27.9	173	-75.4	173.6	0	0	0	113.2	Y416 K692 L774 L776 C780 V804	Y416-L778 HydrophobicContact CE1-CD2 4.14Å; Y416-L778 WeakPolarHBondContact OH-CD2 3.19Å; K692-L778 PolarHBondContact NZ-O 3.33Å; L774-L778 HydrophobicContact CD1-CD1 3.99Å; L774-L778 HydrophobicContact CD1-CG 3.97Å; L774-L778 HydrophobicContact CD2-CD1 4.48Å; L774-L778 HydrophobicContact CG-CD1 3.82Å; L774-L778 HydrophobicContact CG-CG 4.24Å; L774-L778 VanDerWaalsContact O-CB 3.29Å; L774-L778 WeakPolarHBondContact O-CB 3.12Å; L774-L778 WeakPolarHBondContact O-CG 3.3Å; L774-L778 PolarHBondContact O-N 2.89Å; L776-L778 VanDerWaalsContact C-N 3.35Å; L776-L778 PolarHBondContact O-N 2.92Å; L778-C780 VanDerWaalsContact C-N 3.31Å; L778-V804 HydrophobicContact CD1-CG2 4.15Å; L778-V804 HydrophobicContact CD2-CG1 4.31Å; L778-V804 HydrophobicContact CD2-CG2 3.98Å
779	S	88.3	Confident	88.9	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-77.3	-18.7	177.9	-53.1	0	0	0	0	113.3	L746 R747 K748 N750 D775 L776 A777	L746-S779 WeakPolarHBondContact CA-OG 3.24Å; R747-S779 PolarHBondContact N-OG 3.29Å; K748-S779 CarbonylContact O-C 3.55Å; K748-S779 VanDerWaalsContact O-CA 3.28Å; K748-S779 WeakPolarHBondContact O-CA 3.47Å; K748-S779 VanDerWaalsContact O-O 3.04Å; N750-S779 PolarHBondContact N-O 3.3Å; N750-S779 PolarHBondContact ND2-O 3.48Å; N750-S779 VanDerWaalsContact ND2-O 3.11Å; D775-S779 PolarHBondContact O-N 2.95Å; D775-S779 PolarHBondContact O-OG 3.42Å; L776-S779 VanDerWaalsContact O-CB 3.32Å; L776-S779 WeakPolarHBondContact O-CB 3.08Å; L776-S779 PolarHBondContact O-N 3.17Å; A777-S779 VanDerWaalsContact C-N 3.27Å; A777-S779 PolarHBondContact O-N 3.34Å
780	C	88.9	Confident	88.5	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.121	C	C	.	.	S	Bend	trans	-87.2	160.4	178.5	-60.9	0	0	0	0	111.6	K692 L752 L754 L776 A777 L778 V783	K692-C780 PolarHBondContact NZ-O 2.98Å; L752-C780 WeakPolarHBondContact O-CB 3.4Å; L754-C780 HydrophobicContact CB-CB 4.3Å; L776-C780 PolarHBondContact O-N 3.45Å; L776-C780 PolarHBondContact O-SG 3.45Å; A777-C780 PolarHBondContact O-N 3.43Å; L778-C780 VanDerWaalsContact C-N 3.31Å; C780-V783 HydrophobicContact CB-CG2 4.37Å
781	K	86.8	Confident	88.1	Confident	43 Å²	43	26 Å²	26	19%	0.187	14%	0.135	C	C	.	.	S	Bend	trans	-95.8	-34.4	179.8	-179.7	171.4	172	-173.7	0	112.1	M687 M718 N750 E751 L752	M687-K781 HydrophobicContact CE-CD 4.48Å; M687-K781 HydrophobicContact CE-CG 3.88Å; M718-K781 HydrophobicContact CE-CD 3.98Å; N750-K781 WeakPolarHBondContact O-CB 3.45Å; E751-K781 IonicContact OE1-NZ 3.5Å; E751-K781 PolarHBondContact OE1-NZ 3.42Å; E751-K781 WeakPolarHBondContact OE2-CD 3.3Å; E751-K781 IonicContact OE2-NZ 3.7Å; E751-K781 PolarHBondContact OE2-NZ 3.35Å; L752-K781 PolarHBondContact O-N 2.92Å
782	A	90.1	Very high	87.9	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	152.6	168.1	0	0	0	0	0	110.3	L713 A753 L754	L713-A782 HydrophobicContact CD1-CB 3.71Å; L713-A782 HydrophobicContact CD2-CB 4.41Å; L713-A782 HydrophobicContact CG-CB 3.77Å; A753-A782 WeakPolarHBondContact CA-O 3.45Å; A753-A782 HydrophobicContact CB-CB 4.3Å; L754-A782 PolarHBondContact N-O 3.47Å; L754-A782 VanDerWaalsContact N-O 3.12Å
783	V	94.8	Very high	88	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.2	172.2	-177	0	0	0	0	108.3	W694 V695 L754 A777 C780	W694-V783 CarbonylContact C-O 3.52Å; W694-V783 VanDerWaalsContact CA-O 3.3Å; W694-V783 WeakPolarHBondContact CA-O 3.46Å; W694-V783 HydrophobicContact CB-CB 4.31Å; W694-V783 HydrophobicContact CD2-CB 3.75Å; W694-V783 HydrophobicContact CD2-CG1 4.2Å; W694-V783 HydrophobicContact CD2-CG2 3.87Å; W694-V783 HydrophobicContact CE3-CB 4.21Å; W694-V783 HydrophobicContact CE3-CG1 4.13Å; W694-V783 HydrophobicContact CE3-CG2 4.46Å; W694-V783 HydrophobicContact CG-CB 3.76Å; W694-V783 HydrophobicContact CG-CG2 4.13Å; W694-V783 HydrophobicContact CZ2-CG2 4.03Å; V695-V783 PolarHBondContact N-O 3.34Å; L754-V783 HydrophobicContact CB-CG1 4.31Å; L754-V783 HydrophobicContact CB-CG2 4.31Å; L754-V783 HydrophobicContact CD2-CG1 4.29Å; L754-V783 HydrophobicContact CG-CG1 4.45Å; L754-V783 CarbonylContact O-C 3.36Å; L754-V783 WeakPolarHBondContact O-CA 3.25Å; A777-V783 HydrophobicContact CB-CG2 4.18Å; C780-V783 HydrophobicContact CB-CG2 4.37Å
784	I	94.8	Very high	87.8	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	115.1	178	-54	-179.6	0	0	0	107.8	V695 A704 L713 V714 L754 I755 I756	V695-I784 CarbonylContact O-C 3.5Å; V695-I784 WeakPolarHBondContact O-CA 3.35Å; A704-I784 HydrophobicContact CB-CG2 3.78Å; L713-I784 HydrophobicContact CD2-CG1 4.44Å; V714-I784 HydrophobicContact CG2-CD1 3.91Å; L754-I784 PolarHBondContact O-N 3.46Å; I755-I784 WeakPolarHBondContact CA-O 3.08Å; I755-I784 HydrophobicContact CG1-CB 4.4Å; I756-I784 PolarHBondContact N-O 2.89Å; I756-I784 VanDerWaalsContact N-O 3.14Å
785	C	93.6	Very high	87.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	122.7	173.2	-55.5	0	0	0	0	109	V695 L696 T697 I756 V788 I796	V695-C785 PolarHBondContact O-N 2.82Å; L696-C785 HydrophobicContact CD2-CB 3.69Å; L696-C785 VanDerWaalsContact CD2-SG 3.57Å; T697-C785 PolarHBondContact N-O 3.44Å; I756-C785 HydrophobicContact CG2-CB 4.19Å; I756-C785 VanDerWaalsContact CG2-SG 3.56Å; I756-C785 WeakPolarHBondContact O-CA 3.1Å; C785-V788 HydrophobicContact CB-CG1 3.61Å; C785-I796 HydrophobicContact CB-CD1 4.43Å
786	C	89.1	Confident	88	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.007	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	153.9	-172.6	-49.1	0	0	0	0	110.5	T697 Q701 I756 D757 G758 V788	T697-C786 CarbonylContact O-C 3.56Å; Q701-C786 HydrophobicContact CB-CB 4.15Å; I756-C786 PolarHBondContact O-N 2.75Å; D757-C786 CarbonylContact C-O 3.49Å; D757-C786 WeakPolarHBondContact CA-O 3.29Å; G758-C786 PolarHBondContact N-O 3.22Å; C786-V788 PolarHBondContact O-N 2.74Å; C786-V788 VanDerWaalsContact O-N 3.13Å
787	R	82.3	Confident	88.1	Confident	131 Å²	131	25.7 Å²	25.7	49%	0.494	13%	0.13	S	C	.	.	S	Bend	trans	49.9	31.4	-176.8	-57	-173.8	179.5	-163.9	1.4	114.5	T697 G698 D699	T697-R787 PolarHBondContact O-N 3.38Å; G698-R787 WeakPolarHBondContact O-CA 3.39Å; D699-R787 WeakPolarHBondContact O-CG 3.42Å; D699-R787 PolarHBondContact O-N 3.07Å
788	V	82.8	Confident	88.2	Confident	5 Å²	5	27.8 Å²	27.8	3%	0.03	14%	0.141	C	C	.	.			trans	-83.3	132.8	-177.9	-66.1	0	0	0	0	112.6	L696 T697 L761 C785 C786 Q792 K793	L696-V788 HydrophobicContact CB-CG2 4.23Å; T697-V788 WeakPolarHBondContact O-CG2 3.3Å; T697-V788 PolarHBondContact O-N 2.92Å; L761-V788 HydrophobicContact CD2-CB 4.46Å; L761-V788 HydrophobicContact CD2-CG1 3.47Å; L761-V788 VanDerWaalsContact CD2-CG1 3.47Å; C785-V788 HydrophobicContact CB-CG1 3.61Å; C786-V788 PolarHBondContact O-N 2.74Å; C786-V788 VanDerWaalsContact O-N 3.13Å; V788-Q792 HydrophobicContact CB-CB 4.4Å; V788-K793 HydrophobicContact CG2-CG 3.81Å
789	S	79	Confident	88.3	Confident	47 Å²	47	26.8 Å²	26.8	33%	0.329	14%	0.135	S	C	.	.			trans	-71.6	155.5	173.9	63.9	0	0	0	0	112.3	L791 Q792 K793	S789-L791 PolarHBondContact O-N 3.07Å; S789-L791 VanDerWaalsContact O-N 3.15Å; S789-Q792 WeakPolarHBondContact O-CB 3.33Å; S789-Q792 PolarHBondContact O-N 3.26Å; S789-Q792 WeakPolarHBondContact OG-CG 3.47Å; S789-Q792 PolarHBondContact OG-N 3.39Å; S789-Q792 PolarHBondContact OG-OE1 2.92Å; S789-K793 PolarHBondContact O-N 2.88Å
790	P	79.2	Confident	88.5	Confident	51 Å²	51	26.9 Å²	26.9	33%	0.331	14%	0.136	S	C	.	.	H	α-helix	trans	-51	-37.9	176	-32.2	38.7	0	0	0	114.3	K793 S794 N816	P790-K793 PolarHBondContact O-N 2.97Å; P790-S794 PolarHBondContact O-N 3.34Å; P790-N816 WeakPolarHBondContact CB-O 3.41Å; P790-N816 HydrophobicContact CG-CB 3.93Å; P790-N816 WeakPolarHBondContact CG-OD1 3.22Å
791	L	80	Confident	88.7	Confident	112 Å²	112	29.8 Å²	29.8	59%	0.586	15%	0.149	S	C	*	.	H	α-helix	trans	-64	-49.6	175.9	-177.1	62.6	0	0	0	110.8	S789 K793 S794 E795	S789-L791 PolarHBondContact O-N 3.07Å; S789-L791 VanDerWaalsContact O-N 3.15Å; L791-K793 VanDerWaalsContact C-N 3.32Å; L791-K793 PolarHBondContact O-N 2.98Å; L791-S794 WeakPolarHBondContact O-CA 3.19Å; L791-S794 WeakPolarHBondContact O-CB 3.34Å; L791-S794 PolarHBondContact O-N 3.43Å; L791-S794 PolarHBondContact O-OG 2.91Å; L791-E795 PolarHBondContact O-N 3.07Å
792	Q	85.6	Confident	88.8	Confident	26 Å²	26	34 Å²	34	12%	0.121	17%	0.167	C	C	.	.	H	α-helix	trans	-61.4	-36.8	177.9	-71.8	167.9	-59.2	0	0	112.6	G758 L761 V788 S789 S794 E795 I796	G758-Q792 PolarHBondContact O-NE2 3.1Å; L761-Q792 HydrophobicContact CD2-CB 4.04Å; L761-Q792 HydrophobicContact CD2-CG 4.44Å; V788-Q792 HydrophobicContact CB-CB 4.4Å; S789-Q792 WeakPolarHBondContact O-CB 3.33Å; S789-Q792 PolarHBondContact O-N 3.26Å; S789-Q792 WeakPolarHBondContact OG-CG 3.47Å; S789-Q792 PolarHBondContact OG-N 3.39Å; S789-Q792 PolarHBondContact OG-OE1 2.92Å; Q792-S794 VanDerWaalsContact C-N 3.28Å; Q792-S794 PolarHBondContact O-N 2.93Å; Q792-E795 PolarHBondContact O-N 2.77Å; Q792-I796 WeakPolarHBondContact O-CG1 3.2Å; Q792-I796 PolarHBondContact O-N 3.01Å
793	K	89.5	Confident	88.7	Confident	6 Å²	6	38.2 Å²	38.2	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-55.4	-46.1	171.8	-59.9	-166.6	-166.3	-170.1	0	111	D420 L696 V788 S789 P790 L791 V797 D817 M820	D420-K793 IonicContact OD1-NZ 2.67Å; D420-K793 PolarHBondContact OD1-NZ 2.89Å; L696-K793 HydrophobicContact CB-CD 4.41Å; L696-K793 HydrophobicContact CB-CG 4.23Å; L696-K793 HydrophobicContact CD1-CB 4.47Å; L696-K793 WeakPolarHBondContact O-CD 3.29Å; L696-K793 WeakPolarHBondContact O-CE 3.33Å; L696-K793 PolarHBondContact O-NZ 3.03Å; V788-K793 HydrophobicContact CG2-CG 3.81Å; S789-K793 PolarHBondContact O-N 2.88Å; P790-K793 PolarHBondContact O-N 2.97Å; L791-K793 VanDerWaalsContact C-N 3.32Å; L791-K793 PolarHBondContact O-N 2.98Å; K793-V797 WeakPolarHBondContact O-CG2 3.33Å; K793-V797 PolarHBondContact O-N 3.12Å; K793-D817 WeakPolarHBondContact CD-OD1 3.28Å; K793-D817 IonicContact NZ-OD1 2.86Å; K793-D817 PolarHBondContact NZ-OD1 2.93Å; K793-M820 HydrophobicContact CB-CB 4.08Å; K793-M820 HydrophobicContact CB-CG 4.21Å; K793-M820 HydrophobicContact CB-SD 4.15Å; K793-M820 HydrophobicContact CD-SD 4.27Å
794	S	88.8	Confident	88.2	Confident	19 Å²	19	40.2 Å²	40.2	13%	0.133	20%	0.199	C	C	.	.	H	α-helix	trans	-66.9	-39.7	177.7	77.5	0	0	0	0	113	P790 L791 Q792 V797 D798 G819	P790-S794 PolarHBondContact O-N 3.34Å; L791-S794 WeakPolarHBondContact O-CA 3.19Å; L791-S794 WeakPolarHBondContact O-CB 3.34Å; L791-S794 PolarHBondContact O-N 3.43Å; L791-S794 PolarHBondContact O-OG 2.91Å; Q792-S794 VanDerWaalsContact C-N 3.28Å; Q792-S794 PolarHBondContact O-N 2.93Å; S794-V797 PolarHBondContact O-N 3.41Å; S794-D798 PolarHBondContact O-N 2.57Å; S794-G819 WeakPolarHBondContact CB-O 3.22Å
795	E	90.8	Very high	87.7	Confident	75 Å²	75	48.8 Å²	48.8	35%	0.35	24%	0.236	S	C	.	.	H	α-helix	trans	-65.5	-39.1	178.8	-70.7	-176.2	176.8	0	0	112.8	L765 L791 Q792 D798 M799	L765-E795 HydrophobicContact CD1-CB 4.17Å; L791-E795 PolarHBondContact O-N 3.07Å; Q792-E795 PolarHBondContact O-N 2.77Å; E795-D798 PolarHBondContact O-N 2.91Å; E795-M799 VanDerWaalsContact O-CB 3.3Å; E795-M799 WeakPolarHBondContact O-CB 3.46Å; E795-M799 PolarHBondContact O-N 2.95Å
796	I	93.1	Very high	87.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.8	-46.7	173.9	-68	159.7	0	0	0	110.6	F418 W694 L696 L761 L765 C785 Q792 M799 V800	F418-I796 HydrophobicContact CD1-CG2 4.45Å; F418-I796 HydrophobicContact CE1-CG2 3.93Å; W694-I796 HydrophobicContact CE3-CG2 3.93Å; W694-I796 HydrophobicContact CZ3-CG2 3.82Å; L696-I796 HydrophobicContact CD1-CB 4.18Å; L696-I796 HydrophobicContact CD1-CD1 4.1Å; L696-I796 HydrophobicContact CD1-CG2 4.06Å; L696-I796 HydrophobicContact CD2-CD1 3.86Å; L696-I796 HydrophobicContact CD2-CG2 4.37Å; L761-I796 HydrophobicContact CD1-CD1 4.24Å; L761-I796 HydrophobicContact CD1-CG1 4.29Å; L761-I796 HydrophobicContact CD2-CD1 3.55Å; L761-I796 HydrophobicContact CD2-CG1 4.2Å; L765-I796 HydrophobicContact CD1-CG1 4.37Å; L765-I796 HydrophobicContact CD2-CG1 4.42Å; C785-I796 HydrophobicContact CB-CD1 4.43Å; Q792-I796 WeakPolarHBondContact O-CG1 3.2Å; Q792-I796 PolarHBondContact O-N 3.01Å; I796-M799 PolarHBondContact O-N 3.28Å; I796-V800 PolarHBondContact O-N 3.15Å
797	V	93.3	Very high	87.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.4	-42.6	179.6	176.1	0	0	0	0	111.2	F418 L696 K793 S794 K801 M820 T823 A824	F418-V797 HydrophobicContact CB-CG2 4.09Å; F418-V797 HydrophobicContact CD1-CG2 3.98Å; F418-V797 HydrophobicContact CD2-CG1 4.38Å; F418-V797 HydrophobicContact CD2-CG2 3.7Å; F418-V797 HydrophobicContact CE1-CG2 4.32Å; F418-V797 HydrophobicContact CE2-CG1 4.38Å; F418-V797 HydrophobicContact CE2-CG2 4.08Å; F418-V797 HydrophobicContact CG-CG2 3.64Å; F418-V797 HydrophobicContact CZ-CG2 4.37Å; L696-V797 HydrophobicContact CD1-CG2 4.49Å; K793-V797 WeakPolarHBondContact O-CG2 3.33Å; K793-V797 PolarHBondContact O-N 3.12Å; S794-V797 PolarHBondContact O-N 3.41Å; V797-K801 WeakPolarHBondContact O-CB 3.33Å; V797-K801 PolarHBondContact O-N 3.04Å; V797-M820 HydrophobicContact CG2-CG 3.62Å; V797-M820 HydrophobicContact CG2-SD 4.48Å; V797-T823 HydrophobicContact CB-CG2 4.27Å; V797-T823 HydrophobicContact CG1-CG2 4.11Å; V797-A824 HydrophobicContact CG1-CB 3.93Å
798	D	91.8	Very high	88.3	Confident	43 Å²	43	43.9 Å²	43.9	23%	0.23	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-40.9	176.3	-175.2	61.4	0	0	0	112.5	S794 E795 K801 K802 T823	S794-D798 PolarHBondContact O-N 2.57Å; E795-D798 PolarHBondContact O-N 2.91Å; D798-K801 PolarHBondContact O-N 3.13Å; D798-K802 VanDerWaalsContact CG-NZ 3.26Å; D798-K802 WeakPolarHBondContact O-CB 3.38Å; D798-K802 WeakPolarHBondContact O-CG 3.48Å; D798-K802 PolarHBondContact O-N 3.32Å; D798-K802 WeakPolarHBondContact OD1-CD 3.28Å; D798-K802 WeakPolarHBondContact OD1-CE 3.49Å; D798-K802 IonicContact OD1-NZ 2.78Å; D798-K802 PolarHBondContact OD1-NZ 3.22Å; D798-K802 VanDerWaalsContact OD1-NZ 3.09Å; D798-K802 WeakPolarHBondContact OD2-CD 3.34Å; D798-K802 VanDerWaalsContact OD2-CE 3.28Å; D798-K802 WeakPolarHBondContact OD2-CE 3.46Å; D798-K802 IonicContact OD2-NZ 3.61Å; D798-K802 PolarHBondContact OD2-NZ 2.97Å; D798-T823 HydrophobicContact CB-CG2 3.78Å
799	M	92.1	Very high	88.9	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.015	22%	0.22	C	C	.	.	H	α-helix	trans	-57.1	-55.9	174.2	177.3	-170.4	64.4	0	0	110.8	L765 R770 F773 L774 E795 I796 K801 K802 H803	L765-M799 HydrophobicContact CD2-CE 4.35Å; L765-M799 HydrophobicContact CD2-SD 3.96Å; R770-M799 HydrophobicContact CG-CG 3.93Å; R770-M799 HydrophobicContact CG-SD 3.54Å; R770-M799 VanDerWaalsContact CG-SD 3.54Å; F773-M799 HydrophobicContact CD1-CE 3.91Å; F773-M799 HydrophobicContact CD1-SD 4.15Å; F773-M799 HydrophobicContact CE1-CE 3.75Å; L774-M799 HydrophobicContact CB-CE 4.49Å; L774-M799 HydrophobicContact CB-SD 4.2Å; L774-M799 HydrophobicContact CD1-CE 4.12Å; E795-M799 VanDerWaalsContact O-CB 3.3Å; E795-M799 WeakPolarHBondContact O-CB 3.46Å; E795-M799 PolarHBondContact O-N 2.95Å; I796-M799 PolarHBondContact O-N 3.28Å; M799-K801 VanDerWaalsContact C-N 3.34Å; M799-K801 PolarHBondContact O-N 2.97Å; M799-K802 PolarHBondContact O-N 2.86Å; M799-H803 PolarHBondContact O-N 3.32Å; M799-H803 VanDerWaalsContact O-N 3.07Å; M799-H803 PolarHBondContact O-ND1 2.97Å
800	V	92.9	Very high	89.7	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-62.5	-43.5	-179.2	174.1	0	0	0	0	110.8	Y416 F418 W694 L774 I796 K802 V804 T808	Y416-V800 HydrophobicContact CD1-CG1 4.32Å; Y416-V800 HydrophobicContact CD2-CG1 4.21Å; Y416-V800 HydrophobicContact CG-CG1 4.11Å; F418-V800 HydrophobicContact CE1-CG2 4.37Å; F418-V800 HydrophobicContact CZ-CB 3.82Å; F418-V800 HydrophobicContact CZ-CG1 3.93Å; F418-V800 HydrophobicContact CZ-CG2 3.91Å; W694-V800 HydrophobicContact CH2-CG2 3.68Å; W694-V800 HydrophobicContact CZ2-CG2 4.4Å; W694-V800 HydrophobicContact CZ3-CG2 3.82Å; L774-V800 HydrophobicContact CD1-CG2 4.06Å; I796-V800 PolarHBondContact O-N 3.15Å; V800-K802 PolarHBondContact O-N 2.95Å; V800-V804 HydrophobicContact CG1-CB 4.3Å; V800-V804 HydrophobicContact CG1-CG2 3.94Å; V800-V804 VanDerWaalsContact O-CB 3.25Å; V800-V804 WeakPolarHBondContact O-CB 3.34Å; V800-V804 WeakPolarHBondContact O-CG2 3.48Å; V800-V804 PolarHBondContact O-N 3.1Å; V800-T808 HydrophobicContact CG1-CG2 4.16Å
801	K	91.7	Very high	90.5	Very high	62 Å²	62	39 Å²	39	27%	0.27	19%	0.188	S	C	.	.	H	α-helix	trans	-54.7	-49.5	176.4	171.9	171.8	-168.7	-174.4	0	112.8	V797 D798 M799 T808 T823	V797-K801 WeakPolarHBondContact O-CB 3.33Å; V797-K801 PolarHBondContact O-N 3.04Å; D798-K801 PolarHBondContact O-N 3.13Å; M799-K801 VanDerWaalsContact C-N 3.34Å; M799-K801 PolarHBondContact O-N 2.97Å; K801-T808 HydrophobicContact CB-CG2 4.45Å; K801-T823 WeakPolarHBondContact CD-O 3.45Å; K801-T823 PolarHBondContact NZ-O 3.05Å
802	K	89.3	Confident	91	Very high	131 Å²	131	33.6 Å²	33.6	57%	0.57	16%	0.16	S	C	*	.	H	α-helix	trans	-73.1	-43.4	-176.8	-75.6	173.9	175.9	159.7	0	113.2	D798 M799 V800	D798-K802 VanDerWaalsContact CG-NZ 3.26Å; D798-K802 WeakPolarHBondContact O-CB 3.38Å; D798-K802 WeakPolarHBondContact O-CG 3.48Å; D798-K802 PolarHBondContact O-N 3.32Å; D798-K802 WeakPolarHBondContact OD1-CD 3.28Å; D798-K802 WeakPolarHBondContact OD1-CE 3.49Å; D798-K802 IonicContact OD1-NZ 2.78Å; D798-K802 PolarHBondContact OD1-NZ 3.22Å; D798-K802 VanDerWaalsContact OD1-NZ 3.09Å; D798-K802 WeakPolarHBondContact OD2-CD 3.34Å; D798-K802 VanDerWaalsContact OD2-CE 3.28Å; D798-K802 WeakPolarHBondContact OD2-CE 3.46Å; D798-K802 IonicContact OD2-NZ 3.61Å; D798-K802 PolarHBondContact OD2-NZ 2.97Å; M799-K802 PolarHBondContact O-N 2.86Å; V800-K802 PolarHBondContact O-N 2.95Å
803	H	87.4	Confident	91	Very high	88 Å²	88	32.4 Å²	32.4	41%	0.407	16%	0.155	S	C	.	.	H	α-helix	trans	-86.4	-41.2	-171	-61.8	81.2	0	0	0	112.8	L774 M799	L774-H803 HydrophobicContact CD2-CB 3.44Å; L774-H803 VanDerWaalsContact CD2-CB 3.44Å; M799-H803 PolarHBondContact O-N 3.32Å; M799-H803 VanDerWaalsContact O-N 3.07Å; M799-H803 PolarHBondContact O-ND1 2.97Å
804	V	85.6	Confident	90.3	Very high	43 Å²	43	32.3 Å²	32.3	26%	0.261	16%	0.156	S	C	.	.	H	α-helix	trans	-85.3	-20.6	-173.4	-169.4	0	0	0	0	112.2	Y416 L774 L778 V800 A806	Y416-V804 HydrophobicContact CE2-CG1 3.81Å; L774-V804 HydrophobicContact CD1-CG2 4.08Å; L774-V804 HydrophobicContact CD2-CG2 4.44Å; L778-V804 HydrophobicContact CD1-CG2 4.15Å; L778-V804 HydrophobicContact CD2-CG1 4.31Å; L778-V804 HydrophobicContact CD2-CG2 3.98Å; V800-V804 HydrophobicContact CG1-CB 4.3Å; V800-V804 HydrophobicContact CG1-CG2 3.94Å; V800-V804 VanDerWaalsContact O-CB 3.25Å; V800-V804 WeakPolarHBondContact O-CB 3.34Å; V800-V804 WeakPolarHBondContact O-CG2 3.48Å; V800-V804 PolarHBondContact O-N 3.1Å; V804-A806 HydrophobicContact CG1-CB 4.11Å; V804-A806 PolarHBondContact O-N 2.94Å; V804-A806 VanDerWaalsContact O-N 3.13Å
805	K	82.8	Confident	89.4	Confident	181 Å²	181	32.1 Å²	32.1	79%	0.787	16%	0.155	S	C	*	.			trans	55.1	26.8	180	-55.6	177.8	-176	172.7	0	113.9
806	A	88.5	Confident	88.7	Confident	16 Å²	16	30.9 Å²	30.9	13%	0.132	15%	0.151	C	C	.	.			trans	-102.1	156.3	174.9	0	0	0	0	0	110.6	K415 Y416 V804 H825	K415-A806 HydrophobicContact CB-CB 4.23Å; K415-A806 HydrophobicContact CD-CB 4.41Å; Y416-A806 HydrophobicContact CD2-CB 3.98Å; Y416-A806 HydrophobicContact CE2-CB 3.9Å; V804-A806 HydrophobicContact CG1-CB 4.11Å; V804-A806 PolarHBondContact O-N 2.94Å; V804-A806 VanDerWaalsContact O-N 3.13Å; A806-H825 PolarHBondContact O-CE1 3.12Å; A806-H825 VanDerWaalsContact O-CE1 3.29Å
807	I	93.8	Very high	88.2	Confident	12 Å²	12	31 Å²	31	6%	0.062	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	130.8	177.9	-53.4	-47.9	0	0	0	109.5	N299 E410 Q413 V414 K415 Y416 H825	N299-I807 HydrophobicContact CB-CD1 4.16Å; E410-I807 HydrophobicContact CB-CG2 4.36Å; E410-I807 VanDerWaalsContact OE2-CD1 3.27Å; E410-I807 WeakPolarHBondContact OE2-CD1 3.25Å; Q413-I807 HydrophobicContact CB-CB 4.26Å; Q413-I807 HydrophobicContact CB-CG1 3.79Å; V414-I807 HydrophobicContact CG2-CG2 4.34Å; K415-I807 PolarHBondContact N-O 2.88Å; Y416-I807 PolarHBondContact N-O 2.89Å; I807-H825 HydrophobicContact CG2-CB 3.88Å
808	T	95.5	Very high	87.6	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	128.9	-173.8	55.5	0	0	0	0	109.9	F418 V800 K801 H825 V826	F418-T808 HydrophobicContact CE2-CG2 3.85Å; V800-T808 HydrophobicContact CG1-CG2 4.16Å; K801-T808 HydrophobicContact CB-CG2 4.45Å; T808-H825 PolarHBondContact N-ND1 3.15Å; T808-H825 WeakPolarHBondContact O-CB 3.25Å; T808-H825 PolarHBondContact O-N 3.07Å; T808-H825 PolarHBondContact OG1-N 3.15Å; T808-H825 PolarHBondContact OG1-ND1 2.73Å; T808-V826 PolarHBondContact O-N 3.18Å; T808-V826 VanDerWaalsContact O-N 3.08Å
809	L	97.1	Very high	87.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	137.7	170.6	-169.1	150.6	0	0	0	109.2	L411 V414 Y416 L417 F418 I811 V826 V828 L852 L856	L411-L809 HydrophobicContact CD2-CD1 4.11Å; V414-L809 HydrophobicContact CB-CB 4.48Å; V414-L809 HydrophobicContact CG1-CB 3.58Å; V414-L809 HydrophobicContact CG2-CB 4.02Å; V414-L809 HydrophobicContact CG2-CD1 4.01Å; Y416-L809 PolarHBondContact O-N 2.89Å; L417-L809 WeakPolarHBondContact CA-O 3.49Å; L417-L809 HydrophobicContact CD1-CB 4.39Å; L417-L809 HydrophobicContact CD1-CD2 3.39Å; L417-L809 HydrophobicContact CD1-CG 4.45Å; F418-L809 WeakPolarHBondContact CD2-O 3.09Å; F418-L809 PolarHBondContact N-O 3.4Å; L809-I811 HydrophobicContact CD2-CB 4.21Å; L809-V826 VanDerWaalsContact CA-O 3.29Å; L809-V826 WeakPolarHBondContact CA-O 3.3Å; L809-V826 HydrophobicContact CB-CB 4.43Å; L809-V826 HydrophobicContact CD1-CB 4.14Å; L809-V826 HydrophobicContact CD1-CG1 3.83Å; L809-V826 HydrophobicContact CG-CB 4.12Å; L809-V826 HydrophobicContact CG-CG1 4.09Å; L809-V828 HydrophobicContact CD1-CG2 3.81Å; L809-V828 HydrophobicContact CD2-CB 4.21Å; L809-V828 HydrophobicContact CD2-CG2 3.75Å; L809-V828 HydrophobicContact CG-CG2 4.03Å; L809-L852 HydrophobicContact CD1-CD1 4.25Å; L809-L852 HydrophobicContact CD2-CD1 4.32Å; L809-L856 HydrophobicContact CD1-CD2 3.87Å
810	A	96.1	Very high	87.1	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	138.6	168	0	0	0	0	0	110.3	F418 M820 I821 A824 V826 V828	F418-A810 HydrophobicContact CB-CB 4.38Å; F418-A810 CarbonylContact O-C 3.55Å; F418-A810 VanDerWaalsContact O-CA 3.3Å; F418-A810 WeakPolarHBondContact O-CA 3.24Å; A810-M820 HydrophobicContact CB-CE 4.29Å; A810-M820 HydrophobicContact CB-CG 3.76Å; A810-M820 HydrophobicContact CB-SD 4.38Å; A810-I821 HydrophobicContact CB-CG1 4.37Å; A810-A824 HydrophobicContact CB-CB 3.55Å; A810-V826 PolarHBondContact N-O 2.96Å; A810-V828 PolarHBondContact O-N 3.45Å
811	I	95.5	Very high	86.9	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	138.1	175.4	-168.5	165.8	0	0	0	111	L417 F418 D420 T424 L809 M820 V828 I830 I846 F849 L852	L417-I811 HydrophobicContact CD1-CG2 3.86Å; F418-I811 PolarHBondContact O-N 2.65Å; D420-I811 PolarHBondContact N-O 3.34Å; T424-I811 HydrophobicContact CG2-CG1 4.34Å; T424-I811 HydrophobicContact CG2-CG2 4.17Å; L809-I811 HydrophobicContact CD2-CB 4.21Å; I811-M820 WeakPolarHBondContact O-CE 3.44Å; I811-V828 WeakPolarHBondContact CA-O 3.47Å; I811-V828 HydrophobicContact CB-CB 4.21Å; I811-V828 HydrophobicContact CD1-CB 4.16Å; I811-V828 HydrophobicContact CD1-CG1 3.73Å; I811-V828 HydrophobicContact CG1-CB 3.99Å; I811-V828 HydrophobicContact CG1-CG1 3.93Å; I811-I830 HydrophobicContact CD1-CD1 3.84Å; I811-I830 HydrophobicContact CD1-CG1 3.97Å; I811-I830 HydrophobicContact CG1-CD1 4.1Å; I811-I830 HydrophobicContact CG1-CG1 4.13Å; I811-I846 HydrophobicContact CD1-CD1 4.11Å; I811-F849 HydrophobicContact CD1-CD2 4.04Å; I811-F849 HydrophobicContact CD1-CE2 4.44Å; I811-F849 HydrophobicContact CG2-CD2 4.47Å; I811-F849 HydrophobicContact CG2-CE2 4.03Å; I811-L852 HydrophobicContact CD1-CD2 4.12Å
812	G	90.8	Very high	86.7	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.6	166.2	-178.3	0	0	0	0	0	110.9	T424 D817 V828 G829 I830 A838	T424-G812 VanDerWaalsContact OG1-CA 3.22Å; T424-G812 WeakPolarHBondContact OG1-CA 3.42Å; G812-D817 WeakPolarHBondContact CA-OD2 3.48Å; G812-V828 PolarHBondContact N-O 3.45Å; G812-G829 CarbonylContact O-C 3.55Å; G812-G829 VanDerWaalsContact O-CA 3.31Å; G812-G829 WeakPolarHBondContact O-CA 3.43Å; G812-I830 PolarHBondContact O-N 3.49Å; G812-A838 WeakPolarHBondContact O-CB 3.32Å
813	D	85.2	Confident	86.8	Confident	1 Å²	1	24.6 Å²	24.6	1%	0.005	13%	0.134	C	C	.	.			trans	-123.1	-35.8	176.1	56.3	-48.7	0	0	0	114.1	G423 T424 I830 E834 A838	G423-D813 WeakPolarHBondContact CA-OD1 3.02Å; G423-D813 VanDerWaalsContact CA-OD2 3.25Å; G423-D813 WeakPolarHBondContact CA-OD2 3.41Å; T424-D813 PolarHBondContact N-OD1 3.31Å; T424-D813 PolarHBondContact OG1-N 2.92Å; T424-D813 PolarHBondContact OG1-OD1 2.69Å; D813-I830 HydrophobicContact CB-CB 3.88Å; D813-I830 HydrophobicContact CB-CG2 3.95Å; D813-I830 WeakPolarHBondContact CB-O 3.24Å; D813-E834 WeakPolarHBondContact OD2-CG 3.22Å; D813-A838 VanDerWaalsContact C-CB 3.4Å; D813-A838 WeakPolarHBondContact O-CB 3.24Å; D813-A838 PolarHBondContact O-N 3.48Å
814	G	74.6	Confident	87	Confident	4 Å²	4	20.4 Å²	20.4	4%	0.041	12%	0.115	C	C	.	.	S	Bend	trans	-70.8	160.8	177.5	0	0	0	0	0	114.7	N816 D817	G814-N816 PolarHBondContact O-N 3.27Å; G814-D817 PolarHBondContact O-N 3.39Å; G814-D817 VanDerWaalsContact O-N 3.11Å
815	A	70.4	Confident	87.4	Confident	15 Å²	15	20.4 Å²	20.4	12%	0.124	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-63	-30.9	177.8	0	0	0	0	0	112.6	D199 D817 V818 Q837	D199-A815 CarbonylContact O-C 3.51Å; D199-A815 PolarHBondContact O-N 2.7Å; A815-D817 PolarHBondContact O-N 3.48Å; A815-V818 WeakPolarHBondContact O-CB 3.47Å; A815-V818 WeakPolarHBondContact O-CG2 3.2Å; A815-V818 PolarHBondContact O-N 2.8Å; A815-Q837 HydrophobicContact CB-CB 4.08Å
816	N	75.7	Confident	88	Confident	48 Å²	48	11.8 Å²	11.8	26%	0.257	8%	0.075	S	C	.	.	G	3₁₀ helix	trans	-50.3	-26.5	170.9	-80.9	-28.7	0	0	0	113.8	D199 P790 G814	D199-N816 WeakPolarHBondContact O-CB 3.43Å; D199-N816 PolarHBondContact O-N 3.29Å; D199-N816 PolarHBondContact O-ND2 3.15Å; D199-N816 VanDerWaalsContact O-ND2 3.09Å; D199-N816 PolarHBondContact O-OD1 3.5Å; P790-N816 WeakPolarHBondContact CB-O 3.41Å; P790-N816 HydrophobicContact CG-CB 3.93Å; P790-N816 WeakPolarHBondContact CG-OD1 3.22Å; G814-N816 PolarHBondContact O-N 3.27Å
817	D	82.1	Confident	88.3	Confident	4 Å²	4	11 Å²	11	2%	0.021	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-93.1	-8.9	-179.2	-64.2	-41.5	0	0	0	114.3	D420 K793 G812 G814 A815 G819 M820 I821	D420-D817 WeakPolarHBondContact CB-OD2 3.45Å; K793-D817 WeakPolarHBondContact CD-OD1 3.28Å; K793-D817 IonicContact NZ-OD1 2.86Å; K793-D817 PolarHBondContact NZ-OD1 2.93Å; G812-D817 WeakPolarHBondContact CA-OD2 3.48Å; G814-D817 PolarHBondContact O-N 3.39Å; G814-D817 VanDerWaalsContact O-N 3.11Å; A815-D817 PolarHBondContact O-N 3.48Å; D817-G819 VanDerWaalsContact C-N 3.25Å; D817-G819 PolarHBondContact O-N 3.25Å; D817-M820 HydrophobicContact CB-CE 4.05Å; D817-M820 WeakPolarHBondContact O-CA 3.35Å; D817-M820 WeakPolarHBondContact O-CB 3.28Å; D817-M820 PolarHBondContact O-N 2.93Å; D817-I821 HydrophobicContact CB-CD1 3.93Å; D817-I821 HydrophobicContact CB-CG1 4.41Å; D817-I821 WeakPolarHBondContact O-CB 3.39Å; D817-I821 WeakPolarHBondContact O-CG1 3.21Å; D817-I821 PolarHBondContact O-N 3.46Å
818	V	81.6	Confident	88.4	Confident	19 Å²	19	10.5 Å²	10.5	12%	0.115	7%	0.066	C	C	.	.	H	α-helix	trans	-57.1	-39.5	-178.2	171.5	0	0	0	0	111.6	A815 M820 I821 Q822	A815-V818 WeakPolarHBondContact O-CB 3.47Å; A815-V818 WeakPolarHBondContact O-CG2 3.2Å; A815-V818 PolarHBondContact O-N 2.8Å; V818-M820 PolarHBondContact O-N 2.96Å; V818-I821 PolarHBondContact O-N 2.96Å; V818-Q822 HydrophobicContact CG1-CG 4.24Å; V818-Q822 WeakPolarHBondContact O-CB 3.5Å; V818-Q822 VanDerWaalsContact O-CG 3.28Å; V818-Q822 WeakPolarHBondContact O-CG 3.44Å; V818-Q822 PolarHBondContact O-N 3.47Å
819	G	82.6	Confident	88.2	Confident	29 Å²	29	10.5 Å²	10.5	30%	0.299	7%	0.066	S	C	.	.	H	α-helix	trans	-65	-36.1	175.1	0	0	0	0	0	113.6	S794 D817 T823	S794-G819 WeakPolarHBondContact CB-O 3.22Å; D817-G819 VanDerWaalsContact C-N 3.25Å; D817-G819 PolarHBondContact O-N 3.25Å; G819-T823 VanDerWaalsContact O-CB 3.23Å; G819-T823 WeakPolarHBondContact O-CB 3.27Å; G819-T823 PolarHBondContact O-N 2.99Å; G819-T823 PolarHBondContact O-OG1 3.35Å
820	M	89.5	Confident	87.8	Confident	0 Å²	0	10.5 Å²	10.5	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-69.7	-48.2	175.9	-168.2	-178.2	53.3	0	0	110.8	F418 L696 K793 V797 A810 I811 D817 V818 T823 A824	F418-M820 HydrophobicContact CB-SD 3.99Å; L696-M820 HydrophobicContact CB-SD 4.37Å; L696-M820 HydrophobicContact CD1-SD 3.9Å; K793-M820 HydrophobicContact CB-CB 4.08Å; K793-M820 HydrophobicContact CB-CG 4.21Å; K793-M820 HydrophobicContact CB-SD 4.15Å; K793-M820 HydrophobicContact CD-SD 4.27Å; V797-M820 HydrophobicContact CG2-CG 3.62Å; V797-M820 HydrophobicContact CG2-SD 4.48Å; A810-M820 HydrophobicContact CB-CE 4.29Å; A810-M820 HydrophobicContact CB-CG 3.76Å; A810-M820 HydrophobicContact CB-SD 4.38Å; I811-M820 WeakPolarHBondContact O-CE 3.44Å; D817-M820 HydrophobicContact CB-CE 4.05Å; D817-M820 WeakPolarHBondContact O-CA 3.35Å; D817-M820 WeakPolarHBondContact O-CB 3.28Å; D817-M820 PolarHBondContact O-N 2.93Å; V818-M820 PolarHBondContact O-N 2.96Å; M820-T823 PolarHBondContact O-N 3.47Å; M820-A824 PolarHBondContact O-N 3.43Å
821	I	89.9	Confident	87.1	Confident	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.3	-42.9	-179.5	-71.8	170.8	0	0	0	111.9	K296 A810 D817 V818 V828 A838	K296-I821 PolarHBondContact NZ-O 3.02Å; A810-I821 HydrophobicContact CB-CG1 4.37Å; D817-I821 HydrophobicContact CB-CD1 3.93Å; D817-I821 HydrophobicContact CB-CG1 4.41Å; D817-I821 WeakPolarHBondContact O-CB 3.39Å; D817-I821 WeakPolarHBondContact O-CG1 3.21Å; D817-I821 PolarHBondContact O-N 3.46Å; V818-I821 PolarHBondContact O-N 2.96Å; I821-V828 WeakPolarHBondContact CD1-O 3.03Å; I821-A838 HydrophobicContact CD1-CB 3.6Å
822	Q	87.2	Confident	85.8	Confident	21 Å²	21	12.9 Å²	12.9	10%	0.098	9%	0.087	C	C	.	.	H	α-helix	trans	-68.9	-34	175.5	-72.6	-176.9	12.7	0	0	112.4	T291 P294 K296 V818	T291-Q822 VanDerWaalsContact OG1-CD 3.26Å; T291-Q822 PolarHBondContact OG1-NE2 3.41Å; T291-Q822 PolarHBondContact OG1-OE1 3.38Å; P294-Q822 HydrophobicContact CG-CB 4.24Å; K296-Q822 WeakPolarHBondContact CE-O 3.16Å; V818-Q822 HydrophobicContact CG1-CG 4.24Å; V818-Q822 WeakPolarHBondContact O-CB 3.5Å; V818-Q822 VanDerWaalsContact O-CG 3.28Å; V818-Q822 WeakPolarHBondContact O-CG 3.44Å; V818-Q822 PolarHBondContact O-N 3.47Å
823	T	90.2	Very high	84.2	Confident	35 Å²	35	19.4 Å²	19.4	22%	0.215	12%	0.122	C	C	.	.	H	α-helix	trans	-77.2	-32.8	-177.4	-61	0	0	0	0	113	V797 D798 K801 G819 M820	V797-T823 HydrophobicContact CB-CG2 4.27Å; V797-T823 HydrophobicContact CG1-CG2 4.11Å; D798-T823 HydrophobicContact CB-CG2 3.78Å; K801-T823 WeakPolarHBondContact CD-O 3.45Å; K801-T823 PolarHBondContact NZ-O 3.05Å; G819-T823 VanDerWaalsContact O-CB 3.23Å; G819-T823 WeakPolarHBondContact O-CB 3.27Å; G819-T823 PolarHBondContact O-N 2.99Å; G819-T823 PolarHBondContact O-OG1 3.35Å; M820-T823 PolarHBondContact O-N 3.47Å
824	A	93.5	Very high	82.8	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	-62	157	176.4	0	0	0	0	0	113.5	K296 V797 A810 M820 V826	K296-A824 VanDerWaalsContact CE-O 3.24Å; K296-A824 WeakPolarHBondContact CE-O 3.49Å; K296-A824 PolarHBondContact NZ-O 2.88Å; V797-A824 HydrophobicContact CG1-CB 3.93Å; A810-A824 HydrophobicContact CB-CB 3.55Å; M820-A824 PolarHBondContact O-N 3.43Å; A824-V826 VanDerWaalsContact C-N 3.26Å; A824-V826 VanDerWaalsContact CB-O 3.23Å; A824-V826 WeakPolarHBondContact CB-O 3.39Å; A824-V826 PolarHBondContact O-N 2.98Å
825	H	94.1	Very high	82.1	Confident	44 Å²	44	20.8 Å²	20.8	20%	0.204	13%	0.131	C	C	.	.	S	Bend	trans	-63.2	-36.4	172.6	-68.1	96	0	0	0	111.6	A806 I807 T808	A806-H825 PolarHBondContact O-CE1 3.12Å; A806-H825 VanDerWaalsContact O-CE1 3.29Å; I807-H825 HydrophobicContact CG2-CB 3.88Å; T808-H825 PolarHBondContact N-ND1 3.15Å; T808-H825 WeakPolarHBondContact O-CB 3.25Å; T808-H825 PolarHBondContact O-N 3.07Å; T808-H825 PolarHBondContact OG1-N 3.15Å; T808-H825 PolarHBondContact OG1-ND1 2.73Å
826	V	95.3	Very high	81.9	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	130.8	170.3	178.2	0	0	0	0	108.8	E410 L411 T808 L809 A810 A824 V828 Y844	E410-V826 HydrophobicContact CB-CG2 3.66Å; L411-V826 HydrophobicContact CD2-CG1 3.9Å; T808-V826 PolarHBondContact O-N 3.18Å; T808-V826 VanDerWaalsContact O-N 3.08Å; L809-V826 VanDerWaalsContact CA-O 3.29Å; L809-V826 WeakPolarHBondContact CA-O 3.3Å; L809-V826 HydrophobicContact CB-CB 4.43Å; L809-V826 HydrophobicContact CD1-CB 4.14Å; L809-V826 HydrophobicContact CD1-CG1 3.83Å; L809-V826 HydrophobicContact CG-CB 4.12Å; L809-V826 HydrophobicContact CG-CG1 4.09Å; A810-V826 PolarHBondContact N-O 2.96Å; A824-V826 VanDerWaalsContact C-N 3.26Å; A824-V826 VanDerWaalsContact CB-O 3.23Å; A824-V826 WeakPolarHBondContact CB-O 3.39Å; A824-V826 PolarHBondContact O-N 2.98Å; V826-V828 HydrophobicContact CG1-CG2 4.38Å; V826-Y844 HydrophobicContact CG1-CD2 3.67Å; V826-Y844 HydrophobicContact CG1-CE2 3.61Å
827	G	94.2	Very high	81.4	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125.1	171.3	0	0	0	0	0	110.8	D843 Y844	G827-D843 PolarHBondContact N-OD2 2.96Å; G827-D843 WeakPolarHBondContact O-CA 3.39Å; G827-D843 WeakPolarHBondContact O-CB 3.34Å; G827-D843 PolarHBondContact O-N 3.3Å; G827-Y844 PolarHBondContact O-N 3.03Å; G827-Y844 VanDerWaalsContact O-N 3.15Å
828	V	95.1	Very high	80.8	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	132.2	170.9	-179.4	0	0	0	0	108.1	L809 A810 I811 G812 I821 V826 Y844 I846 L852 L855	L809-V828 HydrophobicContact CD1-CG2 3.81Å; L809-V828 HydrophobicContact CD2-CB 4.21Å; L809-V828 HydrophobicContact CD2-CG2 3.75Å; L809-V828 HydrophobicContact CG-CG2 4.03Å; A810-V828 PolarHBondContact O-N 3.45Å; I811-V828 WeakPolarHBondContact CA-O 3.47Å; I811-V828 HydrophobicContact CB-CB 4.21Å; I811-V828 HydrophobicContact CD1-CB 4.16Å; I811-V828 HydrophobicContact CD1-CG1 3.73Å; I811-V828 HydrophobicContact CG1-CB 3.99Å; I811-V828 HydrophobicContact CG1-CG1 3.93Å; G812-V828 PolarHBondContact N-O 3.45Å; I821-V828 WeakPolarHBondContact CD1-O 3.03Å; V826-V828 HydrophobicContact CG1-CG2 4.38Å; V828-Y844 CarbonylContact C-O 3.5Å; V828-Y844 WeakPolarHBondContact CA-O 3.43Å; V828-I846 HydrophobicContact CG1-CD1 3.73Å; V828-I846 HydrophobicContact CG1-CG1 3.8Å; V828-L852 HydrophobicContact CG2-CD1 4.28Å; V828-L855 HydrophobicContact CG2-CD2 4.35Å
829	G	91.6	Very high	80.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.4	173.6	0	0	0	0	0	109.2	G812 S842 Y844 S845 I846	G812-G829 CarbonylContact O-C 3.55Å; G812-G829 VanDerWaalsContact O-CA 3.31Å; G812-G829 WeakPolarHBondContact O-CA 3.43Å; G829-S842 PolarHBondContact N-OG 3.38Å; G829-Y844 PolarHBondContact N-O 2.9Å; G829-S845 VanDerWaalsContact O-CA 3.29Å; G829-S845 WeakPolarHBondContact O-CA 3.5Å; G829-I846 PolarHBondContact O-N 3.38Å
830	I	89.8	Confident	80	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	141.9	166	-79.5	173.5	0	0	0	108.8	T424 I811 G812 D813 G832 T839 I846 F849	T424-I830 HydrophobicContact CG2-CD1 3.99Å; I811-I830 HydrophobicContact CD1-CD1 3.84Å; I811-I830 HydrophobicContact CD1-CG1 3.97Å; I811-I830 HydrophobicContact CG1-CD1 4.1Å; I811-I830 HydrophobicContact CG1-CG1 4.13Å; G812-I830 PolarHBondContact O-N 3.49Å; D813-I830 HydrophobicContact CB-CB 3.88Å; D813-I830 HydrophobicContact CB-CG2 3.95Å; D813-I830 WeakPolarHBondContact CB-O 3.24Å; I830-G832 VanDerWaalsContact C-N 3.34Å; I830-G832 PolarHBondContact O-N 2.94Å; I830-T839 PolarHBondContact O-OG1 2.83Å; I830-I846 CarbonylContact C-O 3.36Å; I830-I846 VanDerWaalsContact CA-O 3.3Å; I830-I846 WeakPolarHBondContact CA-O 3.42Å; I830-I846 HydrophobicContact CG1-CG1 4.12Å; I830-F849 HydrophobicContact CD1-CB 3.97Å; I830-F849 HydrophobicContact CD1-CD2 4.36Å
831	S	80.6	Confident	79.3	Confident	25 Å²	25	29.6 Å²	29.6	18%	0.175	17%	0.167	C	C	.	.			trans	-98.7	60.1	179.6	-59	0	0	0	0	109.8	T839 S845 I846	S831-T839 WeakPolarHBondContact CA-OG1 3.47Å; S831-T839 PolarHBondContact N-OG1 2.95Å; S831-T839 PolarHBondContact OG-OG1 2.71Å; S831-S845 PolarHBondContact OG-OG 3.42Å; S831-I846 PolarHBondContact N-O 3.11Å
832	G	67.6	Low	79.1	Confident	26 Å²	26	29.9 Å²	29.9	27%	0.268	17%	0.169	S	C	.	.			trans	-91	-169.7	-177.1	0	0	0	0	0	114.3	I830 E834	I830-G832 VanDerWaalsContact C-N 3.34Å; I830-G832 PolarHBondContact O-N 2.94Å; G832-E834 VanDerWaalsContact C-N 3.31Å; G832-E834 PolarHBondContact O-N 3.18Å
833	N	57.2	Low	79.2	Confident	137 Å²	137	29 Å²	29	73%	0.733	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-17.8	-177.5	-67.4	-31.2	0	0	0	113.6	G835	N833-G835 PolarHBondContact O-N 3.25Å; N833-G835 VanDerWaalsContact O-N 3.11Å
834	E	55.9	Low	79.3	Confident	18 Å²	18	27.4 Å²	27.4	8%	0.084	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	7	-175.5	-47.9	-150.8	159.4	0	0	113.5	T202 T422 N428 D813 G832	T202-E834 HydrophobicContact CG2-CB 3.99Å; T202-E834 HydrophobicContact CG2-CG 3.68Å; T422-E834 WeakPolarHBondContact CG2-OE1 3.27Å; N428-E834 PolarHBondContact ND2-OE1 3.18Å; D813-E834 WeakPolarHBondContact OD2-CG 3.22Å; G832-E834 VanDerWaalsContact C-N 3.31Å; G832-E834 PolarHBondContact O-N 3.18Å
835	G	60.3	Low	79.2	Confident	16 Å²	16	27.4 Å²	27.4	17%	0.165	16%	0.155	C	C	.	.			trans	105.2	164.5	173.7	0	0	0	0	0	113.4	N833 Q837	N833-G835 PolarHBondContact O-N 3.25Å; N833-G835 VanDerWaalsContact O-N 3.11Å; G835-Q837 VanDerWaalsContact C-N 3.26Å; G835-Q837 PolarHBondContact O-N 2.82Å
836	M	65.8	Low	79.2	Confident	130 Å²	130	25.4 Å²	25.4	64%	0.64	15%	0.145	S	C	*	.	S	Bend	trans	-83.6	17.4	-174.2	-67.3	-174.8	-83.2	0	0	114.2	T839 N840	M836-T839 HydrophobicContact CB-CG2 4.43Å; M836-N840 WeakPolarHBondContact O-CB 3.41Å; M836-N840 VanDerWaalsContact O-CG 3.23Å; M836-N840 PolarHBondContact O-N 2.69Å; M836-N840 PolarHBondContact O-ND2 3.24Å
837	Q	66.5	Low	79	Confident	49 Å²	49	25.7 Å²	25.7	23%	0.229	15%	0.148	C	C	.	.	H	α-helix	trans	-78.7	-45.9	-167.9	-65.5	-145.8	1.7	0	0	114.5	N197 A815 G835 N840 S841	N197-Q837 VanDerWaalsContact C-NE2 3.26Å; N197-Q837 PolarHBondContact O-NE2 2.9Å; N197-Q837 PolarHBondContact OD1-NE2 2.86Å; A815-Q837 HydrophobicContact CB-CB 4.08Å; G835-Q837 VanDerWaalsContact C-N 3.26Å; G835-Q837 PolarHBondContact O-N 2.82Å; Q837-N840 PolarHBondContact O-N 2.98Å; Q837-S841 WeakPolarHBondContact O-CB 3.48Å; Q837-S841 PolarHBondContact O-N 2.99Å; Q837-S841 VanDerWaalsContact O-N 3.09Å; Q837-S841 PolarHBondContact O-OG 3.25Å
838	A	68.6	Low	78.8	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.8	-49.1	169.6	0	0	0	0	0	110.6	G812 D813 I821 N840 S841 S842	G812-A838 WeakPolarHBondContact O-CB 3.32Å; D813-A838 VanDerWaalsContact C-CB 3.4Å; D813-A838 WeakPolarHBondContact O-CB 3.24Å; D813-A838 PolarHBondContact O-N 3.48Å; I821-A838 HydrophobicContact CD1-CB 3.6Å; A838-N840 PolarHBondContact O-N 3.07Å; A838-N840 VanDerWaalsContact O-N 3.14Å; A838-S841 CarbonylContact O-C 3.44Å; A838-S841 PolarHBondContact O-N 3.45Å; A838-S842 VanDerWaalsContact O-CB 3.3Å; A838-S842 WeakPolarHBondContact O-CB 3.43Å; A838-S842 PolarHBondContact O-N 3.42Å; A838-S842 PolarHBondContact O-OG 3.45Å
839	T	74.8	Confident	78.8	Confident	4 Å²	4	27.1 Å²	27.1	3%	0.025	15%	0.154	C	C	.	.	H	α-helix	trans	-50.2	-35.3	172.6	-88.2	0	0	0	0	113.2	R403 I830 S831 M836 S842	R403-T839 PolarHBondContact NE-O 3.1Å; R403-T839 PolarHBondContact NH2-O 3.04Å; R403-T839 VanDerWaalsContact NH2-O 3.12Å; I830-T839 PolarHBondContact O-OG1 2.83Å; S831-T839 WeakPolarHBondContact CA-OG1 3.47Å; S831-T839 PolarHBondContact N-OG1 2.95Å; S831-T839 PolarHBondContact OG-OG1 2.71Å; M836-T839 HydrophobicContact CB-CG2 4.43Å; T839-S842 PolarHBondContact O-OG 3.19Å
840	N	73.3	Confident	78.9	Confident	89 Å²	89	28.2 Å²	28.2	48%	0.476	16%	0.162	S	C	.	.	H	α-helix	trans	-84.4	-20.3	178	-80.7	-42.4	0	0	0	114.8	R403 M836 Q837 A838	R403-N840 PolarHBondContact NH1-OD1 3.13Å; R403-N840 PolarHBondContact NH2-OD1 3.12Å; M836-N840 WeakPolarHBondContact O-CB 3.41Å; M836-N840 VanDerWaalsContact O-CG 3.23Å; M836-N840 PolarHBondContact O-N 2.69Å; M836-N840 PolarHBondContact O-ND2 3.24Å; Q837-N840 PolarHBondContact O-N 2.98Å; A838-N840 PolarHBondContact O-N 3.07Å; A838-N840 VanDerWaalsContact O-N 3.14Å
841	S	73.1	Confident	79.1	Confident	27 Å²	27	29.9 Å²	29.9	19%	0.189	17%	0.169	C	C	.	.	H	α-helix	trans	-100.2	-2.5	-179.9	-52.7	0	0	0	0	113.6	Q837 A838	Q837-S841 WeakPolarHBondContact O-CB 3.48Å; Q837-S841 PolarHBondContact O-N 2.99Å; Q837-S841 VanDerWaalsContact O-N 3.09Å; Q837-S841 PolarHBondContact O-OG 3.25Å; A838-S841 CarbonylContact O-C 3.44Å; A838-S841 PolarHBondContact O-N 3.45Å
842	S	85.8	Confident	79.8	Confident	6 Å²	6	28.7 Å²	28.7	4%	0.042	16%	0.16	C	C	.	.	S	Bend	trans	-90.8	160.7	-175.8	67.7	0	0	0	0	113.9	R403 G829 A838 T839 Y844	R403-S842 WeakPolarHBondContact CD-O 3.38Å; G829-S842 PolarHBondContact N-OG 3.38Å; A838-S842 VanDerWaalsContact O-CB 3.3Å; A838-S842 WeakPolarHBondContact O-CB 3.43Å; A838-S842 PolarHBondContact O-N 3.42Å; A838-S842 PolarHBondContact O-OG 3.45Å; T839-S842 PolarHBondContact O-OG 3.19Å; S842-Y844 VanDerWaalsContact CB-O 3.26Å; S842-Y844 WeakPolarHBondContact CB-O 3.26Å; S842-Y844 PolarHBondContact OG-O 2.82Å
843	D	89.3	Confident	81.1	Confident	3 Å²	3	29 Å²	29	2%	0.016	16%	0.155	C	C	.	.	S	Bend	trans	-78.9	-32.1	173.9	-60.8	-63.5	0	0	0	111.9	K296 R403 T404 L407 G827	K296-D843 VanDerWaalsContact CD-OD2 3.3Å; K296-D843 WeakPolarHBondContact CD-OD2 3.37Å; K296-D843 WeakPolarHBondContact CE-OD2 2.98Å; K296-D843 IonicContact NZ-OD2 3.23Å; K296-D843 PolarHBondContact NZ-OD2 3.27Å; R403-D843 WeakPolarHBondContact CA-O 3.34Å; R403-D843 WeakPolarHBondContact CB-O 3.47Å; R403-D843 PolarHBondContact N-O 3.15Å; T404-D843 WeakPolarHBondContact CB-OD1 3.36Å; T404-D843 PolarHBondContact N-O 3.18Å; T404-D843 WeakPolarHBondContact OG1-CA 3.25Å; T404-D843 PolarHBondContact OG1-OD1 2.55Å; L407-D843 HydrophobicContact CD1-CB 4.06Å; L407-D843 VanDerWaalsContact CD1-CG 3.48Å; L407-D843 WeakPolarHBondContact CD1-OD1 3.47Å; G827-D843 PolarHBondContact N-OD2 2.96Å; G827-D843 WeakPolarHBondContact O-CA 3.39Å; G827-D843 WeakPolarHBondContact O-CB 3.34Å; G827-D843 PolarHBondContact O-N 3.3Å
844	Y	93	Very high	82.9	Confident	2 Å²	2	23 Å²	23	1%	0.008	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	144.8	173.6	-54.3	-89.1	0	0	0	109.5	I385 M401 A402 L407 N408 L411 V826 G827 V828 G829 S842 L855	I385-Y844 HydrophobicContact CD1-CE1 4.1Å; M401-Y844 CarbonylContact O-C 3.14Å; M401-Y844 WeakPolarHBondContact O-CA 3.49Å; A402-Y844 HydrophobicContact CB-CD1 3.69Å; A402-Y844 HydrophobicContact CB-CE1 3.72Å; L407-Y844 PolarHBondContact O-OH 3.1Å; L407-Y844 VanDerWaalsContact O-OH 3.12Å; N408-Y844 VanDerWaalsContact CA-OH 3.27Å; N408-Y844 WeakPolarHBondContact CA-OH 3.48Å; N408-Y844 PolarHBondContact N-OH 2.8Å; N408-Y844 PolarHBondContact OD1-OH 3.03Å; L411-Y844 HydrophobicContact CD1-CD1 4.27Å; L411-Y844 HydrophobicContact CD1-CD2 4.45Å; L411-Y844 HydrophobicContact CD1-CE1 3.67Å; L411-Y844 HydrophobicContact CD1-CE2 3.87Å; L411-Y844 VanDerWaalsContact CD1-CZ 3.45Å; L411-Y844 HydrophobicContact CD2-CD2 4.16Å; L411-Y844 HydrophobicContact CD2-CE2 3.87Å; L411-Y844 HydrophobicContact CG-CE2 3.85Å; V826-Y844 HydrophobicContact CG1-CD2 3.67Å; V826-Y844 HydrophobicContact CG1-CE2 3.61Å; G827-Y844 PolarHBondContact O-N 3.03Å; G827-Y844 VanDerWaalsContact O-N 3.15Å; V828-Y844 CarbonylContact C-O 3.5Å; V828-Y844 WeakPolarHBondContact CA-O 3.43Å; G829-Y844 PolarHBondContact N-O 2.9Å; S842-Y844 VanDerWaalsContact CB-O 3.26Å; S842-Y844 WeakPolarHBondContact CB-O 3.26Å; S842-Y844 PolarHBondContact OG-O 2.82Å; Y844-L855 HydrophobicContact CD1-CD1 4.43Å; Y844-L855 HydrophobicContact CG-CD2 4.44Å
845	S	91.2	Very high	84.8	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	134.8	171.9	141.6	0	0	0	0	108.6	A400 M401 G829 S831	A400-S845 CarbonylContact C-O 3.59Å; A400-S845 VanDerWaalsContact CA-O 3.32Å; A400-S845 WeakPolarHBondContact CA-O 3.46Å; M401-S845 PolarHBondContact N-O 3.2Å; M401-S845 PolarHBondContact O-N 3.24Å; G829-S845 VanDerWaalsContact O-CA 3.29Å; G829-S845 WeakPolarHBondContact O-CA 3.5Å; S831-S845 PolarHBondContact OG-OG 3.42Å
846	I	93.9	Very high	86.5	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	151.9	177.6	62.6	-179.5	0	0	0	109.3	A400 I811 V828 G829 I830 S831 Q848 L852 L855	A400-I846 HydrophobicContact CB-CG2 4.16Å; I811-I846 HydrophobicContact CD1-CD1 4.11Å; V828-I846 HydrophobicContact CG1-CD1 3.73Å; V828-I846 HydrophobicContact CG1-CG1 3.8Å; G829-I846 PolarHBondContact O-N 3.38Å; I830-I846 CarbonylContact C-O 3.36Å; I830-I846 VanDerWaalsContact CA-O 3.3Å; I830-I846 WeakPolarHBondContact CA-O 3.42Å; I830-I846 HydrophobicContact CG1-CG1 4.12Å; S831-I846 PolarHBondContact N-O 3.11Å; I846-Q848 WeakPolarHBondContact CD1-O 3.43Å; I846-L852 HydrophobicContact CD1-CB 4.28Å; I846-L855 HydrophobicContact CG2-CD2 4.21Å
847	A	90.8	Very high	87.9	Confident	6 Å²	6	15.2 Å²	15.2	5%	0.05	8%	0.08	C	C	.	.	S	Bend	trans	-79.8	-35.8	-177.9	0	0	0	0	0	113.9	Y393 T398 Y851	Y393-A847 HydrophobicContact CD1-CB 3.67Å; Y393-A847 HydrophobicContact CG-CB 3.89Å; T398-A847 HydrophobicContact CG2-CB 3.93Å; A847-Y851 HydrophobicContact CB-CE2 4.14Å
848	Q	91.1	Very high	89.2	Confident	30 Å²	30	12.9 Å²	12.9	14%	0.14	7%	0.069	C	C	.	.	S	Bend	trans	-132.4	151.2	-178.2	-65.7	-171.3	-14.3	0	0	111.5	Y393 I846 S850 Y851	Y393-Q848 VanDerWaalsContact CZ-NE2 3.33Å; I846-Q848 WeakPolarHBondContact CD1-O 3.43Å; Q848-S850 VanDerWaalsContact C-N 3.29Å; Q848-S850 PolarHBondContact O-N 2.85Å; Q848-Y851 PolarHBondContact O-N 2.93Å
849	F	93.9	Very high	90.5	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-35.5	178.2	-175.6	-84.4	0	0	0	113.1	L417 T424 L425 V679 T682 I683 I811 I830 Y851 L852	L417-F849 HydrophobicContact CD2-CZ 4.23Å; T424-F849 HydrophobicContact CG2-CD2 4.21Å; L425-F849 HydrophobicContact CD2-CD1 4.36Å; L425-F849 HydrophobicContact CD2-CD2 3.73Å; L425-F849 HydrophobicContact CD2-CE1 4.14Å; L425-F849 HydrophobicContact CD2-CE2 3.48Å; L425-F849 VanDerWaalsContact CD2-CE2 3.48Å; L425-F849 HydrophobicContact CD2-CG 4.18Å; L425-F849 HydrophobicContact CD2-CZ 3.7Å; V679-F849 HydrophobicContact CB-CD1 4.5Å; V679-F849 HydrophobicContact CG2-CB 3.89Å; V679-F849 HydrophobicContact CG2-CD1 3.86Å; V679-F849 HydrophobicContact CG2-CG 4.07Å; T682-F849 HydrophobicContact CG2-CD1 4.11Å; T682-F849 HydrophobicContact CG2-CE1 3.88Å; I683-F849 HydrophobicContact CD1-CE1 4.4Å; I683-F849 HydrophobicContact CD1-CZ 4.47Å; I683-F849 HydrophobicContact CG1-CE1 3.91Å; I683-F849 HydrophobicContact CG1-CZ 4.13Å; I811-F849 HydrophobicContact CD1-CD2 4.04Å; I811-F849 HydrophobicContact CD1-CE2 4.44Å; I811-F849 HydrophobicContact CG2-CD2 4.47Å; I811-F849 HydrophobicContact CG2-CE2 4.03Å; I830-F849 HydrophobicContact CD1-CB 3.97Å; I830-F849 HydrophobicContact CD1-CD2 4.36Å; F849-Y851 PolarHBondContact O-N 2.93Å; F849-L852 HydrophobicContact CE2-CD2 4.29Å; F849-L852 HydrophobicContact CZ-CD2 4.26Å; F849-L852 WeakPolarHBondContact O-CB 3.46Å; F849-L852 PolarHBondContact O-N 3.4Å
850	S	93.7	Very high	91.4	Very high	24 Å²	24	13.3 Å²	13.3	17%	0.168	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-33	179.3	50.8	0	0	0	0	113.5	A677 Q848 L852 E853	A677-S850 WeakPolarHBondContact O-CB 3.16Å; A677-S850 PolarHBondContact O-OG 3.23Å; Q848-S850 VanDerWaalsContact C-N 3.29Å; Q848-S850 PolarHBondContact O-N 2.85Å; S850-L852 PolarHBondContact O-N 3.17Å; S850-L852 VanDerWaalsContact O-N 3.14Å; S850-E853 WeakPolarHBondContact O-CB 3.37Å; S850-E853 PolarHBondContact O-N 2.79Å; S850-E853 VanDerWaalsContact O-N 3.11Å
851	Y	95.4	Very high	92.4	Very high	34 Å²	34	9.1 Å²	9.1	13%	0.133	5%	0.049	C	C	.	.	H	α-helix	trans	-65	-17.3	177.2	-58.4	-15.5	0	0	0	113.1	E390 M391 Y392 A847 Q848 F849 E853 K854 L855	E390-Y851 WeakPolarHBondContact O-CE1 3.3Å; M391-Y851 HydrophobicContact CB-CD2 4.11Å; M391-Y851 HydrophobicContact CB-CG 4.21Å; M391-Y851 HydrophobicContact CG-CG 4.38Å; Y392-Y851 PolarHBondContact O-OH 2.98Å; A847-Y851 HydrophobicContact CB-CE2 4.14Å; Q848-Y851 PolarHBondContact O-N 2.93Å; F849-Y851 PolarHBondContact O-N 2.93Å; Y851-E853 PolarHBondContact O-N 2.65Å; Y851-K854 PolarHBondContact O-N 3.03Å; Y851-L855 WeakPolarHBondContact O-CB 3.37Å; Y851-L855 PolarHBondContact O-N 3.5Å
852	L	95.3	Very high	93.4	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-59.8	-30.8	173.3	-171.9	63.6	0	0	0	112.1	L417 L686 L809 I811 V828 I846 F849 S850 L855 L856	L417-L852 HydrophobicContact CD1-CD2 3.95Å; L417-L852 HydrophobicContact CD2-CD2 3.74Å; L686-L852 HydrophobicContact CD1-CD2 4.06Å; L686-L852 HydrophobicContact CD1-CG 4.38Å; L809-L852 HydrophobicContact CD1-CD1 4.25Å; L809-L852 HydrophobicContact CD2-CD1 4.32Å; I811-L852 HydrophobicContact CD1-CD2 4.12Å; V828-L852 HydrophobicContact CG2-CD1 4.28Å; I846-L852 HydrophobicContact CD1-CB 4.28Å; F849-L852 HydrophobicContact CE2-CD2 4.29Å; F849-L852 HydrophobicContact CZ-CD2 4.26Å; F849-L852 WeakPolarHBondContact O-CB 3.46Å; F849-L852 PolarHBondContact O-N 3.4Å; S850-L852 PolarHBondContact O-N 3.17Å; S850-L852 VanDerWaalsContact O-N 3.14Å; L852-L855 HydrophobicContact CD1-CD2 4.43Å; L852-L856 HydrophobicContact CD1-CD1 3.87Å; L852-L856 HydrophobicContact CD1-CG 4.04Å; L852-L856 HydrophobicContact CG-CD1 3.89Å; L852-L856 HydrophobicContact CG-CG 4.37Å; L852-L856 WeakPolarHBondContact O-CB 3.47Å; L852-L856 WeakPolarHBondContact O-CG 3.47Å; L852-L856 PolarHBondContact O-N 3.19Å
853	E	94.4	Very high	93.8	Very high	33 Å²	33	8.6 Å²	8.6	15%	0.154	4%	0.042	C	C	.	.	H	α-helix	trans	-59	-52.7	175.3	-165	176.3	130.7	0	0	111.2	T682 T685 S850 Y851 L857 L933	T682-E853 VanDerWaalsContact CA-OE2 3.27Å; T682-E853 WeakPolarHBondContact CA-OE2 3.1Å; T682-E853 HydrophobicContact CG2-CB 3.87Å; T682-E853 PolarHBondContact OG1-OE2 2.69Å; T685-E853 WeakPolarHBondContact CB-OE2 3.14Å; T685-E853 HydrophobicContact CG2-CG 3.66Å; T685-E853 WeakPolarHBondContact CG2-OE1 3.12Å; S850-E853 WeakPolarHBondContact O-CB 3.37Å; S850-E853 PolarHBondContact O-N 2.79Å; S850-E853 VanDerWaalsContact O-N 3.11Å; Y851-E853 PolarHBondContact O-N 2.65Å; E853-L857 HydrophobicContact CG-CD1 3.92Å; E853-L857 VanDerWaalsContact O-CB 3.28Å; E853-L857 WeakPolarHBondContact O-CB 3.43Å; E853-L857 WeakPolarHBondContact O-CG 3.07Å; E853-L857 PolarHBondContact O-N 3.25Å; E853-L933 HydrophobicContact CG-CD2 3.94Å
854	K	94.9	Very high	94	Very high	11 Å²	11	8.5 Å²	8.5	5%	0.048	4%	0.041	C	C	.	.	H	α-helix	trans	-70.5	-39.3	179.6	-168.4	175.5	-175.7	-178.9	0	112	D388 E390 M391 Y851 L856 V858 H859 Q929	D388-K854 IonicContact OD1-NZ 2.69Å; D388-K854 PolarHBondContact OD1-NZ 3.08Å; D388-K854 WeakPolarHBondContact OD2-CD 3.45Å; D388-K854 WeakPolarHBondContact OD2-CE 3.16Å; D388-K854 IonicContact OD2-NZ 2.65Å; D388-K854 PolarHBondContact OD2-NZ 3.22Å; E390-K854 HydrophobicContact CB-CD 4.22Å; E390-K854 IonicContact OE1-NZ 2.69Å; E390-K854 PolarHBondContact OE1-NZ 2.58Å; E390-K854 VanDerWaalsContact OE1-NZ 3.17Å; E390-K854 WeakPolarHBondContact OE2-CE 3.4Å; E390-K854 IonicContact OE2-NZ 2.94Å; E390-K854 PolarHBondContact OE2-NZ 3.48Å; M391-K854 HydrophobicContact CG-CB 4.41Å; M391-K854 HydrophobicContact CG-CD 4.02Å; M391-K854 HydrophobicContact SD-CB 4.05Å; M391-K854 HydrophobicContact SD-CD 4.32Å; M391-K854 HydrophobicContact SD-CG 4.21Å; Y851-K854 PolarHBondContact O-N 3.03Å; K854-L856 VanDerWaalsContact C-N 3.32Å; K854-L856 PolarHBondContact O-N 2.95Å; K854-V858 HydrophobicContact CG-CB 4.1Å; K854-V858 HydrophobicContact CG-CG2 3.98Å; K854-V858 VanDerWaalsContact O-CB 3.31Å; K854-V858 WeakPolarHBondContact O-CB 3.46Å; K854-V858 PolarHBondContact O-N 3.2Å; K854-V858 VanDerWaalsContact O-N 3.12Å; K854-H859 PolarHBondContact O-N 3.1Å; K854-H859 VanDerWaalsContact O-N 3.12Å; K854-Q929 VanDerWaalsContact NZ-CD 3.31Å
855	L	96.4	Very high	94	Very high	1 Å²	1	10 Å²	10	1%	0.005	5%	0.049	C	C	.	.	I	π-helix	trans	-59	-41.1	178.4	-175.8	62.6	0	0	0	112.1	I385 M391 L411 V828 Y844 I846 Y851 L852 H859 G860	I385-L855 HydrophobicContact CD1-CD1 4.24Å; I385-L855 HydrophobicContact CG1-CD1 4.49Å; I385-L855 HydrophobicContact CG2-CD1 4.06Å; M391-L855 HydrophobicContact SD-CB 4.29Å; L411-L855 HydrophobicContact CD1-CD1 3.76Å; L411-L855 HydrophobicContact CD1-CG 4Å; L411-L855 HydrophobicContact CD2-CD2 4.37Å; L411-L855 HydrophobicContact CD2-CG 4.21Å; V828-L855 HydrophobicContact CG2-CD2 4.35Å; Y844-L855 HydrophobicContact CD1-CD1 4.43Å; Y844-L855 HydrophobicContact CG-CD2 4.44Å; I846-L855 HydrophobicContact CG2-CD2 4.21Å; Y851-L855 WeakPolarHBondContact O-CB 3.37Å; Y851-L855 PolarHBondContact O-N 3.5Å; L852-L855 HydrophobicContact CD1-CD2 4.43Å; L855-H859 WeakPolarHBondContact O-CB 3.45Å; L855-G860 PolarHBondContact O-N 3.15Å
856	L	95.8	Very high	94.1	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.051	C	C	.	.	I	π-helix	trans	-85.2	-58.5	179.1	-65	175.7	0	0	0	112.7	L411 V414 L686 I691 L809 L852 K854 V858 G860 A861 Y939	L411-L856 HydrophobicContact CB-CD2 4.15Å; L411-L856 HydrophobicContact CD2-CD2 3.68Å; L411-L856 VanDerWaalsContact O-CD2 3.29Å; L411-L856 WeakPolarHBondContact O-CD2 3.44Å; V414-L856 HydrophobicContact CB-CD2 4.27Å; V414-L856 HydrophobicContact CG2-CD2 3.77Å; L686-L856 HydrophobicContact CD2-CD1 3.95Å; I691-L856 HydrophobicContact CD1-CD1 4.08Å; L809-L856 HydrophobicContact CD1-CD2 3.87Å; L852-L856 HydrophobicContact CD1-CD1 3.87Å; L852-L856 HydrophobicContact CD1-CG 4.04Å; L852-L856 HydrophobicContact CG-CD1 3.89Å; L852-L856 HydrophobicContact CG-CG 4.37Å; L852-L856 WeakPolarHBondContact O-CB 3.47Å; L852-L856 WeakPolarHBondContact O-CG 3.47Å; L852-L856 PolarHBondContact O-N 3.19Å; K854-L856 VanDerWaalsContact C-N 3.32Å; K854-L856 PolarHBondContact O-N 2.95Å; L856-V858 VanDerWaalsContact C-N 3.32Å; L856-V858 PolarHBondContact O-N 3.01Å; L856-G860 WeakPolarHBondContact O-CA 3.41Å; L856-G860 PolarHBondContact O-N 2.71Å; L856-A861 PolarHBondContact O-N 2.66Å; L856-A861 VanDerWaalsContact O-N 3.08Å; L856-Y939 HydrophobicContact CB-CE2 4.45Å; L856-Y939 WeakPolarHBondContact O-CE2 3.43Å
857	L	94.6	Very high	94.1	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.051	C	C	.	.	I	π-helix	trans	-72.7	-24.9	-168.7	-56.6	-175.4	0	0	0	113.1	T685 A689 E853 A861 M932 L933 P936 Y939	T685-L857 HydrophobicContact CG2-CD1 3.58Å; A689-L857 HydrophobicContact CB-CD2 3.75Å; E853-L857 HydrophobicContact CG-CD1 3.92Å; E853-L857 VanDerWaalsContact O-CB 3.28Å; E853-L857 WeakPolarHBondContact O-CB 3.43Å; E853-L857 WeakPolarHBondContact O-CG 3.07Å; E853-L857 PolarHBondContact O-N 3.25Å; L857-A861 VanDerWaalsContact O-CB 3.3Å; L857-A861 WeakPolarHBondContact O-CB 3.43Å; L857-M932 WeakPolarHBondContact O-CE 3.21Å; L857-L933 HydrophobicContact CB-CD2 4.49Å; L857-P936 HydrophobicContact CD1-CB 3.97Å; L857-P936 HydrophobicContact CD1-CG 4.33Å; L857-Y939 HydrophobicContact CD2-CD1 4.13Å; L857-Y939 HydrophobicContact CD2-CD2 3.77Å; L857-Y939 HydrophobicContact CD2-CE2 4.4Å; L857-Y939 HydrophobicContact CD2-CG 3.63Å
858	V	94.4	Very high	94.2	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.05	C	C	.	.	I	π-helix	trans	-105.6	-68.4	178.2	-171.6	0	0	0	0	110.2	K854 L856 W862 Q929 M932 L933	K854-V858 HydrophobicContact CG-CB 4.1Å; K854-V858 HydrophobicContact CG-CG2 3.98Å; K854-V858 VanDerWaalsContact O-CB 3.31Å; K854-V858 WeakPolarHBondContact O-CB 3.46Å; K854-V858 PolarHBondContact O-N 3.2Å; K854-V858 VanDerWaalsContact O-N 3.12Å; L856-V858 VanDerWaalsContact C-N 3.32Å; L856-V858 PolarHBondContact O-N 3.01Å; V858-W862 HydrophobicContact CG1-CD2 3.9Å; V858-W862 HydrophobicContact CG1-CE3 3.83Å; V858-W862 HydrophobicContact CG1-CH2 3.74Å; V858-W862 HydrophobicContact CG1-CZ2 3.78Å; V858-W862 HydrophobicContact CG1-CZ3 3.75Å; V858-W862 WeakPolarHBondContact O-CB 3.48Å; V858-W862 PolarHBondContact O-N 3.25Å; V858-Q929 HydrophobicContact CG1-CB 4.2Å; V858-Q929 HydrophobicContact CG1-CG 3.95Å; V858-Q929 HydrophobicContact CG2-CG 3.97Å; V858-M932 HydrophobicContact CG2-CB 4.29Å; V858-L933 HydrophobicContact CG2-CD1 4.39Å; V858-L933 HydrophobicContact CG2-CD2 3.87Å; V858-L933 HydrophobicContact CG2-CG 3.87Å
859	H	95.5	Very high	94.2	Very high	12 Å²	12	11.1 Å²	11.1	6%	0.056	5%	0.053	C	C	.	.	I	π-helix	trans	-67.5	-44.8	-172.1	-74.8	-73.9	0	0	0	113.1	I385 D388 M391 K854 L855 S863	I385-H859 HydrophobicContact CD1-CB 4.31Å; I385-H859 HydrophobicContact CG1-CB 4.01Å; D388-H859 IonicContact OD2-CD2 3.51Å; D388-H859 IonicContact OD2-CE1 3.31Å; D388-H859 IonicContact OD2-NE2 3.34Å; D388-H859 PolarHBondContact OD2-NE2 3.39Å; M391-H859 VanDerWaalsContact CE-CD2 3.48Å; M391-H859 WeakPolarHBondContact CE-CD2 3.47Å; M391-H859 WeakPolarHBondContact CE-NE2 3.35Å; K854-H859 PolarHBondContact O-N 3.1Å; K854-H859 VanDerWaalsContact O-N 3.12Å; L855-H859 WeakPolarHBondContact O-CB 3.45Å; H859-S863 WeakPolarHBondContact O-CB 3.35Å; H859-S863 PolarHBondContact O-N 3.13Å; H859-S863 PolarHBondContact O-OG 2.76Å
860	G	94.5	Very high	94.2	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	5%	0.053	C	C	.	.	I	π-helix	trans	-63.5	-53	176.4	0	0	0	0	0	112.9	L411 G412 L855 L856 W862 S863 Y864	L411-G860 VanDerWaalsContact C-CA 3.49Å; L411-G860 VanDerWaalsContact CB-CA 3.43Å; G412-G860 WeakPolarHBondContact CA-O 3.5Å; L855-G860 PolarHBondContact O-N 3.15Å; L856-G860 WeakPolarHBondContact O-CA 3.41Å; L856-G860 PolarHBondContact O-N 2.71Å; G860-W862 VanDerWaalsContact C-N 3.33Å; G860-W862 PolarHBondContact O-N 3.25Å; G860-S863 PolarHBondContact O-N 2.65Å; G860-Y864 PolarHBondContact O-N 3.22Å
861	A	93	Very high	94.2	Very high	1 Å²	1	10 Å²	10	1%	0.008	5%	0.045	C	C	.	.	H	α-helix	trans	-58.1	-42.5	177.7	0	0	0	0	0	112.6	L856 L857 N865 M932 Y939	L856-A861 PolarHBondContact O-N 2.66Å; L856-A861 VanDerWaalsContact O-N 3.08Å; L857-A861 VanDerWaalsContact O-CB 3.3Å; L857-A861 WeakPolarHBondContact O-CB 3.43Å; A861-N865 PolarHBondContact O-N 3.47Å; A861-N865 PolarHBondContact O-ND2 3.41Å; A861-M932 HydrophobicContact CB-CE 3.74Å; A861-Y939 HydrophobicContact CB-CD2 4.17Å
862	W	94.1	Very high	94.1	Very high	21 Å²	21	8.9 Å²	8.9	8%	0.08	4%	0.041	C	C	.	.	H	α-helix	trans	-66.4	-45.7	174.8	-73.4	-2.4	0	0	0	112.1	V858 G860 Y864 N865 R866 C927 Q929	V858-W862 HydrophobicContact CG1-CD2 3.9Å; V858-W862 HydrophobicContact CG1-CE3 3.83Å; V858-W862 HydrophobicContact CG1-CH2 3.74Å; V858-W862 HydrophobicContact CG1-CZ2 3.78Å; V858-W862 HydrophobicContact CG1-CZ3 3.75Å; V858-W862 WeakPolarHBondContact O-CB 3.48Å; V858-W862 PolarHBondContact O-N 3.25Å; G860-W862 VanDerWaalsContact C-N 3.33Å; G860-W862 PolarHBondContact O-N 3.25Å; W862-Y864 PolarHBondContact O-N 2.78Å; W862-N865 PolarHBondContact O-N 3.15Å; W862-R866 WeakPolarHBondContact O-CB 3.29Å; W862-R866 WeakPolarHBondContact O-CD 3.3Å; W862-R866 WeakPolarHBondContact O-CG 3.43Å; W862-R866 PolarHBondContact O-N 3.09Å; W862-C927 WeakPolarHBondContact CZ2-O 3.17Å; W862-C927 PolarHBondContact NE1-O 2.91Å; W862-Q929 HydrophobicContact CH2-CB 4.19Å; W862-Q929 HydrophobicContact CZ2-CB 4.29Å
863	S	94.4	Very high	94.1	Very high	1 Å²	1	9.3 Å²	9.3	1%	0.007	4%	0.043	C	C	.	.	H	α-helix	trans	-63.4	-41.6	-178.4	-61.7	0	0	0	0	111.9	N408 H859 G860 R866 V867	N408-S863 WeakPolarHBondContact O-CB 3.5Å; H859-S863 WeakPolarHBondContact O-CB 3.35Å; H859-S863 PolarHBondContact O-N 3.13Å; H859-S863 PolarHBondContact O-OG 2.76Å; G860-S863 PolarHBondContact O-N 2.65Å; S863-R866 PolarHBondContact O-N 2.72Å; S863-V867 WeakPolarHBondContact O-CB 3.36Å; S863-V867 VanDerWaalsContact O-CG2 3.29Å; S863-V867 WeakPolarHBondContact O-CG2 3.46Å; S863-V867 PolarHBondContact O-N 3.17Å
864	Y	93.9	Very high	94	Very high	2 Å²	2	7.7 Å²	7.7	1%	0.008	4%	0.035	C	C	.	.	H	α-helix	trans	-57.6	-52.8	172.2	177.4	-91.8	0	0	0	112.1	V300 E409 Q413 G860 W862 R866 V867 T868 T942 A945 F948	V300-Y864 HydrophobicContact CG2-CD2 4.31Å; V300-Y864 HydrophobicContact CG2-CE2 3.99Å; E409-Y864 HydrophobicContact CB-CD2 4.4Å; Q413-Y864 HydrophobicContact CG-CD2 3.58Å; Q413-Y864 HydrophobicContact CG-CE2 3.8Å; Q413-Y864 HydrophobicContact CG-CG 4.41Å; G860-Y864 PolarHBondContact O-N 3.22Å; W862-Y864 PolarHBondContact O-N 2.78Å; Y864-R866 VanDerWaalsContact C-N 3.34Å; Y864-R866 PolarHBondContact O-N 3.33Å; Y864-V867 PolarHBondContact O-N 3.24Å; Y864-T868 HydrophobicContact CD1-CG2 4.43Å; Y864-T868 HydrophobicContact CD2-CG2 4.16Å; Y864-T868 HydrophobicContact CE1-CG2 4.09Å; Y864-T868 HydrophobicContact CE2-CG2 3.76Å; Y864-T868 HydrophobicContact CG-CG2 4.46Å; Y864-T868 WeakPolarHBondContact O-CB 3.3Å; Y864-T868 VanDerWaalsContact O-CG2 3.26Å; Y864-T868 WeakPolarHBondContact O-CG2 3.39Å; Y864-T868 PolarHBondContact O-N 2.94Å; Y864-T868 PolarHBondContact O-OG1 2.71Å; Y864-T942 HydrophobicContact CD1-CG2 3.54Å; Y864-T942 HydrophobicContact CE1-CG2 4.13Å; Y864-T942 HydrophobicContact CG-CG2 4.34Å; Y864-A945 VanDerWaalsContact OH-CA 3.32Å; Y864-A945 WeakPolarHBondContact OH-CA 3.41Å; Y864-F948 PolarHBondContact OH-N 3.28Å
865	N	91.9	Very high	93.9	Very high	32 Å²	32	7.3 Å²	7.3	17%	0.171	3%	0.034	C	C	.	.	H	α-helix	trans	-63	-38.4	-179.2	-77.9	-65.8	0	0	0	112.5	A861 W862 T868 K869 P926 T942	A861-N865 PolarHBondContact O-N 3.47Å; A861-N865 PolarHBondContact O-ND2 3.41Å; W862-N865 PolarHBondContact O-N 3.15Å; N865-T868 PolarHBondContact O-OG1 3.2Å; N865-K869 WeakPolarHBondContact O-CB 3.09Å; N865-K869 WeakPolarHBondContact O-CG 3.11Å; N865-K869 PolarHBondContact O-N 2.99Å; N865-P926 HydrophobicContact CB-CG 4.45Å; N865-T942 VanDerWaalsContact ND2-CG2 3.3Å; N865-T942 WeakPolarHBondContact ND2-CG2 3.18Å
866	R	93.9	Very high	93.8	Very high	12 Å²	12	7.4 Å²	7.4	5%	0.045	3%	0.034	C	C	.	.	H	α-helix	trans	-65.3	-52	176.1	-76	168.2	-176.5	155.3	6.2	112.7	W862 S863 Y864 T868 C870 G921 I922 D924	W862-R866 WeakPolarHBondContact O-CB 3.29Å; W862-R866 WeakPolarHBondContact O-CD 3.3Å; W862-R866 WeakPolarHBondContact O-CG 3.43Å; W862-R866 PolarHBondContact O-N 3.09Å; S863-R866 PolarHBondContact O-N 2.72Å; Y864-R866 VanDerWaalsContact C-N 3.34Å; Y864-R866 PolarHBondContact O-N 3.33Å; R866-T868 PolarHBondContact O-N 2.92Å; R866-C870 VanDerWaalsContact O-CB 3.3Å; R866-C870 WeakPolarHBondContact O-CB 3.49Å; R866-C870 PolarHBondContact O-N 3.48Å; R866-G921 WeakPolarHBondContact CB-O 3.18Å; R866-G921 WeakPolarHBondContact CD-O 3.38Å; R866-I922 PolarHBondContact NE-O 2.94Å; R866-D924 PolarHBondContact NE-O 2.91Å; R866-D924 PolarHBondContact NH2-O 3.22Å
867	V	93.6	Very high	93.7	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-61.9	-45.9	-178.6	166.5	0	0	0	0	110.4	V300 L374 V377 K378 E409 S863 Y864 C870 I871	V300-V867 HydrophobicContact CG1-CG1 4.23Å; L374-V867 HydrophobicContact CD2-CG1 4.17Å; V377-V867 HydrophobicContact CG1-CG2 4.47Å; K378-V867 HydrophobicContact CG-CG2 4.45Å; E409-V867 HydrophobicContact CB-CB 4.34Å; E409-V867 HydrophobicContact CB-CG1 4.47Å; E409-V867 HydrophobicContact CB-CG2 4.46Å; S863-V867 WeakPolarHBondContact O-CB 3.36Å; S863-V867 VanDerWaalsContact O-CG2 3.29Å; S863-V867 WeakPolarHBondContact O-CG2 3.46Å; S863-V867 PolarHBondContact O-N 3.17Å; Y864-V867 PolarHBondContact O-N 3.24Å; V867-C870 WeakPolarHBondContact O-CB 3.36Å; V867-C870 PolarHBondContact O-N 3.18Å; V867-I871 HydrophobicContact CG1-CD1 3.69Å; V867-I871 HydrophobicContact CG1-CG1 4.41Å; V867-I871 VanDerWaalsContact O-CG1 3.27Å; V867-I871 WeakPolarHBondContact O-CG1 3.35Å; V867-I871 PolarHBondContact O-N 3.43Å
868	T	92.6	Very high	93.5	Very high	4 Å²	4	7.4 Å²	7.4	3%	0.025	3%	0.034	C	C	.	.	H	α-helix	trans	-66.1	-43.9	-178.2	52.4	0	0	0	0	113.2	V300 Y864 N865 R866 C870 I871 L872 F948	V300-T868 HydrophobicContact CG1-CG2 4.42Å; Y864-T868 HydrophobicContact CD1-CG2 4.43Å; Y864-T868 HydrophobicContact CD2-CG2 4.16Å; Y864-T868 HydrophobicContact CE1-CG2 4.09Å; Y864-T868 HydrophobicContact CE2-CG2 3.76Å; Y864-T868 HydrophobicContact CG-CG2 4.46Å; Y864-T868 WeakPolarHBondContact O-CB 3.3Å; Y864-T868 VanDerWaalsContact O-CG2 3.26Å; Y864-T868 WeakPolarHBondContact O-CG2 3.39Å; Y864-T868 PolarHBondContact O-N 2.94Å; Y864-T868 PolarHBondContact O-OG1 2.71Å; N865-T868 PolarHBondContact O-OG1 3.2Å; R866-T868 PolarHBondContact O-N 2.92Å; T868-C870 PolarHBondContact O-N 3.09Å; T868-I871 PolarHBondContact O-N 3.23Å; T868-L872 WeakPolarHBondContact O-CG 3.1Å; T868-L872 PolarHBondContact O-N 3.38Å; T868-F948 HydrophobicContact CG2-CB 3.34Å; T868-F948 HydrophobicContact CG2-CD1 4.39Å; T868-F948 HydrophobicContact CG2-CD2 4.39Å; T868-F948 HydrophobicContact CG2-CG 3.83Å
869	K	92.4	Very high	93.5	Very high	45 Å²	45	7.7 Å²	7.7	20%	0.196	4%	0.036	C	C	.	.	H	α-helix	trans	-57.8	-46.1	169.8	-77.4	-172.8	-178.2	-169.8	0	112.1	N865 I871 L872 Y873 D924 E1011 T1013	N865-K869 WeakPolarHBondContact O-CB 3.09Å; N865-K869 WeakPolarHBondContact O-CG 3.11Å; N865-K869 PolarHBondContact O-N 2.99Å; K869-I871 VanDerWaalsContact C-N 3.33Å; K869-I871 PolarHBondContact O-N 3.48Å; K869-L872 PolarHBondContact O-N 3.05Å; K869-Y873 VanDerWaalsContact O-CB 3.3Å; K869-Y873 WeakPolarHBondContact O-CB 3.33Å; K869-Y873 PolarHBondContact O-N 3.01Å; K869-D924 WeakPolarHBondContact CD-OD2 3.22Å; K869-D924 IonicContact NZ-OD2 3.58Å; K869-D924 PolarHBondContact NZ-OD2 2.93Å; K869-E1011 PolarHBondContact NZ-O 3.47Å; K869-T1013 PolarHBondContact NZ-OG1 3.32Å
870	C	94.1	Very high	93.4	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-59.2	-42.3	178.9	-175	0	0	0	0	111.9	R866 V867 T868 C874	R866-C870 VanDerWaalsContact O-CB 3.3Å; R866-C870 WeakPolarHBondContact O-CB 3.49Å; R866-C870 PolarHBondContact O-N 3.48Å; V867-C870 WeakPolarHBondContact O-CB 3.36Å; V867-C870 PolarHBondContact O-N 3.18Å; T868-C870 PolarHBondContact O-N 3.09Å; C870-C874 VanDerWaalsContact O-CB 3.24Å; C870-C874 WeakPolarHBondContact O-CB 3.29Å; C870-C874 PolarHBondContact O-N 2.82Å; C870-C874 PolarHBondContact O-SG 3.2Å
871	I	93.2	Very high	93.3	Very high	1 Å²	1	7.1 Å²	7.1	1%	0.005	3%	0.033	C	C	.	.	H	α-helix	trans	-62.5	-55.2	176.5	-66.8	161.5	0	0	0	110.7	V300 T304 L370 L374 V867 T868 K869 Y873 C874 F875 F948	V300-I871 HydrophobicContact CG1-CD1 3.47Å; V300-I871 VanDerWaalsContact CG1-CD1 3.47Å; T304-I871 HydrophobicContact CG2-CG2 4.37Å; L370-I871 HydrophobicContact CD1-CG1 4.37Å; L374-I871 HydrophobicContact CD1-CD1 4.36Å; L374-I871 HydrophobicContact CD1-CG1 3.94Å; L374-I871 HydrophobicContact CD2-CG1 3.95Å; V867-I871 HydrophobicContact CG1-CD1 3.69Å; V867-I871 HydrophobicContact CG1-CG1 4.41Å; V867-I871 VanDerWaalsContact O-CG1 3.27Å; V867-I871 WeakPolarHBondContact O-CG1 3.35Å; V867-I871 PolarHBondContact O-N 3.43Å; T868-I871 PolarHBondContact O-N 3.23Å; K869-I871 VanDerWaalsContact C-N 3.33Å; K869-I871 PolarHBondContact O-N 3.48Å; I871-Y873 VanDerWaalsContact C-N 3.33Å; I871-Y873 PolarHBondContact O-N 2.76Å; I871-C874 PolarHBondContact O-N 3.16Å; I871-F875 HydrophobicContact CG2-CD2 3.75Å; I871-F875 HydrophobicContact CG2-CE2 3.63Å; I871-F875 VanDerWaalsContact O-CD2 3.3Å; I871-F875 WeakPolarHBondContact O-CD2 3.48Å; I871-F875 PolarHBondContact O-N 3.19Å; I871-F948 HydrophobicContact CB-CE2 4.21Å; I871-F948 HydrophobicContact CD1-CZ 4.39Å; I871-F948 HydrophobicContact CG2-CE2 3.65Å; I871-F948 HydrophobicContact CG2-CZ 3.79Å
872	L	93.2	Very high	93.2	Very high	11 Å²	11	7.4 Å²	7.4	6%	0.058	3%	0.034	C	C	.	.	H	α-helix	trans	-59.9	-42.8	-176.4	-68.7	169	0	0	0	111.9	T868 K869 Y876 F948 V952 F953	T868-L872 WeakPolarHBondContact O-CG 3.1Å; T868-L872 PolarHBondContact O-N 3.38Å; K869-L872 PolarHBondContact O-N 3.05Å; L872-Y876 WeakPolarHBondContact O-CB 3.31Å; L872-Y876 PolarHBondContact O-N 2.89Å; L872-F948 HydrophobicContact CD1-CD2 4.24Å; L872-F948 HydrophobicContact CD2-CD2 3.96Å; L872-F948 HydrophobicContact CD2-CE2 3.94Å; L872-F948 HydrophobicContact CG-CD2 3.94Å; L872-F948 HydrophobicContact CG-CE2 4.14Å; L872-V952 HydrophobicContact CD1-CG1 3.8Å; L872-V952 HydrophobicContact CD2-CG1 4.29Å; L872-F953 HydrophobicContact CD2-CB 4.26Å; L872-F953 HydrophobicContact CD2-CD2 4.35Å
873	Y	94.3	Very high	93.1	Very high	8 Å²	8	7.2 Å²	7.2	3%	0.031	3%	0.034	C	C	.	.	H	α-helix	trans	-67.6	-40.1	176.7	177.9	-97.9	0	0	0	112.7	K869 I871 Y876 K877 P916 P917 L920 V1004 A1008	K869-Y873 VanDerWaalsContact O-CB 3.3Å; K869-Y873 WeakPolarHBondContact O-CB 3.33Å; K869-Y873 PolarHBondContact O-N 3.01Å; I871-Y873 VanDerWaalsContact C-N 3.33Å; I871-Y873 PolarHBondContact O-N 2.76Å; Y873-Y876 HydrophobicContact CD2-CD1 4.29Å; Y873-Y876 HydrophobicContact CE2-CD1 4.41Å; Y873-Y876 PolarHBondContact O-N 3.07Å; Y873-K877 HydrophobicContact CD1-CD 4.14Å; Y873-K877 HydrophobicContact CE1-CD 3.63Å; Y873-K877 WeakPolarHBondContact O-CB 3.35Å; Y873-K877 PolarHBondContact O-N 3.07Å; Y873-P916 HydrophobicContact CE1-CB 4.12Å; Y873-P917 HydrophobicContact CD1-CG 3.92Å; Y873-P917 HydrophobicContact CE1-CG 3.76Å; Y873-L920 HydrophobicContact CD1-CD1 4.01Å; Y873-L920 HydrophobicContact CD2-CD1 4.36Å; Y873-L920 HydrophobicContact CG-CD1 3.85Å; Y873-V1004 HydrophobicContact CE2-CG1 4.41Å; Y873-V1004 WeakPolarHBondContact OH-CG1 3.45Å; Y873-V1004 PolarHBondContact OH-O 3.27Å; Y873-V1004 VanDerWaalsContact OH-O 3.05Å; Y873-A1008 HydrophobicContact CD2-CB 4.4Å; Y873-A1008 HydrophobicContact CE1-CB 4.42Å; Y873-A1008 HydrophobicContact CE2-CB 3.66Å
874	C	92.9	Very high	93.1	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-64.6	-37.9	176.4	-87.3	0	0	0	0	113.1	L370 C870 I871 N878	L370-C874 HydrophobicContact CD1-CB 3.72Å; C870-C874 VanDerWaalsContact O-CB 3.24Å; C870-C874 WeakPolarHBondContact O-CB 3.29Å; C870-C874 PolarHBondContact O-N 2.82Å; C870-C874 PolarHBondContact O-SG 3.2Å; I871-C874 PolarHBondContact O-N 3.16Å; C874-N878 PolarHBondContact O-ND2 3.32Å
875	F	92.7	Very high	93	Very high	3 Å²	3	7.2 Å²	7.2	1%	0.013	3%	0.034	C	C	.	.	H	α-helix	trans	-67.3	-52.1	170.8	-77.3	-69.9	0	0	0	111.1	T304 I308 L311 P367 L370 I871 K877 N878 V879 F953	T304-F875 HydrophobicContact CG2-CE2 4.14Å; T304-F875 HydrophobicContact CG2-CZ 4.32Å; I308-F875 HydrophobicContact CD1-CZ 4.43Å; I308-F875 HydrophobicContact CG1-CE1 4.21Å; I308-F875 HydrophobicContact CG1-CZ 3.79Å; L311-F875 HydrophobicContact CD1-CD1 3.52Å; L311-F875 HydrophobicContact CD1-CE1 3.47Å; L311-F875 VanDerWaalsContact CD1-CE1 3.47Å; P367-F875 HydrophobicContact CG-CD1 3.91Å; P367-F875 HydrophobicContact CG-CE1 3.82Å; P367-F875 HydrophobicContact CG-CZ 4.41Å; L370-F875 HydrophobicContact CD2-CD2 4.3Å; L370-F875 HydrophobicContact CD2-CE1 4.36Å; L370-F875 HydrophobicContact CD2-CE2 3.56Å; L370-F875 HydrophobicContact CD2-CZ 3.59Å; I871-F875 HydrophobicContact CG2-CD2 3.75Å; I871-F875 HydrophobicContact CG2-CE2 3.63Å; I871-F875 VanDerWaalsContact O-CD2 3.3Å; I871-F875 WeakPolarHBondContact O-CD2 3.48Å; I871-F875 PolarHBondContact O-N 3.19Å; F875-K877 VanDerWaalsContact C-N 3.33Å; F875-K877 PolarHBondContact O-N 3.32Å; F875-N878 PolarHBondContact O-N 3.18Å; F875-N878 VanDerWaalsContact O-N 3.11Å; F875-V879 VanDerWaalsContact O-CG2 3.31Å; F875-V879 WeakPolarHBondContact O-CG2 3.43Å; F875-V879 PolarHBondContact O-N 3.17Å; F875-F953 HydrophobicContact CB-CE2 4.18Å; F875-F953 HydrophobicContact CD1-CE2 4.26Å; F875-F953 HydrophobicContact CD2-CD2 4.37Å; F875-F953 AromaticContact CD2-CE2 3.65Å; F875-F953 HydrophobicContact CD2-CE2 3.65Å; F875-F953 HydrophobicContact CE2-CE2 4.01Å; F875-F953 AromaticContact CG-CE2 3.77Å; F875-F953 HydrophobicContact CG-CE2 3.77Å; F875-F953 HydrophobicContact CG-CZ 4.47Å; F875-F953 HydrophobicContact CZ-CE2 4.48Å
876	Y	94.3	Very high	92.9	Very high	2 Å²	2	6.6 Å²	6.6	1%	0.008	3%	0.031	C	C	.	.	H	α-helix	trans	-49.2	-50.6	178.1	163.5	-88.9	0	0	0	112.4	L872 Y873 N878 V879 V880 A960 H963 V1004 K1007	L872-Y876 WeakPolarHBondContact O-CB 3.31Å; L872-Y876 PolarHBondContact O-N 2.89Å; Y873-Y876 HydrophobicContact CD2-CD1 4.29Å; Y873-Y876 HydrophobicContact CE2-CD1 4.41Å; Y873-Y876 PolarHBondContact O-N 3.07Å; Y876-N878 VanDerWaalsContact C-N 3.27Å; Y876-N878 PolarHBondContact O-N 2.91Å; Y876-V879 PolarHBondContact O-N 2.75Å; Y876-V880 HydrophobicContact CD2-CG2 4.18Å; Y876-V880 HydrophobicContact CE1-CG2 4.13Å; Y876-V880 HydrophobicContact CE2-CG2 3.75Å; Y876-V880 WeakPolarHBondContact O-CG2 3.38Å; Y876-V880 PolarHBondContact O-N 3.12Å; Y876-A960 HydrophobicContact CD2-CB 3.72Å; Y876-A960 HydrophobicContact CE2-CB 4.2Å; Y876-A960 HydrophobicContact CG-CB 4.43Å; Y876-H963 AromaticContact CE2-ND1 3.9Å; Y876-H963 AromaticContact CZ-ND1 3.82Å; Y876-H963 PolarHBondContact OH-ND1 3.02Å; Y876-V1004 HydrophobicContact CE1-CG2 4.31Å; Y876-K1007 HydrophobicContact CD1-CG 4.38Å; Y876-K1007 HydrophobicContact CE1-CB 4.14Å; Y876-K1007 HydrophobicContact CE1-CG 3.64Å
877	K	93.4	Very high	92.9	Very high	1 Å²	1	8.2 Å²	8.2	0%	0.004	4%	0.037	C	C	.	.	H	α-helix	trans	-67.4	-24.8	-175.4	83.6	-170.8	-172.7	78.8	0	114.1	Y873 F875 Y908 N909 T913 P917 V1004	Y873-K877 HydrophobicContact CD1-CD 4.14Å; Y873-K877 HydrophobicContact CE1-CD 3.63Å; Y873-K877 WeakPolarHBondContact O-CB 3.35Å; Y873-K877 PolarHBondContact O-N 3.07Å; F875-K877 VanDerWaalsContact C-N 3.33Å; F875-K877 PolarHBondContact O-N 3.32Å; K877-Y908 WeakPolarHBondContact O-CE1 3.21Å; K877-Y908 PolarHBondContact O-OH 2.69Å; K877-N909 PolarHBondContact NZ-OD1 3.34Å; K877-T913 WeakPolarHBondContact CE-O 3.34Å; K877-T913 PolarHBondContact NZ-O 2.99Å; K877-T913 PolarHBondContact NZ-OG1 3.45Å; K877-P917 HydrophobicContact CD-CG 4.25Å; K877-V1004 HydrophobicContact CB-CG1 3.68Å; K877-V1004 HydrophobicContact CB-CG2 4.43Å
878	N	91.8	Very high	92.9	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-83.6	-45.9	176.3	-79.5	-97.8	0	0	0	110.4	N364 P367 C874 F875 Y876 V880 L881 Y882 N909	N364-N878 PolarHBondContact O-OD1 3.19Å; P367-N878 HydrophobicContact CB-CB 4.45Å; C874-N878 PolarHBondContact O-ND2 3.32Å; F875-N878 PolarHBondContact O-N 3.18Å; F875-N878 VanDerWaalsContact O-N 3.11Å; Y876-N878 VanDerWaalsContact C-N 3.27Å; Y876-N878 PolarHBondContact O-N 2.91Å; N878-V880 VanDerWaalsContact C-N 3.27Å; N878-V880 PolarHBondContact O-N 3.11Å; N878-L881 PolarHBondContact O-N 3.39Å; N878-Y882 HydrophobicContact CB-CD2 4.17Å; N878-Y882 HydrophobicContact CB-CE2 4.29Å; N878-Y882 WeakPolarHBondContact O-CD2 3.45Å; N878-Y882 PolarHBondContact O-N 2.73Å; N878-Y882 WeakPolarHBondContact OD1-CE2 3.48Å; N878-N909 PolarHBondContact ND2-OD1 3.41Å; N878-N909 PolarHBondContact OD1-ND2 2.8Å; N878-N909 PolarHBondContact OD1-OD1 3.43Å
879	V	93.2	Very high	92.8	Very high	6 Å²	6	9.1 Å²	9.1	4%	0.036	4%	0.04	C	C	.	.	H	α-helix	trans	-58.7	-38.2	176	177.1	0	0	0	0	111.5	L365 F875 Y876 I883 A960	L365-V879 HydrophobicContact CD1-CG2 4.08Å; F875-V879 VanDerWaalsContact O-CG2 3.31Å; F875-V879 WeakPolarHBondContact O-CG2 3.43Å; F875-V879 PolarHBondContact O-N 3.17Å; Y876-V879 PolarHBondContact O-N 2.75Å; V879-I883 HydrophobicContact CG1-CD1 3.56Å; V879-I883 HydrophobicContact CG1-CG1 4.26Å; V879-I883 WeakPolarHBondContact O-CB 3.24Å; V879-I883 WeakPolarHBondContact O-CG1 3.44Å; V879-I883 PolarHBondContact O-N 3.33Å; V879-A960 HydrophobicContact CB-CB 3.7Å; V879-A960 HydrophobicContact CG1-CB 3.48Å; V879-A960 VanDerWaalsContact CG1-CB 3.48Å
880	V	94.4	Very high	92.7	Very high	0 Å²	0	12 Å²	12	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-59.9	-49.3	174.3	169.7	0	0	0	0	112.3	Y876 N878 I884 A960 H963 S964 L967 V1000 V1004	Y876-V880 HydrophobicContact CD2-CG2 4.18Å; Y876-V880 HydrophobicContact CE1-CG2 4.13Å; Y876-V880 HydrophobicContact CE2-CG2 3.75Å; Y876-V880 WeakPolarHBondContact O-CG2 3.38Å; Y876-V880 PolarHBondContact O-N 3.12Å; N878-V880 VanDerWaalsContact C-N 3.27Å; N878-V880 PolarHBondContact O-N 3.11Å; V880-I884 WeakPolarHBondContact O-CD1 3.43Å; V880-I884 WeakPolarHBondContact O-CG1 3.49Å; V880-A960 HydrophobicContact CG2-CB 3.67Å; V880-H963 HydrophobicContact CG2-CB 4.16Å; V880-S964 WeakPolarHBondContact O-CB 3.3Å; V880-L967 HydrophobicContact CG1-CD1 3.57Å; V880-V1000 HydrophobicContact CG1-CG1 4.01Å; V880-V1004 HydrophobicContact CG1-CG2 4.32Å
881	L	92.3	Very high	92.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-74.2	-48	-175	-176.2	69.2	0	0	0	111.8	N878 I883 I884 F900 Y908 Y997 V1000	N878-L881 PolarHBondContact O-N 3.39Å; L881-I883 PolarHBondContact O-N 2.8Å; L881-I884 WeakPolarHBondContact O-CB 3.26Å; L881-I884 PolarHBondContact O-N 3.03Å; L881-F900 HydrophobicContact CD1-CD2 3.97Å; L881-F900 HydrophobicContact CD1-CE2 3.39Å; L881-F900 HydrophobicContact CD1-CZ 3.71Å; L881-F900 HydrophobicContact CG-CD2 4.49Å; L881-F900 HydrophobicContact CG-CE2 4.09Å; L881-Y908 HydrophobicContact CB-CE1 3.99Å; L881-Y908 HydrophobicContact CD2-CD1 3.4Å; L881-Y908 HydrophobicContact CD2-CD2 3.86Å; L881-Y908 HydrophobicContact CD2-CE1 3.66Å; L881-Y908 HydrophobicContact CD2-CE2 4.1Å; L881-Y908 HydrophobicContact CD2-CG 3.49Å; L881-Y908 VanDerWaalsContact CD2-CG 3.49Å; L881-Y908 HydrophobicContact CG-CE1 4.45Å; L881-Y997 HydrophobicContact CD1-CD2 4.17Å; L881-Y997 HydrophobicContact CD1-CE2 4.46Å; L881-Y997 HydrophobicContact CD2-CE2 4.4Å; L881-V1000 HydrophobicContact CB-CG1 4.28Å; L881-V1000 HydrophobicContact CD1-CB 4.35Å; L881-V1000 HydrophobicContact CD1-CG1 3.93Å; L881-V1000 HydrophobicContact CD1-CG2 4.28Å
882	Y	90.3	Very high	92.2	Very high	7 Å²	7	17.1 Å²	17.1	3%	0.027	8%	0.083	C	C	.	.	H	α-helix	trans	-82.5	-15.3	-168.2	-60.3	-61.1	0	0	0	114.4	N364 N878 I884 I905 N909	N364-Y882 VanDerWaalsContact C-CD2 3.42Å; N364-Y882 HydrophobicContact CB-CD1 3.92Å; N364-Y882 HydrophobicContact CB-CD2 3.66Å; N364-Y882 HydrophobicContact CB-CE1 3.63Å; N364-Y882 HydrophobicContact CB-CE2 3.35Å; N364-Y882 HydrophobicContact CB-CG 3.94Å; N364-Y882 WeakPolarHBondContact O-CD2 3.26Å; N364-Y882 WeakPolarHBondContact O-CE2 3.38Å; N878-Y882 HydrophobicContact CB-CD2 4.17Å; N878-Y882 HydrophobicContact CB-CE2 4.29Å; N878-Y882 WeakPolarHBondContact O-CD2 3.45Å; N878-Y882 PolarHBondContact O-N 2.73Å; N878-Y882 WeakPolarHBondContact OD1-CE2 3.48Å; Y882-I884 VanDerWaalsContact C-N 3.3Å; Y882-I905 HydrophobicContact CE1-CG2 4.05Å; Y882-I905 PolarHBondContact OH-O 2.93Å; Y882-N909 PolarHBondContact OH-ND2 3.3Å
883	I	93.2	Very high	91.8	Very high	16 Å²	16	17 Å²	17	8%	0.082	9%	0.085	C	C	.	.	H	α-helix	trans	-76.4	-18.2	167.5	-65.7	-172.7	0	0	0	111.7	L365 V879 L881 E885 L886 W887 L961 S964	L365-I883 HydrophobicContact CD1-CD1 4.41Å; L365-I883 HydrophobicContact CD1-CG1 4.01Å; V879-I883 HydrophobicContact CG1-CD1 3.56Å; V879-I883 HydrophobicContact CG1-CG1 4.26Å; V879-I883 WeakPolarHBondContact O-CB 3.24Å; V879-I883 WeakPolarHBondContact O-CG1 3.44Å; V879-I883 PolarHBondContact O-N 3.33Å; L881-I883 PolarHBondContact O-N 2.8Å; I883-E885 VanDerWaalsContact C-N 3.28Å; I883-E885 PolarHBondContact O-N 3.06Å; I883-L886 WeakPolarHBondContact O-CB 3.27Å; I883-L886 PolarHBondContact O-N 3.41Å; I883-L886 VanDerWaalsContact O-N 3.1Å; I883-W887 HydrophobicContact CG2-CZ2 4.13Å; I883-W887 PolarHBondContact O-N 3.34Å; I883-L961 HydrophobicContact CD1-CD1 4.05Å; I883-L961 HydrophobicContact CG2-CD1 3.89Å; I883-S964 WeakPolarHBondContact CG2-OG 3.47Å
884	I	93.8	Very high	91.4	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.9	-35.2	172.7	-66	169.2	0	0	0	111.4	V880 L881 Y882 L886 W887 F888 L899 F900 L967 F968 V996 V1000	V880-I884 WeakPolarHBondContact O-CD1 3.43Å; V880-I884 WeakPolarHBondContact O-CG1 3.49Å; L881-I884 WeakPolarHBondContact O-CB 3.26Å; L881-I884 PolarHBondContact O-N 3.03Å; Y882-I884 VanDerWaalsContact C-N 3.3Å; I884-L886 VanDerWaalsContact C-N 3.28Å; I884-L886 PolarHBondContact O-N 3.3Å; I884-W887 PolarHBondContact O-N 3.42Å; I884-W887 VanDerWaalsContact O-N 3.16Å; I884-F888 WeakPolarHBondContact O-CB 3.36Å; I884-F888 PolarHBondContact O-N 3.27Å; I884-L899 HydrophobicContact CG2-CD2 3.66Å; I884-F900 HydrophobicContact CB-CE2 4.31Å; I884-F900 HydrophobicContact CB-CZ 4.25Å; I884-F900 HydrophobicContact CD1-CZ 4.38Å; I884-F900 HydrophobicContact CG2-CE2 4.16Å; I884-F900 HydrophobicContact CG2-CZ 3.78Å; I884-L967 HydrophobicContact CD1-CB 4.01Å; I884-F968 HydrophobicContact CG1-CB 4.34Å; I884-F968 HydrophobicContact CG2-CB 4.03Å; I884-F968 HydrophobicContact CG2-CD2 3.67Å; I884-F968 HydrophobicContact CG2-CG 4.18Å; I884-V996 HydrophobicContact CD1-CG1 4.02Å; I884-V996 HydrophobicContact CG2-CG1 4.16Å; I884-V1000 HydrophobicContact CD1-CG2 3.45Å; I884-V1000 VanDerWaalsContact CD1-CG2 3.45Å
885	E	90.8	Very high	91	Very high	3 Å²	3	22 Å²	22	1%	0.014	12%	0.117	C	C	.	.	H	α-helix	trans	-64.9	-31.4	173.9	-61.6	-70.5	-173.8	0	0	112	L361 Y362 I883 F888 A889 L899 F900	L361-E885 HydrophobicContact CD1-CB 4.4Å; L361-E885 HydrophobicContact CD1-CG 4.49Å; L361-E885 HydrophobicContact CG-CB 4.43Å; Y362-E885 HydrophobicContact CE1-CB 4.45Å; I883-E885 VanDerWaalsContact C-N 3.28Å; I883-E885 PolarHBondContact O-N 3.06Å; E885-F888 PolarHBondContact O-N 3.31Å; E885-A889 PolarHBondContact O-N 2.81Å; E885-L899 PolarHBondContact OE1-N 2.84Å; E885-L899 WeakPolarHBondContact OE2-CB 3.47Å; E885-L899 PolarHBondContact OE2-N 3.39Å; E885-F900 HydrophobicContact CG-CD2 4.49Å; E885-F900 WeakPolarHBondContact OE1-CD2 3.17Å; E885-F900 PolarHBondContact OE1-N 3.01Å
886	L	91.7	Very high	90.5	Very high	19 Å²	19	22.1 Å²	22.1	10%	0.099	12%	0.119	C	C	.	.	H	α-helix	trans	-68.3	-42	171.1	175.6	66.3	0	0	0	111.4	M318 Y362 I883 I884 F888 A889 F890	M318-L886 HydrophobicContact CG-CD2 4.4Å; M318-L886 HydrophobicContact SD-CD2 3.83Å; Y362-L886 HydrophobicContact CE1-CB 3.99Å; Y362-L886 WeakPolarHBondContact OH-CD1 3.37Å; I883-L886 WeakPolarHBondContact O-CB 3.27Å; I883-L886 PolarHBondContact O-N 3.41Å; I883-L886 VanDerWaalsContact O-N 3.1Å; I884-L886 VanDerWaalsContact C-N 3.28Å; I884-L886 PolarHBondContact O-N 3.3Å; L886-F888 VanDerWaalsContact C-N 3.3Å; L886-F888 PolarHBondContact O-N 3.44Å; L886-A889 WeakPolarHBondContact O-CB 3.28Å; L886-A889 PolarHBondContact O-N 3.36Å; L886-F890 HydrophobicContact CD1-CE2 4.15Å; L886-F890 HydrophobicContact CG-CE2 4.17Å; L886-F890 WeakPolarHBondContact O-CD2 3.32Å; L886-F890 PolarHBondContact O-N 3.17Å
887	W	93.3	Very high	90.2	Very high	46 Å²	46	25.7 Å²	25.7	17%	0.174	14%	0.136	C	C	.	.	H	α-helix	trans	-64.6	-36.1	174.3	-59	135.3	0	0	0	112.3	I883 I884 F890 L961 S964 I965 F968	I883-W887 HydrophobicContact CG2-CZ2 4.13Å; I883-W887 PolarHBondContact O-N 3.34Å; I884-W887 PolarHBondContact O-N 3.42Å; I884-W887 VanDerWaalsContact O-N 3.16Å; W887-F890 HydrophobicContact CE3-CD2 4.03Å; W887-F890 HydrophobicContact CE3-CE2 4.06Å; W887-F890 HydrophobicContact CZ3-CD2 4.46Å; W887-F890 HydrophobicContact CZ3-CE2 4.07Å; W887-F890 PolarHBondContact O-N 3.15Å; W887-L961 HydrophobicContact CH2-CD1 4.39Å; W887-L961 HydrophobicContact CZ2-CD1 3.66Å; W887-S964 PolarHBondContact NE1-OG 3.33Å; W887-I965 HydrophobicContact CH2-CD1 4.38Å; W887-I965 HydrophobicContact CH2-CG1 4.27Å; W887-I965 HydrophobicContact CZ2-CD1 3.78Å; W887-I965 HydrophobicContact CZ2-CG1 3.36Å; W887-F968 HydrophobicContact CB-CB 4.3Å; W887-F968 HydrophobicContact CB-CD1 3.4Å; W887-F968 HydrophobicContact CB-CE1 3.74Å; W887-F968 HydrophobicContact CB-CG 3.82Å; W887-F968 HydrophobicContact CB-CZ 4.42Å; W887-F968 HydrophobicContact CG-CD1 4.28Å
888	F	92.4	Very high	90	Very high	23 Å²	23	26.3 Å²	26.3	10%	0.101	14%	0.139	C	C	.	.	H	α-helix	trans	-67.4	-35.2	173.7	-174.9	-128.9	0	0	0	112.5	I884 E885 L886 F890 V891 N892 Q897 L899 F968 Y989	I884-F888 WeakPolarHBondContact O-CB 3.36Å; I884-F888 PolarHBondContact O-N 3.27Å; E885-F888 PolarHBondContact O-N 3.31Å; L886-F888 VanDerWaalsContact C-N 3.3Å; L886-F888 PolarHBondContact O-N 3.44Å; F888-F890 VanDerWaalsContact C-N 3.29Å; F888-F890 PolarHBondContact O-N 3.33Å; F888-V891 CarbonylContact O-C 3.6Å; F888-V891 WeakPolarHBondContact O-CA 3.39Å; F888-V891 PolarHBondContact O-N 3.48Å; F888-N892 WeakPolarHBondContact CD1-ND2 3.49Å; F888-N892 HydrophobicContact CE1-CB 4.42Å; F888-N892 VanDerWaalsContact CE1-ND2 3.32Å; F888-N892 WeakPolarHBondContact CE1-ND2 3.3Å; F888-N892 HydrophobicContact CE2-CB 4.32Å; F888-N892 HydrophobicContact CZ-CB 4.21Å; F888-N892 PolarHBondContact O-N 3.35Å; F888-N892 PolarHBondContact O-ND2 2.91Å; F888-Q897 WeakPolarHBondContact CD1-O 3.44Å; F888-Q897 HydrophobicContact CE1-CB 4.38Å; F888-Q897 HydrophobicContact CE1-CG 4.05Å; F888-Q897 WeakPolarHBondContact CE1-O 3.11Å; F888-Q897 HydrophobicContact CZ-CG 4.44Å; F888-L899 HydrophobicContact CB-CB 4.38Å; F888-L899 HydrophobicContact CD1-CB 3.65Å; F888-L899 HydrophobicContact CD2-CD1 4.12Å; F888-L899 HydrophobicContact CE1-CB 4Å; F888-L899 HydrophobicContact CE1-CD1 4.43Å; F888-L899 HydrophobicContact CE2-CD1 4.06Å; F888-L899 HydrophobicContact CG-CB 3.98Å; F888-L899 HydrophobicContact CG-CD1 4.35Å; F888-L899 HydrophobicContact CZ-CD1 4.22Å; F888-F968 HydrophobicContact CB-CE2 3.93Å; F888-F968 HydrophobicContact CB-CZ 4.17Å; F888-F968 HydrophobicContact CD2-CE2 4.17Å; F888-F968 HydrophobicContact CD2-CZ 4.29Å; F888-F968 HydrophobicContact CG-CE2 4.49Å; F888-Y989 HydrophobicContact CZ-CD2 4.48Å
889	A	90.9	Very high	89.9	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.9	-36	175.5	0	0	0	0	0	113.3	E885 L886 V891 N892 F894	E885-A889 PolarHBondContact O-N 2.81Å; L886-A889 WeakPolarHBondContact O-CB 3.28Å; L886-A889 PolarHBondContact O-N 3.36Å; A889-V891 PolarHBondContact O-N 3.17Å; A889-N892 WeakPolarHBondContact CA-OD1 3.2Å; A889-N892 PolarHBondContact O-OD1 2.99Å; A889-F894 HydrophobicContact CB-CD1 3.85Å; A889-F894 HydrophobicContact CB-CE1 4.21Å; A889-F894 PolarHBondContact O-N 3.2Å
890	F	90.5	Very high	89.8	Confident	107 Å²	107	26.5 Å²	26.5	47%	0.469	14%	0.14	S	C	.	.	H	α-helix	trans	-65.4	-24.1	172.9	-74.3	-80.3	0	0	0	113.6	L886 W887 F888 F894	L886-F890 HydrophobicContact CD1-CE2 4.15Å; L886-F890 HydrophobicContact CG-CE2 4.17Å; L886-F890 WeakPolarHBondContact O-CD2 3.32Å; L886-F890 PolarHBondContact O-N 3.17Å; W887-F890 HydrophobicContact CE3-CD2 4.03Å; W887-F890 HydrophobicContact CE3-CE2 4.06Å; W887-F890 HydrophobicContact CZ3-CD2 4.46Å; W887-F890 HydrophobicContact CZ3-CE2 4.07Å; W887-F890 PolarHBondContact O-N 3.15Å; F888-F890 VanDerWaalsContact C-N 3.29Å; F888-F890 PolarHBondContact O-N 3.33Å; F890-F894 HydrophobicContact CD1-CE1 4.27Å; F890-F894 HydrophobicContact CD1-CE2 4.33Å; F890-F894 AromaticContact CD1-CZ 3.53Å; F890-F894 HydrophobicContact CD1-CZ 3.53Å; F890-F894 HydrophobicContact CE1-CE1 4.38Å; F890-F894 AromaticContact CE1-CZ 3.73Å; F890-F894 HydrophobicContact CE1-CZ 3.73Å; F890-F894 HydrophobicContact CG-CE1 4.47Å; F890-F894 HydrophobicContact CG-CZ 4.09Å; F890-F894 HydrophobicContact CZ-CZ 4.42Å
891	V	89	Confident	89.4	Confident	77 Å²	77	27.4 Å²	27.4	47%	0.467	14%	0.144	S	C	.	.	H	α-helix	trans	-95.9	-28.6	-179	-176.2	0	0	0	0	111.7	F888 A889 F968 W969 L972	F888-V891 CarbonylContact O-C 3.6Å; F888-V891 WeakPolarHBondContact O-CA 3.39Å; F888-V891 PolarHBondContact O-N 3.48Å; A889-V891 PolarHBondContact O-N 3.17Å; V891-F968 HydrophobicContact CG2-CE1 4.02Å; V891-F968 HydrophobicContact CG2-CZ 3.96Å; V891-W969 HydrophobicContact CG2-CH2 3.84Å; V891-W969 HydrophobicContact CG2-CZ3 4.33Å; V891-L972 HydrophobicContact CG2-CD2 4.37Å
892	N	87.1	Confident	89	Confident	30 Å²	30	33.5 Å²	33.5	16%	0.16	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	16.5	-176.8	76.7	28.7	0	0	0	114.9	F888 A889 F894 S895 Q897	F888-N892 WeakPolarHBondContact CD1-ND2 3.49Å; F888-N892 HydrophobicContact CE1-CB 4.42Å; F888-N892 VanDerWaalsContact CE1-ND2 3.32Å; F888-N892 WeakPolarHBondContact CE1-ND2 3.3Å; F888-N892 HydrophobicContact CE2-CB 4.32Å; F888-N892 HydrophobicContact CZ-CB 4.21Å; F888-N892 PolarHBondContact O-N 3.35Å; F888-N892 PolarHBondContact O-ND2 2.91Å; A889-N892 WeakPolarHBondContact CA-OD1 3.2Å; A889-N892 PolarHBondContact O-OD1 2.99Å; N892-F894 VanDerWaalsContact C-N 3.31Å; N892-F894 PolarHBondContact O-N 2.96Å; N892-F894 PolarHBondContact OD1-N 3.15Å; N892-S895 VanDerWaalsContact CG-OG 3.3Å; N892-S895 WeakPolarHBondContact O-CB 3.29Å; N892-S895 PolarHBondContact O-N 3.36Å; N892-S895 PolarHBondContact O-OG 2.99Å; N892-S895 PolarHBondContact OD1-N 2.86Å; N892-S895 PolarHBondContact OD1-OG 3.13Å; N892-S895 VanDerWaalsContact OD1-OG 3.11Å; N892-Q897 PolarHBondContact ND2-O 3.17Å
893	G	85.1	Confident	88.6	Confident	10 Å²	10	40.1 Å²	40.1	10%	0.103	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	25	-180	0	0	0	0	0	114.2	S895	G893-S895 VanDerWaalsContact C-N 3.28Å; G893-S895 PolarHBondContact O-N 2.65Å
894	F	87.4	Confident	88.2	Confident	32 Å²	32	39.4 Å²	39.4	14%	0.14	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	43.2	-171.4	-58.5	-84.9	0	0	0	113.1	A326 F358 A889 F890 N892 G896	A326-F894 HydrophobicContact CB-CB 3.8Å; A326-F894 WeakPolarHBondContact CB-O 3.5Å; F358-F894 HydrophobicContact CZ-CB 4.02Å; F358-F894 WeakPolarHBondContact CZ-O 3.38Å; A889-F894 HydrophobicContact CB-CD1 3.85Å; A889-F894 HydrophobicContact CB-CE1 4.21Å; A889-F894 PolarHBondContact O-N 3.2Å; F890-F894 HydrophobicContact CD1-CE1 4.27Å; F890-F894 HydrophobicContact CD1-CE2 4.33Å; F890-F894 AromaticContact CD1-CZ 3.53Å; F890-F894 HydrophobicContact CD1-CZ 3.53Å; F890-F894 HydrophobicContact CE1-CE1 4.38Å; F890-F894 AromaticContact CE1-CZ 3.73Å; F890-F894 HydrophobicContact CE1-CZ 3.73Å; F890-F894 HydrophobicContact CG-CE1 4.47Å; F890-F894 HydrophobicContact CG-CZ 4.09Å; F890-F894 HydrophobicContact CZ-CZ 4.42Å; N892-F894 VanDerWaalsContact C-N 3.31Å; N892-F894 PolarHBondContact O-N 2.96Å; N892-F894 PolarHBondContact OD1-N 3.15Å; F894-G896 VanDerWaalsContact C-N 3.31Å; F894-G896 PolarHBondContact O-N 3.34Å
895	S	83.9	Confident	87.7	Confident	81 Å²	81	39.7 Å²	39.7	57%	0.566	19%	0.19	S	C	*	.			trans	-78.6	-9.7	179.6	50.2	0	0	0	0	114.4	N892 G893 Q897	N892-S895 VanDerWaalsContact CG-OG 3.3Å; N892-S895 WeakPolarHBondContact O-CB 3.29Å; N892-S895 PolarHBondContact O-N 3.36Å; N892-S895 PolarHBondContact O-OG 2.99Å; N892-S895 PolarHBondContact OD1-N 2.86Å; N892-S895 PolarHBondContact OD1-OG 3.13Å; N892-S895 VanDerWaalsContact OD1-OG 3.11Å; G893-S895 VanDerWaalsContact C-N 3.28Å; G893-S895 PolarHBondContact O-N 2.65Å; S895-Q897 PolarHBondContact O-N 3.01Å
896	G	82	Confident	87.2	Confident	5 Å²	5	41.1 Å²	41.1	5%	0.052	21%	0.206	C	C	.	.			trans	75.6	6	-176.2	0	0	0	0	0	114.5	F894	F894-G896 VanDerWaalsContact C-N 3.31Å; F894-G896 PolarHBondContact O-N 3.34Å
897	Q	87.4	Confident	86.8	Confident	77 Å²	77	42.1 Å²	42.1	36%	0.36	21%	0.211	S	C	.	.			trans	-63	134.3	173.5	177.2	56.6	40.9	0	0	111	F888 N892 S895 Y989	F888-Q897 WeakPolarHBondContact CD1-O 3.44Å; F888-Q897 HydrophobicContact CE1-CB 4.38Å; F888-Q897 HydrophobicContact CE1-CG 4.05Å; F888-Q897 WeakPolarHBondContact CE1-O 3.11Å; F888-Q897 HydrophobicContact CZ-CG 4.44Å; N892-Q897 PolarHBondContact ND2-O 3.17Å; S895-Q897 PolarHBondContact O-N 3.01Å; Q897-Y989 PolarHBondContact NE2-OH 3.34Å
898	I	89.3	Confident	86.6	Confident	13 Å²	13	39.9 Å²	39.9	7%	0.067	20%	0.202	C	C	.	.			trans	-79.3	140.3	174.3	54.2	-175.7	0	0	0	111.5	P105 T106 L361 F900 R902 I905	P105-I898 HydrophobicContact CB-CG2 4.33Å; T106-I898 HydrophobicContact CG2-CG2 4.37Å; L361-I898 HydrophobicContact CD1-CG2 3.52Å; I898-F900 WeakPolarHBondContact CD1-O 3.48Å; I898-R902 HydrophobicContact CD1-CG 3.62Å; I898-I905 HydrophobicContact CB-CD1 4.4Å; I898-I905 HydrophobicContact CG2-CD1 4.3Å
899	L	90.6	Very high	86.2	Confident	7 Å²	7	39.6 Å²	39.6	4%	0.037	20%	0.202	C	C	.	.	S	Bend	trans	-78.4	-36.9	172	-178.2	61.6	0	0	0	111.6	I884 E885 F888 F968 V996	I884-L899 HydrophobicContact CG2-CD2 3.66Å; E885-L899 PolarHBondContact OE1-N 2.84Å; E885-L899 WeakPolarHBondContact OE2-CB 3.47Å; E885-L899 PolarHBondContact OE2-N 3.39Å; F888-L899 HydrophobicContact CB-CB 4.38Å; F888-L899 HydrophobicContact CD1-CB 3.65Å; F888-L899 HydrophobicContact CD2-CD1 4.12Å; F888-L899 HydrophobicContact CE1-CB 4Å; F888-L899 HydrophobicContact CE1-CD1 4.43Å; F888-L899 HydrophobicContact CE2-CD1 4.06Å; F888-L899 HydrophobicContact CG-CB 3.98Å; F888-L899 HydrophobicContact CG-CD1 4.35Å; F888-L899 HydrophobicContact CZ-CD1 4.22Å; L899-F968 HydrophobicContact CD2-CD2 4.09Å; L899-F968 HydrophobicContact CD2-CE2 4.09Å; L899-V996 HydrophobicContact CD2-CG1 4.47Å
900	F	90	Very high	85.8	Confident	4 Å²	4	44 Å²	44	2%	0.018	23%	0.228	C	C	.	.	S	Bend	trans	-102.1	149.1	-176.5	-49.3	-59.2	0	0	0	112	L881 I884 E885 I898 I905 G993 V996 Y997	L881-F900 HydrophobicContact CD1-CD2 3.97Å; L881-F900 HydrophobicContact CD1-CE2 3.39Å; L881-F900 HydrophobicContact CD1-CZ 3.71Å; L881-F900 HydrophobicContact CG-CD2 4.49Å; L881-F900 HydrophobicContact CG-CE2 4.09Å; I884-F900 HydrophobicContact CB-CE2 4.31Å; I884-F900 HydrophobicContact CB-CZ 4.25Å; I884-F900 HydrophobicContact CD1-CZ 4.38Å; I884-F900 HydrophobicContact CG2-CE2 4.16Å; I884-F900 HydrophobicContact CG2-CZ 3.78Å; E885-F900 HydrophobicContact CG-CD2 4.49Å; E885-F900 WeakPolarHBondContact OE1-CD2 3.17Å; E885-F900 PolarHBondContact OE1-N 3.01Å; I898-F900 WeakPolarHBondContact CD1-O 3.48Å; F900-I905 HydrophobicContact CB-CD1 4.07Å; F900-I905 HydrophobicContact CB-CG1 3.74Å; F900-I905 WeakPolarHBondContact O-CD1 3.39Å; F900-G993 WeakPolarHBondContact CD1-O 3.3Å; F900-G993 WeakPolarHBondContact CE1-O 3.42Å; F900-V996 HydrophobicContact CE1-CB 4.2Å; F900-V996 HydrophobicContact CE1-CG1 3.91Å; F900-V996 HydrophobicContact CZ-CG1 3.91Å; F900-Y997 HydrophobicContact CB-CD2 4.27Å; F900-Y997 AromaticContact CD1-CD2 3.78Å; F900-Y997 HydrophobicContact CD1-CD2 3.78Å; F900-Y997 HydrophobicContact CD1-CG 4.28Å; F900-Y997 HydrophobicContact CE1-CD2 4.22Å; F900-Y997 AromaticContact CG-CD2 3.93Å; F900-Y997 HydrophobicContact CG-CD2 3.93Å
901	E	87.3	Confident	85.5	Confident	19 Å²	19	42 Å²	42	9%	0.089	22%	0.222	C	C	.	.			trans	-65.3	146.2	176.8	-165.1	-77	122.2	0	0	111.4	W903 C904 I905 Y1037 M1050	E901-W903 VanDerWaalsContact CD-N 3.32Å; E901-W903 PolarHBondContact O-N 3.45Å; E901-W903 PolarHBondContact OE1-N 3.33Å; E901-W903 VanDerWaalsContact OE1-N 3.07Å; E901-W903 WeakPolarHBondContact OE2-CB 3.29Å; E901-W903 PolarHBondContact OE2-N 3.34Å; E901-C904 HydrophobicContact CB-CB 4.32Å; E901-C904 WeakPolarHBondContact O-CB 3.42Å; E901-C904 PolarHBondContact O-N 3.16Å; E901-C904 VanDerWaalsContact O-N 3.11Å; E901-C904 PolarHBondContact OE2-N 3.28Å; E901-I905 PolarHBondContact O-N 3.38Å; E901-Y1037 VanDerWaalsContact CD-OH 3.3Å; E901-Y1037 WeakPolarHBondContact OE2-CE1 3.4Å; E901-Y1037 PolarHBondContact OE2-OH 3.09Å; E901-M1050 HydrophobicContact CB-CG 4.39Å; E901-M1050 HydrophobicContact CB-SD 4.08Å; E901-M1050 HydrophobicContact CG-CG 3.89Å; E901-M1050 HydrophobicContact CG-SD 4.23Å
902	R	82.4	Confident	85.5	Confident	127 Å²	127	38.3 Å²	38.3	48%	0.479	20%	0.2	S	C	.	.	H	α-helix	trans	-56.9	-42.2	-171.2	-62	178.7	172.2	131	-1.3	113.4	P105 I898 G906	P105-R902 PolarHBondContact O-NE 2.88Å; P105-R902 PolarHBondContact O-NH2 2.95Å; I898-R902 HydrophobicContact CD1-CG 3.62Å; R902-G906 PolarHBondContact O-N 3.47Å
903	W	81.9	Confident	85.7	Confident	146 Å²	146	36.9 Å²	36.9	55%	0.553	19%	0.192	S	C	*	.	H	α-helix	trans	-76.1	-36.2	176.2	-60.5	97	0	0	0	112.1	E901 I905 G906 L907 Y1037	E901-W903 VanDerWaalsContact CD-N 3.32Å; E901-W903 PolarHBondContact O-N 3.45Å; E901-W903 PolarHBondContact OE1-N 3.33Å; E901-W903 VanDerWaalsContact OE1-N 3.07Å; E901-W903 WeakPolarHBondContact OE2-CB 3.29Å; E901-W903 PolarHBondContact OE2-N 3.34Å; W903-I905 VanDerWaalsContact C-N 3.26Å; W903-I905 PolarHBondContact O-N 3.48Å; W903-G906 PolarHBondContact O-N 3.24Å; W903-G906 VanDerWaalsContact O-N 3.15Å; W903-L907 WeakPolarHBondContact O-CB 3.43Å; W903-L907 VanDerWaalsContact O-CG 3.28Å; W903-L907 WeakPolarHBondContact O-CG 3.5Å; W903-L907 PolarHBondContact O-N 3.49Å; W903-Y1037 WeakPolarHBondContact CB-OH 3.36Å; W903-Y1037 VanDerWaalsContact CD1-OH 3.25Å
904	C	85.6	Confident	85.9	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.007	19%	0.193	C	C	.	.	H	α-helix	trans	-56.2	-40.7	170.5	-67.8	0	0	0	0	111.8	E901 Y908 Y997	E901-C904 HydrophobicContact CB-CB 4.32Å; E901-C904 WeakPolarHBondContact O-CB 3.42Å; E901-C904 PolarHBondContact O-N 3.16Å; E901-C904 VanDerWaalsContact O-N 3.11Å; E901-C904 PolarHBondContact OE2-N 3.28Å; C904-Y908 PolarHBondContact O-N 3.15Å; C904-Y908 VanDerWaalsContact O-N 3.17Å; C904-Y997 HydrophobicContact CB-CE2 4Å; C904-Y997 WeakPolarHBondContact O-CE2 3.41Å; C904-Y997 PolarHBondContact O-OH 3.24Å
905	I	83.6	Confident	86.1	Confident	7 Å²	7	39.2 Å²	39.2	4%	0.036	21%	0.205	C	C	.	.	H	α-helix	trans	-60.6	-50.6	172.6	-72	170.3	0	0	0	111.6	T106 Y882 I898 F900 E901 W903 Y908	T106-I905 HydrophobicContact CG2-CD1 4.41Å; Y882-I905 HydrophobicContact CE1-CG2 4.05Å; Y882-I905 PolarHBondContact OH-O 2.93Å; I898-I905 HydrophobicContact CB-CD1 4.4Å; I898-I905 HydrophobicContact CG2-CD1 4.3Å; F900-I905 HydrophobicContact CB-CD1 4.07Å; F900-I905 HydrophobicContact CB-CG1 3.74Å; F900-I905 WeakPolarHBondContact O-CD1 3.39Å; E901-I905 PolarHBondContact O-N 3.38Å; W903-I905 VanDerWaalsContact C-N 3.26Å; W903-I905 PolarHBondContact O-N 3.48Å; I905-Y908 WeakPolarHBondContact O-CB 3.45Å
906	G	79.1	Confident	86.5	Confident	33 Å²	33	35.3 Å²	35.3	34%	0.34	18%	0.178	S	C	.	.	H	α-helix	trans	-67	-40.6	-177.2	0	0	0	0	0	113.8	R902 W903	R902-G906 PolarHBondContact O-N 3.47Å; W903-G906 PolarHBondContact O-N 3.24Å; W903-G906 VanDerWaalsContact O-N 3.15Å
907	L	84.9	Confident	87.1	Confident	39 Å²	39	35.2 Å²	35.2	20%	0.204	18%	0.176	C	C	.	.	H	α-helix	trans	-79.6	-17.4	-176.7	-61.9	-178.5	0	0	0	113.4	W903 N909 V910 I911 F912 F1033	W903-L907 WeakPolarHBondContact O-CB 3.43Å; W903-L907 VanDerWaalsContact O-CG 3.28Å; W903-L907 WeakPolarHBondContact O-CG 3.5Å; W903-L907 PolarHBondContact O-N 3.49Å; L907-N909 VanDerWaalsContact C-N 3.3Å; L907-N909 PolarHBondContact O-N 3.21Å; L907-V910 PolarHBondContact O-N 3.25Å; L907-I911 HydrophobicContact CD1-CD1 4.48Å; L907-I911 HydrophobicContact CD2-CD1 3.84Å; L907-I911 HydrophobicContact CD2-CG1 4.26Å; L907-I911 PolarHBondContact O-N 2.91Å; L907-F912 HydrophobicContact CB-CD2 4.2Å; L907-F912 HydrophobicContact CB-CE2 3.5Å; L907-F912 VanDerWaalsContact CB-CE2 3.5Å; L907-F912 HydrophobicContact CB-CZ 3.9Å; L907-F912 HydrophobicContact CD1-CZ 4.23Å; L907-F912 PolarHBondContact O-N 3.43Å; L907-F1033 HydrophobicContact CD1-CE2 3.95Å; L907-F1033 HydrophobicContact CD1-CZ 3.76Å
908	Y	88.2	Confident	87.4	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.17	C	C	.	.	I	π-helix	trans	-49.6	-49.5	175.4	178	-111.3	0	0	0	112.7	K877 L881 C904 I905 T913 Y997 V1000 V1001	K877-Y908 WeakPolarHBondContact O-CE1 3.21Å; K877-Y908 PolarHBondContact O-OH 2.69Å; L881-Y908 HydrophobicContact CB-CE1 3.99Å; L881-Y908 HydrophobicContact CD2-CD1 3.4Å; L881-Y908 HydrophobicContact CD2-CD2 3.86Å; L881-Y908 HydrophobicContact CD2-CE1 3.66Å; L881-Y908 HydrophobicContact CD2-CE2 4.1Å; L881-Y908 HydrophobicContact CD2-CG 3.49Å; L881-Y908 VanDerWaalsContact CD2-CG 3.49Å; L881-Y908 HydrophobicContact CG-CE1 4.45Å; C904-Y908 PolarHBondContact O-N 3.15Å; C904-Y908 VanDerWaalsContact O-N 3.17Å; I905-Y908 WeakPolarHBondContact O-CB 3.45Å; Y908-T913 HydrophobicContact CD2-CG2 3.91Å; Y908-T913 HydrophobicContact CE2-CG2 3.42Å; Y908-T913 VanDerWaalsContact CE2-CG2 3.42Å; Y908-T913 PolarHBondContact O-N 3.4Å; Y908-T913 PolarHBondContact O-OG1 2.94Å; Y908-Y997 WeakPolarHBondContact CA-OH 3.42Å; Y908-Y997 WeakPolarHBondContact CB-OH 3.44Å; Y908-Y997 HydrophobicContact CD2-CE2 4.4Å; Y908-V1000 HydrophobicContact CE2-CG1 4.27Å; Y908-V1001 HydrophobicContact CD2-CG2 4.27Å; Y908-V1001 HydrophobicContact CE2-CG2 4.19Å
909	N	83.8	Confident	87.6	Confident	17 Å²	17	34 Å²	34	9%	0.091	17%	0.17	C	C	.	.	I	π-helix	trans	-84.7	-23.8	-175	-91.3	-47.3	0	0	0	114.1	K877 N878 Y882 L907	K877-N909 PolarHBondContact NZ-OD1 3.34Å; N878-N909 PolarHBondContact ND2-OD1 3.41Å; N878-N909 PolarHBondContact OD1-ND2 2.8Å; N878-N909 PolarHBondContact OD1-OD1 3.43Å; Y882-N909 PolarHBondContact OH-ND2 3.3Å; L907-N909 VanDerWaalsContact C-N 3.3Å; L907-N909 PolarHBondContact O-N 3.21Å
910	V	81.8	Confident	87.7	Confident	91 Å²	91	33.8 Å²	33.8	55%	0.552	17%	0.169	S	C	*	.	I	π-helix	trans	-97.7	-33.1	-172.2	-179.1	0	0	0	0	112.3	L907 A914	L907-V910 PolarHBondContact O-N 3.25Å; V910-A914 VanDerWaalsContact O-CB 3.25Å; V910-A914 WeakPolarHBondContact O-CB 3.44Å
911	I	85.3	Confident	87.8	Confident	65 Å²	65	33.6 Å²	33.6	33%	0.333	17%	0.168	S	C	.	.	I	π-helix	trans	-118.5	-71.9	-177.6	-57.4	-173	0	0	0	109.9	L907 T913 A914 L1029	L907-I911 HydrophobicContact CD1-CD1 4.48Å; L907-I911 HydrophobicContact CD2-CD1 3.84Å; L907-I911 HydrophobicContact CD2-CG1 4.26Å; L907-I911 PolarHBondContact O-N 2.91Å; I911-T913 PolarHBondContact O-N 3.44Å; I911-A914 PolarHBondContact O-N 2.97Å; I911-L1029 HydrophobicContact CG2-CD2 3.59Å; I911-L1029 HydrophobicContact CG2-CG 4.25Å
912	F	89.4	Confident	88.1	Confident	1 Å²	1	33.3 Å²	33.3	0%	0.004	17%	0.167	C	C	.	.	I	π-helix	trans	-66.2	-35.8	-160.6	-48.2	-52.1	0	0	0	113.7	L907 Y997 S1026 L1029 W1030 F1033	L907-F912 HydrophobicContact CB-CD2 4.2Å; L907-F912 HydrophobicContact CB-CE2 3.5Å; L907-F912 VanDerWaalsContact CB-CE2 3.5Å; L907-F912 HydrophobicContact CB-CZ 3.9Å; L907-F912 HydrophobicContact CD1-CZ 4.23Å; L907-F912 PolarHBondContact O-N 3.43Å; F912-Y997 HydrophobicContact CD2-CE1 4.43Å; F912-Y997 VanDerWaalsContact CD2-OH 3.31Å; F912-Y997 WeakPolarHBondContact CD2-OH 3.41Å; F912-S1026 WeakPolarHBondContact O-CB 3.19Å; F912-S1026 PolarHBondContact O-OG 2.74Å; F912-L1029 HydrophobicContact CD1-CG 4.43Å; F912-W1030 HydrophobicContact CD1-CB 4.34Å; F912-W1030 HydrophobicContact CD1-CE3 4.22Å; F912-W1030 AromaticContact CD2-CE3 3.81Å; F912-W1030 HydrophobicContact CD2-CE3 3.81Å; F912-W1030 HydrophobicContact CD2-CZ3 4.25Å; F912-W1030 HydrophobicContact CE1-CE3 4.12Å; F912-W1030 AromaticContact CE2-CE3 3.68Å; F912-W1030 HydrophobicContact CE2-CE3 3.68Å; F912-W1030 AromaticContact CE2-CZ3 3.79Å; F912-W1030 HydrophobicContact CE2-CZ3 3.79Å; F912-W1030 HydrophobicContact CG-CE3 4.09Å; F912-W1030 AromaticContact CZ-CE3 3.87Å; F912-W1030 HydrophobicContact CZ-CE3 3.87Å; F912-W1030 HydrophobicContact CZ-CZ3 4.1Å; F912-F1033 HydrophobicContact CE1-CB 3.78Å; F912-F1033 AromaticContact CE1-CD1 3.95Å; F912-F1033 HydrophobicContact CE1-CD1 3.95Å; F912-F1033 HydrophobicContact CE1-CD2 4.18Å; F912-F1033 AromaticContact CE1-CG 3.68Å; F912-F1033 HydrophobicContact CE1-CG 3.68Å; F912-F1033 HydrophobicContact CE2-CD1 4.28Å; F912-F1033 HydrophobicContact CE2-CE1 4.39Å; F912-F1033 HydrophobicContact CZ-CB 4.14Å; F912-F1033 AromaticContact CZ-CD1 3.4Å; F912-F1033 HydrophobicContact CZ-CD1 3.4Å; F912-F1033 AromaticContact CZ-CD2 3.99Å; F912-F1033 HydrophobicContact CZ-CD2 3.99Å; F912-F1033 AromaticContact CZ-CE1 3.73Å; F912-F1033 HydrophobicContact CZ-CE1 3.73Å; F912-F1033 HydrophobicContact CZ-CE2 4.27Å; F912-F1033 AromaticContact CZ-CG 3.55Å; F912-F1033 HydrophobicContact CZ-CG 3.55Å; F912-F1033 HydrophobicContact CZ-CZ 4.16Å
913	T	90.6	Very high	88.6	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.6	25.5	177.4	67.6	0	0	0	0	113.5	K877 Y908 I911 P917 V1004	K877-T913 WeakPolarHBondContact CE-O 3.34Å; K877-T913 PolarHBondContact NZ-O 2.99Å; K877-T913 PolarHBondContact NZ-OG1 3.45Å; Y908-T913 HydrophobicContact CD2-CG2 3.91Å; Y908-T913 HydrophobicContact CE2-CG2 3.42Å; Y908-T913 VanDerWaalsContact CE2-CG2 3.42Å; Y908-T913 PolarHBondContact O-N 3.4Å; Y908-T913 PolarHBondContact O-OG1 2.94Å; I911-T913 PolarHBondContact O-N 3.44Å; T913-P917 VanDerWaalsContact O-CD 3.29Å; T913-P917 WeakPolarHBondContact O-CD 3.28Å; T913-V1004 HydrophobicContact CG2-CG1 4.03Å
914	A	88.9	Confident	89	Confident	14 Å²	14	23.2 Å²	23.2	12%	0.116	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-35.3	179.4	0	0	0	0	0	113.7	V910 I911 P917 F918	V910-A914 VanDerWaalsContact O-CB 3.25Å; V910-A914 WeakPolarHBondContact O-CB 3.44Å; I911-A914 PolarHBondContact O-N 2.97Å; A914-P917 WeakPolarHBondContact O-CD 3.24Å; A914-F918 WeakPolarHBondContact O-CD2 3.41Å
915	L	91.9	Very high	89	Confident	76 Å²	76	29.9 Å²	29.9	40%	0.398	16%	0.156	S	C	.	.	H	α-helix	trans	-69.7	-42.1	-177.3	-60.5	178.4	0	0	0	114.8	F918 T919 A1022	L915-F918 PolarHBondContact O-N 3.45Å; L915-F918 VanDerWaalsContact O-N 3.13Å; L915-T919 PolarHBondContact O-N 3Å; L915-A1022 HydrophobicContact CB-CB 3.69Å
916	P	93.3	Very high	89	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-59.9	-43.5	-177.5	-22.6	33.1	0	0	0	114.5	Y873 F918 T919 L920 A1008	Y873-P916 HydrophobicContact CE1-CB 4.12Å; P916-F918 VanDerWaalsContact C-N 3.35Å; P916-F918 PolarHBondContact O-N 2.7Å; P916-T919 WeakPolarHBondContact CA-OG1 3.39Å; P916-T919 PolarHBondContact O-N 3.13Å; P916-T919 PolarHBondContact O-OG1 3.02Å; P916-L920 WeakPolarHBondContact O-CG 3.5Å; P916-L920 PolarHBondContact O-N 3.28Å; P916-A1008 HydrophobicContact CB-CB 3.63Å
917	P	93.5	Very high	89.3	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.013	14%	0.144	C	C	.	.	H	α-helix	trans	-53.7	-45.3	170.4	-25	32.5	0	0	0	113.8	T373 Y873 K877 T913 A914 T919 L920 G921	T373-P917 HydrophobicContact CG2-CB 3.85Å; Y873-P917 HydrophobicContact CD1-CG 3.92Å; Y873-P917 HydrophobicContact CE1-CG 3.76Å; K877-P917 HydrophobicContact CD-CG 4.25Å; T913-P917 VanDerWaalsContact O-CD 3.29Å; T913-P917 WeakPolarHBondContact O-CD 3.28Å; A914-P917 WeakPolarHBondContact O-CD 3.24Å; P917-T919 PolarHBondContact O-N 3.16Å; P917-L920 PolarHBondContact O-N 3.24Å; P917-G921 PolarHBondContact O-N 3.27Å
918	F	93.6	Very high	89.4	Confident	55 Å²	55	28.5 Å²	28.5	24%	0.241	14%	0.144	C	C	.	.	H	α-helix	trans	-62.4	-41	177.3	-73.4	-58.9	0	0	0	111.9	T373 V376 V377 A914 L915 P916 G921 I922	T373-F918 HydrophobicContact CG2-CD1 4.11Å; T373-F918 HydrophobicContact CG2-CE1 3.86Å; T373-F918 HydrophobicContact CG2-CZ 4.21Å; V376-F918 HydrophobicContact CB-CE1 3.96Å; V376-F918 HydrophobicContact CG1-CD1 4.41Å; V376-F918 HydrophobicContact CG1-CE1 3.75Å; V376-F918 HydrophobicContact CG1-CZ 4.44Å; V377-F918 HydrophobicContact CG2-CD1 3.87Å; V377-F918 HydrophobicContact CG2-CE1 4.35Å; A914-F918 WeakPolarHBondContact O-CD2 3.41Å; L915-F918 PolarHBondContact O-N 3.45Å; L915-F918 VanDerWaalsContact O-N 3.13Å; P916-F918 VanDerWaalsContact C-N 3.35Å; P916-F918 PolarHBondContact O-N 2.7Å; F918-G921 PolarHBondContact O-N 2.77Å; F918-I922 HydrophobicContact CB-CD1 4.29Å; F918-I922 HydrophobicContact CD1-CD1 4.23Å; F918-I922 VanDerWaalsContact O-CB 3.26Å; F918-I922 WeakPolarHBondContact O-CB 3.27Å; F918-I922 VanDerWaalsContact O-CG1 3.3Å; F918-I922 WeakPolarHBondContact O-CG1 3.32Å; F918-I922 PolarHBondContact O-N 3.23Å
919	T	93.4	Very high	89.5	Confident	11 Å²	11	30.8 Å²	30.8	7%	0.067	16%	0.155	C	C	.	.	H	α-helix	trans	-66.8	-38.7	177.7	51.4	0	0	0	0	113.6	L915 P916 P917 F923 D924 F1018 A1022	L915-T919 PolarHBondContact O-N 3Å; P916-T919 WeakPolarHBondContact CA-OG1 3.39Å; P916-T919 PolarHBondContact O-N 3.13Å; P916-T919 PolarHBondContact O-OG1 3.02Å; P917-T919 PolarHBondContact O-N 3.16Å; T919-F923 HydrophobicContact CG2-CD2 4.19Å; T919-F923 PolarHBondContact O-N 3.38Å; T919-D924 PolarHBondContact O-N 3.46Å; T919-F1018 HydrophobicContact CG2-CB 4.25Å; T919-F1018 WeakPolarHBondContact CG2-O 3.42Å; T919-A1022 HydrophobicContact CG2-CB 3.44Å; T919-A1022 VanDerWaalsContact CG2-CB 3.44Å
920	L	93.3	Very high	89.7	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-65.5	-38.9	172.8	-69	169.8	0	0	0	111.7	Y873 P916 P917 A1008 T1012	Y873-L920 HydrophobicContact CD1-CD1 4.01Å; Y873-L920 HydrophobicContact CD2-CD1 4.36Å; Y873-L920 HydrophobicContact CG-CD1 3.85Å; P916-L920 WeakPolarHBondContact O-CG 3.5Å; P916-L920 PolarHBondContact O-N 3.28Å; P917-L920 PolarHBondContact O-N 3.24Å; L920-A1008 HydrophobicContact CD1-CB 4.45Å; L920-T1012 WeakPolarHBondContact CD2-OG1 3.49Å
921	G	92.4	Very high	90	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-76.1	-27.7	179.9	0	0	0	0	0	115.3	V377 Q381 R866 P917 F918	V377-G921 VanDerWaalsContact CG1-O 3.29Å; V377-G921 WeakPolarHBondContact CG1-O 3.36Å; Q381-G921 PolarHBondContact NE2-O 2.85Å; R866-G921 WeakPolarHBondContact CB-O 3.18Å; R866-G921 WeakPolarHBondContact CD-O 3.38Å; P917-G921 PolarHBondContact O-N 3.27Å; F918-G921 PolarHBondContact O-N 2.77Å
922	I	93.4	Very high	90.1	Very high	14 Å²	14	31.1 Å²	31.1	7%	0.072	15%	0.15	C	C	.	.	H	α-helix	trans	-110.9	-48.6	-170.8	-60.9	171.7	0	0	0	112.1	V377 T380 F384 R866 F918	V377-I922 HydrophobicContact CG2-CD1 4.46Å; V377-I922 HydrophobicContact CG2-CG1 4.08Å; T380-I922 HydrophobicContact CG2-CD1 4.19Å; T380-I922 HydrophobicContact CG2-CG1 4.37Å; T380-I922 HydrophobicContact CG2-CG2 3.74Å; F384-I922 HydrophobicContact CE2-CG2 3.52Å; F384-I922 HydrophobicContact CZ-CG2 3.68Å; R866-I922 PolarHBondContact NE-O 2.94Å; F918-I922 HydrophobicContact CB-CD1 4.29Å; F918-I922 HydrophobicContact CD1-CD1 4.23Å; F918-I922 VanDerWaalsContact O-CB 3.26Å; F918-I922 WeakPolarHBondContact O-CB 3.27Å; F918-I922 VanDerWaalsContact O-CG1 3.3Å; F918-I922 WeakPolarHBondContact O-CG1 3.32Å; F918-I922 PolarHBondContact O-N 3.23Å
923	F	92.1	Very high	90	Very high	58 Å²	58	33 Å²	33	25%	0.254	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	-16.8	-164.4	-62.3	-64.2	0	0	0	115.1	F384 T919 F1018	F384-F923 HydrophobicContact CZ-CE1 4.17Å; T919-F923 HydrophobicContact CG2-CD2 4.19Å; T919-F923 PolarHBondContact O-N 3.38Å; F923-F1018 AromaticContact CD1-CD2 3.91Å; F923-F1018 HydrophobicContact CD1-CD2 3.91Å; F923-F1018 HydrophobicContact CD1-CE2 4.4Å; F923-F1018 HydrophobicContact CD2-CB 3.69Å; F923-F1018 HydrophobicContact CD2-CD2 4.13Å; F923-F1018 HydrophobicContact CD2-CG 4.04Å; F923-F1018 AromaticContact CE1-CD2 3.82Å; F923-F1018 HydrophobicContact CE1-CD2 3.82Å; F923-F1018 AromaticContact CE1-CE2 3.98Å; F923-F1018 HydrophobicContact CE1-CE2 3.98Å; F923-F1018 HydrophobicContact CE1-CG 4.44Å; F923-F1018 HydrophobicContact CE2-CB 3.89Å; F923-F1018 HydrophobicContact CE2-CD1 4.38Å; F923-F1018 HydrophobicContact CE2-CD2 4.05Å; F923-F1018 AromaticContact CE2-CG 3.85Å; F923-F1018 HydrophobicContact CE2-CG 3.85Å; F923-F1018 HydrophobicContact CG-CB 4.23Å; F923-F1018 HydrophobicContact CG-CD2 4.07Å; F923-F1018 HydrophobicContact CG-CG 4.43Å; F923-F1018 HydrophobicContact CZ-CD1 4.47Å; F923-F1018 AromaticContact CZ-CD2 3.89Å; F923-F1018 HydrophobicContact CZ-CD2 3.89Å; F923-F1018 HydrophobicContact CZ-CE2 4.16Å; F923-F1018 HydrophobicContact CZ-CG 4.06Å
924	D	90.6	Very high	89.8	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.016	18%	0.181	C	C	.	.			trans	-62.5	147.7	179.9	-165.2	17.8	0	0	0	112	R866 K869 T919 T1013 A1014	R866-D924 PolarHBondContact NE-O 2.91Å; R866-D924 PolarHBondContact NH2-O 3.22Å; K869-D924 WeakPolarHBondContact CD-OD2 3.22Å; K869-D924 IonicContact NZ-OD2 3.58Å; K869-D924 PolarHBondContact NZ-OD2 2.93Å; T919-D924 PolarHBondContact O-N 3.46Å; D924-T1013 WeakPolarHBondContact OD1-CA 3.22Å; D924-T1013 WeakPolarHBondContact OD1-CB 3.42Å; D924-T1013 PolarHBondContact OD1-N 3.39Å; D924-T1013 PolarHBondContact OD1-OG1 3.37Å; D924-T1013 PolarHBondContact OD2-OG1 2.76Å; D924-A1014 PolarHBondContact OD1-N 2.89Å
925	R	86.4	Confident	89.8	Confident	140 Å²	140	39 Å²	39	53%	0.528	18%	0.179	S	C	.	.			trans	-139.2	117.3	-177.3	-58.6	-178.1	-169.6	-167.8	-2.2	108.9	A1014	R925-A1014 HydrophobicContact CB-CB 4.06Å
926	P	82.4	Confident	89.6	Confident	12 Å²	12	35.4 Å²	35.4	8%	0.078	16%	0.161	C	C	.	.	S	Bend	trans	-77.3	-23	178.9	30.4	-35	0	0	0	113.3	N865 L1093 Q1097	N865-P926 HydrophobicContact CB-CG 4.45Å; P926-L1093 HydrophobicContact CB-CD1 4.45Å; P926-L1093 HydrophobicContact CB-CD2 4.24Å; P926-Q1097 VanDerWaalsContact O-CG 3.32Å; P926-Q1097 WeakPolarHBondContact O-CG 3.37Å; P926-Q1097 PolarHBondContact O-NE2 2.92Å
927	C	85.4	Confident	89.4	Confident	6 Å²	6	38.2 Å²	38.2	4%	0.041	17%	0.174	C	C	.	.	S	Bend	trans	-165.9	156.2	-177.3	-168.7	0	0	0	0	107.9	W862 N931 M932 L1093 E1100	W862-C927 WeakPolarHBondContact CZ2-O 3.17Å; W862-C927 PolarHBondContact NE1-O 2.91Å; C927-N931 WeakPolarHBondContact SG-CB 3.41Å; C927-M932 HydrophobicContact CB-CG 3.96Å; C927-M932 HydrophobicContact CB-SD 3.69Å; C927-L1093 HydrophobicContact CB-CD1 4.02Å; C927-E1100 PolarHBondContact SG-OE2 3Å
928	S	88.6	Confident	89.1	Confident	32 Å²	32	38.4 Å²	38.4	22%	0.224	18%	0.175	C	C	.	.			trans	-68.7	156	173.8	53.5	0	0	0	0	113.1	Q930 N931 M932 E1100	S928-Q930 VanDerWaalsContact C-N 3.3Å; S928-Q930 PolarHBondContact O-N 3.4Å; S928-N931 PolarHBondContact O-N 3.02Å; S928-N931 PolarHBondContact OG-ND2 2.79Å; S928-M932 WeakPolarHBondContact O-CG 3.45Å; S928-M932 PolarHBondContact O-N 3.2Å; S928-E1100 WeakPolarHBondContact CB-OE1 3.38Å; S928-E1100 PolarHBondContact N-OE1 3.4Å; S928-E1100 PolarHBondContact N-OE2 3.24Å; S928-E1100 PolarHBondContact OG-OE1 2.69Å; S928-E1100 PolarHBondContact OG-OE2 3.45Å
929	Q	89.9	Confident	89	Confident	48 Å²	48	35.8 Å²	35.8	22%	0.224	16%	0.163	C	C	.	.	H	α-helix	trans	-53.9	-45.6	177.1	-179.6	-175.8	-65.9	0	0	112.2	E390 K854 V858 W862 N931 M932 L933	E390-Q929 PolarHBondContact OE1-NE2 3.09Å; E390-Q929 PolarHBondContact OE2-NE2 3.45Å; K854-Q929 VanDerWaalsContact NZ-CD 3.31Å; V858-Q929 HydrophobicContact CG1-CB 4.2Å; V858-Q929 HydrophobicContact CG1-CG 3.95Å; V858-Q929 HydrophobicContact CG2-CG 3.97Å; W862-Q929 HydrophobicContact CH2-CB 4.19Å; W862-Q929 HydrophobicContact CZ2-CB 4.29Å; Q929-N931 PolarHBondContact O-N 3.49Å; Q929-M932 PolarHBondContact O-N 3.21Å; Q929-L933 HydrophobicContact CG-CD1 4.24Å; Q929-L933 WeakPolarHBondContact O-CG 3.49Å; Q929-L933 PolarHBondContact O-N 3.18Å; Q929-L933 VanDerWaalsContact O-N 3.09Å
930	Q	88	Confident	88.7	Confident	156 Å²	156	41 Å²	41	73%	0.729	18%	0.181	S	C	*	.	H	α-helix	trans	-61.9	-44.9	-179.1	-67.4	174.2	-13.6	0	0	111.6	S928 L933 R934	S928-Q930 VanDerWaalsContact C-N 3.3Å; S928-Q930 PolarHBondContact O-N 3.4Å; Q930-L933 PolarHBondContact O-N 3.3Å; Q930-R934 VanDerWaalsContact O-CB 3.26Å; Q930-R934 WeakPolarHBondContact O-CB 3.48Å; Q930-R934 PolarHBondContact O-N 2.73Å
931	N	87.6	Confident	88.3	Confident	18 Å²	18	42.8 Å²	42.8	10%	0.096	19%	0.191	C	C	.	.	H	α-helix	trans	-69.6	-35.4	177.1	-78	-22.1	0	0	0	112.8	C927 S928 Q929 L933 R934 F935 V1096 E1100	C927-N931 WeakPolarHBondContact SG-CB 3.41Å; S928-N931 PolarHBondContact O-N 3.02Å; S928-N931 PolarHBondContact OG-ND2 2.79Å; Q929-N931 PolarHBondContact O-N 3.49Å; N931-L933 VanDerWaalsContact C-N 3.35Å; N931-L933 PolarHBondContact O-N 3.13Å; N931-R934 PolarHBondContact O-N 3.41Å; N931-F935 HydrophobicContact CB-CD2 4.41Å; N931-F935 VanDerWaalsContact O-CD2 3.3Å; N931-F935 WeakPolarHBondContact O-CD2 3.41Å; N931-F935 PolarHBondContact O-N 3.5Å; N931-V1096 HydrophobicContact CB-CG1 4.28Å; N931-E1100 VanDerWaalsContact ND2-CD 3.28Å; N931-E1100 PolarHBondContact ND2-OE2 2.86Å
932	M	87.5	Confident	88.1	Confident	7 Å²	7	43 Å²	43	3%	0.034	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-37.3	175.1	-71.1	-60	-60.1	0	0	112.9	L857 V858 A861 C927 S928 Q929 L938	L857-M932 WeakPolarHBondContact O-CE 3.21Å; V858-M932 HydrophobicContact CG2-CB 4.29Å; A861-M932 HydrophobicContact CB-CE 3.74Å; C927-M932 HydrophobicContact CB-CG 3.96Å; C927-M932 HydrophobicContact CB-SD 3.69Å; S928-M932 WeakPolarHBondContact O-CG 3.45Å; S928-M932 PolarHBondContact O-N 3.2Å; Q929-M932 PolarHBondContact O-N 3.21Å; M932-L938 HydrophobicContact CE-CB 4.14Å; M932-L938 HydrophobicContact SD-CB 4.16Å; M932-L938 HydrophobicContact SD-CD1 3.8Å
933	L	87.8	Confident	87.8	Confident	39 Å²	39	43.5 Å²	43.5	20%	0.204	19%	0.194	C	C	.	.	H	α-helix	trans	-75.1	-42.7	174.9	-65	169.8	0	0	0	111.7	E853 L857 V858 Q929 Q930 N931 F935	E853-L933 HydrophobicContact CG-CD2 3.94Å; L857-L933 HydrophobicContact CB-CD2 4.49Å; V858-L933 HydrophobicContact CG2-CD1 4.39Å; V858-L933 HydrophobicContact CG2-CD2 3.87Å; V858-L933 HydrophobicContact CG2-CG 3.87Å; Q929-L933 HydrophobicContact CG-CD1 4.24Å; Q929-L933 WeakPolarHBondContact O-CG 3.49Å; Q929-L933 PolarHBondContact O-N 3.18Å; Q929-L933 VanDerWaalsContact O-N 3.09Å; Q930-L933 PolarHBondContact O-N 3.3Å; N931-L933 VanDerWaalsContact C-N 3.35Å; N931-L933 PolarHBondContact O-N 3.13Å; L933-F935 VanDerWaalsContact C-N 3.31Å; L933-F935 PolarHBondContact O-N 3.02Å
934	R	85.8	Confident	87.3	Confident	124 Å²	124	45.2 Å²	45.2	47%	0.468	21%	0.206	S	C	.	.	H	α-helix	trans	-67.3	-28.9	-179.5	-167.7	173.7	178.3	-144.9	-2.8	113.2	Q930 N931 P936 D1105	Q930-R934 VanDerWaalsContact O-CB 3.26Å; Q930-R934 WeakPolarHBondContact O-CB 3.48Å; Q930-R934 PolarHBondContact O-N 2.73Å; N931-R934 PolarHBondContact O-N 3.41Å; R934-P936 WeakPolarHBondContact O-CD 3.37Å; R934-D1105 IonicContact CZ-OD1 2.77Å; R934-D1105 IonicContact CZ-OD2 2.72Å; R934-D1105 VanDerWaalsContact NH1-CG 3.29Å; R934-D1105 IonicContact NH1-OD1 2.92Å; R934-D1105 PolarHBondContact NH1-OD1 3.32Å; R934-D1105 IonicContact NH1-OD2 3.63Å; R934-D1105 PolarHBondContact NH1-OD2 2.9Å; R934-D1105 IonicContact NH2-OD1 2.71Å; R934-D1105 PolarHBondContact NH2-OD1 3.29Å; R934-D1105 IonicContact NH2-OD2 3.97Å; R934-D1105 PolarHBondContact NH2-OD2 2.98Å
935	F	88.3	Confident	86.9	Confident	16 Å²	16	46.4 Å²	46.4	7%	0.07	22%	0.216	C	C	.	.			trans	-125.7	73.2	-179.8	-50.8	-69.4	0	0	0	112.6	N931 L933 Q937 L938 P1106 V1110	N931-F935 HydrophobicContact CB-CD2 4.41Å; N931-F935 VanDerWaalsContact O-CD2 3.3Å; N931-F935 WeakPolarHBondContact O-CD2 3.41Å; N931-F935 PolarHBondContact O-N 3.5Å; L933-F935 VanDerWaalsContact C-N 3.31Å; L933-F935 PolarHBondContact O-N 3.02Å; F935-Q937 VanDerWaalsContact C-OE1 3.27Å; F935-Q937 PolarHBondContact O-N 2.9Å; F935-L938 HydrophobicContact CB-CD1 4.2Å; F935-L938 HydrophobicContact CB-CG 4.36Å; F935-L938 WeakPolarHBondContact O-CB 3.43Å; F935-L938 WeakPolarHBondContact O-CG 3.45Å; F935-L938 PolarHBondContact O-N 3.23Å; F935-L938 VanDerWaalsContact O-N 3.12Å; F935-P1106 HydrophobicContact CD2-CG 4.38Å; F935-P1106 HydrophobicContact CE2-CB 4.22Å; F935-P1106 HydrophobicContact CE2-CG 3.49Å; F935-P1106 VanDerWaalsContact CE2-CG 3.49Å; F935-P1106 HydrophobicContact CZ-CB 4.46Å; F935-P1106 HydrophobicContact CZ-CG 3.91Å; F935-V1110 HydrophobicContact CB-CG1 4.5Å; F935-V1110 HydrophobicContact CB-CG2 4.24Å; F935-V1110 HydrophobicContact CD1-CB 3.8Å; F935-V1110 HydrophobicContact CD1-CG1 3.93Å; F935-V1110 HydrophobicContact CD1-CG2 3.48Å; F935-V1110 VanDerWaalsContact CD1-CG2 3.48Å; F935-V1110 HydrophobicContact CE1-CB 4.21Å; F935-V1110 HydrophobicContact CE1-CG2 3.95Å; F935-V1110 HydrophobicContact CG-CG2 3.81Å
936	P	88.9	Confident	86.5	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.006	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-59.4	-21	-174.8	-22.7	34.2	0	0	0	114.1	T685 R688 A689 L857 R934 L938 Y939	T685-P936 HydrophobicContact CG2-CB 4.2Å; T685-P936 HydrophobicContact CG2-CG 3.58Å; R688-P936 HydrophobicContact CB-CB 4.32Å; R688-P936 HydrophobicContact CB-CG 4.35Å; A689-P936 WeakPolarHBondContact CA-O 3.49Å; A689-P936 HydrophobicContact CB-CB 3.82Å; L857-P936 HydrophobicContact CD1-CB 3.97Å; L857-P936 HydrophobicContact CD1-CG 4.33Å; R934-P936 WeakPolarHBondContact O-CD 3.37Å; P936-L938 PolarHBondContact O-N 2.92Å; P936-L938 VanDerWaalsContact O-N 3.13Å; P936-Y939 WeakPolarHBondContact O-CB 3.46Å; P936-Y939 PolarHBondContact O-N 3.13Å
937	Q	87.8	Confident	86	Confident	60 Å²	60	45.1 Å²	45.1	28%	0.28	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-57.5	-25	177.3	-57.8	88.9	-21.9	0	0	113	F935 Y939 R940 L1092	F935-Q937 VanDerWaalsContact C-OE1 3.27Å; F935-Q937 PolarHBondContact O-N 2.9Å; Q937-Y939 PolarHBondContact O-N 2.96Å; Q937-R940 WeakPolarHBondContact O-CB 3.47Å; Q937-R940 WeakPolarHBondContact O-CG 3.22Å; Q937-R940 PolarHBondContact O-N 2.8Å; Q937-L1092 HydrophobicContact CB-CD2 4.31Å
938	L	88.1	Confident	86	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.026	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-58.6	-28.9	175.6	-68.1	173.9	0	0	0	112.8	M932 F935 P936 R940 I941 L1092 L1093 V1096	M932-L938 HydrophobicContact CE-CB 4.14Å; M932-L938 HydrophobicContact SD-CB 4.16Å; M932-L938 HydrophobicContact SD-CD1 3.8Å; F935-L938 HydrophobicContact CB-CD1 4.2Å; F935-L938 HydrophobicContact CB-CG 4.36Å; F935-L938 WeakPolarHBondContact O-CB 3.43Å; F935-L938 WeakPolarHBondContact O-CG 3.45Å; F935-L938 PolarHBondContact O-N 3.23Å; F935-L938 VanDerWaalsContact O-N 3.12Å; P936-L938 PolarHBondContact O-N 2.92Å; P936-L938 VanDerWaalsContact O-N 3.13Å; L938-R940 PolarHBondContact O-N 3.4Å; L938-I941 PolarHBondContact O-N 3.04Å; L938-L1092 HydrophobicContact CD2-CB 4.45Å; L938-L1092 HydrophobicContact CD2-CD2 4.14Å; L938-L1092 HydrophobicContact CD2-CG 3.94Å; L938-L1093 HydrophobicContact CD2-CB 4.19Å; L938-L1093 HydrophobicContact CD2-CD1 4.29Å; L938-V1096 HydrophobicContact CD1-CG1 4.49Å; L938-V1096 HydrophobicContact CD2-CG2 4.36Å
939	Y	91	Very high	85.8	Confident	1 Å²	1	46.3 Å²	46.3	0%	0.004	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-65	-22.7	179.4	-172.9	-104.7	0	0	0	113.6	L411 V414 A689 I691 L856 L857 A861 P936 Q937 I941 T942 Q943	L411-Y939 PolarHBondContact O-OH 3.04Å; V414-Y939 WeakPolarHBondContact CB-OH 3.29Å; V414-Y939 PolarHBondContact N-OH 3.31Å; V414-Y939 VanDerWaalsContact N-OH 3.11Å; V414-Y939 WeakPolarHBondContact O-CE1 3.11Å; V414-Y939 PolarHBondContact O-OH 3.05Å; A689-Y939 HydrophobicContact CB-CD1 4.1Å; A689-Y939 HydrophobicContact CB-CG 4.48Å; I691-Y939 HydrophobicContact CD1-CD1 4.27Å; I691-Y939 HydrophobicContact CD1-CE1 3.74Å; I691-Y939 HydrophobicContact CG1-CD1 4.36Å; I691-Y939 HydrophobicContact CG1-CE1 3.88Å; L856-Y939 HydrophobicContact CB-CE2 4.45Å; L856-Y939 WeakPolarHBondContact O-CE2 3.43Å; L857-Y939 HydrophobicContact CD2-CD1 4.13Å; L857-Y939 HydrophobicContact CD2-CD2 3.77Å; L857-Y939 HydrophobicContact CD2-CE2 4.4Å; L857-Y939 HydrophobicContact CD2-CG 3.63Å; A861-Y939 HydrophobicContact CB-CD2 4.17Å; P936-Y939 WeakPolarHBondContact O-CB 3.46Å; P936-Y939 PolarHBondContact O-N 3.13Å; Q937-Y939 PolarHBondContact O-N 2.96Å; Y939-I941 PolarHBondContact O-N 3.38Å; Y939-T942 PolarHBondContact O-N 2.95Å; Y939-T942 VanDerWaalsContact O-N 3.15Å; Y939-T942 PolarHBondContact O-OG1 2.87Å; Y939-Q943 HydrophobicContact CD1-CG 3.6Å; Y939-Q943 HydrophobicContact CE1-CG 3.43Å; Y939-Q943 VanDerWaalsContact CE1-CG 3.43Å; Y939-Q943 PolarHBondContact O-N 3.31Å; Y939-Q943 VanDerWaalsContact O-N 3.1Å
940	R	87.8	Confident	85.7	Confident	119 Å²	119	47.4 Å²	47.4	45%	0.449	24%	0.236	S	C	.	.	H	α-helix	trans	-60.8	-30.1	178.6	-64.7	-178	178.6	-169.1	-1.4	113.1	R688 A689 Q937 L938 T942 Q943 N944	R688-R940 PolarHBondContact O-NH2 2.69Å; A689-R940 WeakPolarHBondContact O-CG 3.47Å; A689-R940 PolarHBondContact O-NE 3.46Å; Q937-R940 WeakPolarHBondContact O-CB 3.47Å; Q937-R940 WeakPolarHBondContact O-CG 3.22Å; Q937-R940 PolarHBondContact O-N 2.8Å; L938-R940 PolarHBondContact O-N 3.4Å; R940-T942 VanDerWaalsContact C-N 3.32Å; R940-T942 PolarHBondContact O-N 3.05Å; R940-Q943 PolarHBondContact O-N 3.21Å; R940-N944 WeakPolarHBondContact O-CB 3.47Å; R940-N944 VanDerWaalsContact O-CG 3.32Å; R940-N944 PolarHBondContact O-N 3.25Å
941	I	85.4	Confident	85.7	Confident	39 Å²	39	48.7 Å²	48.7	20%	0.2	24%	0.239	C	C	.	.	H	α-helix	trans	-65.5	-36.9	180	-55.8	172.5	0	0	0	110.7	L938 Y939 E946 L1093	L938-I941 PolarHBondContact O-N 3.04Å; Y939-I941 PolarHBondContact O-N 3.38Å; I941-E946 HydrophobicContact CG2-CB 4.35Å; I941-E946 PolarHBondContact O-N 3.38Å; I941-L1093 HydrophobicContact CD1-CB 3.86Å
942	T	87.4	Confident	85.9	Confident	4 Å²	4	50.1 Å²	50.1	3%	0.025	25%	0.249	C	C	.	.	H	α-helix	trans	-83.6	-35	178.6	57.7	0	0	0	0	112.1	G412 Q413 Y864 N865 Y939 R940 N944 A945	G412-T942 CarbonylContact O-C 3.52Å; G412-T942 WeakPolarHBondContact O-CB 3.47Å; G412-T942 PolarHBondContact O-OG1 3.13Å; Q413-T942 PolarHBondContact NE2-O 3.46Å; Q413-T942 VanDerWaalsContact NE2-O 3.09Å; Y864-T942 HydrophobicContact CD1-CG2 3.54Å; Y864-T942 HydrophobicContact CE1-CG2 4.13Å; Y864-T942 HydrophobicContact CG-CG2 4.34Å; N865-T942 VanDerWaalsContact ND2-CG2 3.3Å; N865-T942 WeakPolarHBondContact ND2-CG2 3.18Å; Y939-T942 PolarHBondContact O-N 2.95Å; Y939-T942 VanDerWaalsContact O-N 3.15Å; Y939-T942 PolarHBondContact O-OG1 2.87Å; R940-T942 VanDerWaalsContact C-N 3.32Å; R940-T942 PolarHBondContact O-N 3.05Å; T942-N944 VanDerWaalsContact C-N 3.34Å; T942-N944 PolarHBondContact O-N 3.39Å; T942-A945 PolarHBondContact O-N 3.28Å
943	Q	86.4	Confident	86	Confident	25 Å²	25	49.9 Å²	49.9	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-55.6	-44.8	168.9	-71.2	-175.8	-39.1	0	0	112.8	V414 G690 Y939 R940 A945	V414-Q943 PolarHBondContact O-NE2 3.24Å; G690-Q943 PolarHBondContact O-NE2 2.9Å; Y939-Q943 HydrophobicContact CD1-CG 3.6Å; Y939-Q943 HydrophobicContact CE1-CG 3.43Å; Y939-Q943 VanDerWaalsContact CE1-CG 3.43Å; Y939-Q943 PolarHBondContact O-N 3.31Å; Y939-Q943 VanDerWaalsContact O-N 3.1Å; R940-Q943 PolarHBondContact O-N 3.21Å; Q943-A945 PolarHBondContact O-N 2.7Å
944	N	82.9	Confident	86.2	Confident	95 Å²	95	51.6 Å²	51.6	51%	0.508	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-3.3	-178.9	-73.7	-14.6	0	0	0	114.3	R940 T942 E946	R940-N944 WeakPolarHBondContact O-CB 3.47Å; R940-N944 VanDerWaalsContact O-CG 3.32Å; R940-N944 PolarHBondContact O-N 3.25Å; T942-N944 VanDerWaalsContact C-N 3.34Å; T942-N944 PolarHBondContact O-N 3.39Å; N944-E946 HydrophobicContact CB-CG 3.75Å; N944-E946 VanDerWaalsContact CB-OE1 3.3Å; N944-E946 WeakPolarHBondContact CB-OE1 3.47Å; N944-E946 PolarHBondContact ND2-OE1 3.38Å; N944-E946 PolarHBondContact O-N 2.97Å
945	A	81.6	Confident	86.5	Confident	27 Å²	27	47.6 Å²	47.6	22%	0.223	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	29	-174.1	0	0	0	0	0	114.7	Y864 T942 Q943 G947 F948	Y864-A945 VanDerWaalsContact OH-CA 3.32Å; Y864-A945 WeakPolarHBondContact OH-CA 3.41Å; T942-A945 PolarHBondContact O-N 3.28Å; Q943-A945 PolarHBondContact O-N 2.7Å; A945-G947 VanDerWaalsContact C-N 3.26Å; A945-G947 PolarHBondContact O-N 3.18Å; A945-F948 CarbonylContact O-C 3.44Å; A945-F948 PolarHBondContact O-N 3.43Å
946	E	77	Confident	86.7	Confident	95 Å²	95	48.7 Å²	48.7	44%	0.444	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-33.8	-174.4	-71.8	172.6	-145.4	0	0	112.5	I941 N944 N949	I941-E946 HydrophobicContact CG2-CB 4.35Å; I941-E946 PolarHBondContact O-N 3.38Å; N944-E946 HydrophobicContact CB-CG 3.75Å; N944-E946 VanDerWaalsContact CB-OE1 3.3Å; N944-E946 WeakPolarHBondContact CB-OE1 3.47Å; N944-E946 PolarHBondContact ND2-OE1 3.38Å; N944-E946 PolarHBondContact O-N 2.97Å; E946-N949 PolarHBondContact O-ND2 3.29Å; E946-N949 VanDerWaalsContact O-ND2 3.14Å
947	G	73.6	Confident	86.8	Confident	30 Å²	30	49.1 Å²	49.1	31%	0.309	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-22.8	177.7	0	0	0	0	0	115.2	A945	A945-G947 VanDerWaalsContact C-N 3.26Å; A945-G947 PolarHBondContact O-N 3.18Å
948	F	84.7	Confident	87.1	Confident	11 Å²	11	50.9 Å²	50.9	5%	0.048	27%	0.267	C	S	.	.	S	Bend	trans	-143.6	98.3	-178.5	-169.8	-108.8	0	0	0	112.8	V300 V303 Y864 T868 I871 L872 A945	V300-F948 HydrophobicContact CG1-CD1 4.01Å; V300-F948 HydrophobicContact CG1-CE1 3.93Å; V303-F948 HydrophobicContact CB-CE1 4.05Å; V303-F948 HydrophobicContact CG1-CD1 4.32Å; V303-F948 HydrophobicContact CG1-CE1 3.64Å; V303-F948 HydrophobicContact CG1-CZ 4.31Å; Y864-F948 PolarHBondContact OH-N 3.28Å; T868-F948 HydrophobicContact CG2-CB 3.34Å; T868-F948 HydrophobicContact CG2-CD1 4.39Å; T868-F948 HydrophobicContact CG2-CD2 4.39Å; T868-F948 HydrophobicContact CG2-CG 3.83Å; I871-F948 HydrophobicContact CB-CE2 4.21Å; I871-F948 HydrophobicContact CD1-CZ 4.39Å; I871-F948 HydrophobicContact CG2-CE2 3.65Å; I871-F948 HydrophobicContact CG2-CZ 3.79Å; L872-F948 HydrophobicContact CD1-CD2 4.24Å; L872-F948 HydrophobicContact CD2-CD2 3.96Å; L872-F948 HydrophobicContact CD2-CE2 3.94Å; L872-F948 HydrophobicContact CG-CD2 3.94Å; L872-F948 HydrophobicContact CG-CE2 4.14Å; A945-F948 CarbonylContact O-C 3.44Å; A945-F948 PolarHBondContact O-N 3.43Å
949	N	85.3	Confident	87.4	Confident	53 Å²	53	51.5 Å²	51.5	28%	0.283	27%	0.27	S	S	.	.	S	Bend	trans	-143.5	165.1	174.4	61.1	74.3	0	0	0	109.9	E946 K951 V952 F953	E946-N949 PolarHBondContact O-ND2 3.29Å; E946-N949 VanDerWaalsContact O-ND2 3.14Å; N949-K951 PolarHBondContact O-N 3.27Å; N949-K951 VanDerWaalsContact O-N 3.13Å; N949-K951 WeakPolarHBondContact OD1-CB 3.26Å; N949-K951 PolarHBondContact OD1-N 2.84Å; N949-K951 VanDerWaalsContact OD1-N 3.1Å; N949-V952 WeakPolarHBondContact ND2-CG2 3.49Å; N949-V952 PolarHBondContact O-N 3.19Å; N949-V952 VanDerWaalsContact O-N 3.12Å; N949-V952 PolarHBondContact OD1-N 3.41Å; N949-V952 VanDerWaalsContact OD1-N 3.09Å; N949-F953 PolarHBondContact O-N 3.43Å
950	T	86.8	Confident	87.5	Confident	71 Å²	71	51.4 Å²	51.4	44%	0.436	27%	0.27	S	S	.	.	H	α-helix	trans	-55.6	-32.2	-176.7	-50.3	0	0	0	0	113.5	Q307 W954	Q307-T950 PolarHBondContact NE2-OG1 3.33Å; T950-W954 PolarHBondContact O-N 2.97Å; T950-W954 VanDerWaalsContact O-N 3.09Å
951	K	89.1	Confident	87.8	Confident	183 Å²	183	48.8 Å²	48.8	80%	0.796	27%	0.265	S	S	*	.	H	α-helix	trans	-71.4	-43.9	178.9	-59.2	-179.5	-179.9	178.6	0	111.6	N949 W954 G955	N949-K951 PolarHBondContact O-N 3.27Å; N949-K951 VanDerWaalsContact O-N 3.13Å; N949-K951 WeakPolarHBondContact OD1-CB 3.26Å; N949-K951 PolarHBondContact OD1-N 2.84Å; N949-K951 VanDerWaalsContact OD1-N 3.1Å; K951-W954 PolarHBondContact O-N 3.34Å; K951-G955 PolarHBondContact O-N 3.02Å
952	V	89.9	Confident	88.3	Confident	48 Å²	48	50 Å²	50	29%	0.291	27%	0.27	S	S	.	.	H	α-helix	trans	-61.8	-45.8	174.6	172.2	0	0	0	0	110.4	L872 N949 W954 G955 H956	L872-V952 HydrophobicContact CD1-CG1 3.8Å; L872-V952 HydrophobicContact CD2-CG1 4.29Å; N949-V952 WeakPolarHBondContact ND2-CG2 3.49Å; N949-V952 PolarHBondContact O-N 3.19Å; N949-V952 VanDerWaalsContact O-N 3.12Å; N949-V952 PolarHBondContact OD1-N 3.41Å; N949-V952 VanDerWaalsContact OD1-N 3.09Å; V952-W954 PolarHBondContact O-N 2.93Å; V952-G955 WeakPolarHBondContact O-CA 3.39Å; V952-G955 PolarHBondContact O-N 2.87Å; V952-G955 VanDerWaalsContact O-N 3.1Å; V952-H956 PolarHBondContact O-CD2 3.11Å; V952-H956 PolarHBondContact O-N 3.19Å
953	F	91	Very high	88.7	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.009	27%	0.269	C	S	.	.	H	α-helix	trans	-54.5	-51.4	176.1	174	-95	0	0	0	112.7	Q307 L311 L872 F875 N949 G955 H956 C957	Q307-F953 HydrophobicContact CB-CD1 4.36Å; Q307-F953 HydrophobicContact CB-CD2 4.41Å; Q307-F953 HydrophobicContact CB-CE1 3.88Å; Q307-F953 HydrophobicContact CB-CE2 3.93Å; Q307-F953 HydrophobicContact CB-CZ 3.65Å; Q307-F953 HydrophobicContact CG-CD1 3.98Å; Q307-F953 HydrophobicContact CG-CD2 4.13Å; Q307-F953 HydrophobicContact CG-CE1 4.02Å; Q307-F953 HydrophobicContact CG-CE2 4.16Å; Q307-F953 HydrophobicContact CG-CG 4.05Å; Q307-F953 HydrophobicContact CG-CZ 4.11Å; L311-F953 HydrophobicContact CD1-CZ 3.97Å; L311-F953 HydrophobicContact CG-CZ 4.27Å; L872-F953 HydrophobicContact CD2-CB 4.26Å; L872-F953 HydrophobicContact CD2-CD2 4.35Å; F875-F953 HydrophobicContact CB-CE2 4.18Å; F875-F953 HydrophobicContact CD1-CE2 4.26Å; F875-F953 HydrophobicContact CD2-CD2 4.37Å; F875-F953 AromaticContact CD2-CE2 3.65Å; F875-F953 HydrophobicContact CD2-CE2 3.65Å; F875-F953 HydrophobicContact CE2-CE2 4.01Å; F875-F953 AromaticContact CG-CE2 3.77Å; F875-F953 HydrophobicContact CG-CE2 3.77Å; F875-F953 HydrophobicContact CG-CZ 4.47Å; F875-F953 HydrophobicContact CZ-CE2 4.48Å; N949-F953 PolarHBondContact O-N 3.43Å; F953-G955 VanDerWaalsContact C-N 3.3Å; F953-G955 PolarHBondContact O-N 3.48Å; F953-H956 PolarHBondContact O-N 3.33Å; F953-C957 PolarHBondContact O-N 2.96Å; F953-C957 PolarHBondContact O-SG 3.41Å
954	W	91.2	Very high	89.1	Confident	74 Å²	74	48.6 Å²	48.6	28%	0.28	26%	0.264	S	S	.	.	H	α-helix	trans	-66.3	-31.3	176.5	-73.1	114.3	0	0	0	113	V310 L311 I314 T950 K951 V952 H956 C957 I958	V310-W954 HydrophobicContact CG1-CH2 4.2Å; V310-W954 HydrophobicContact CG1-CZ2 3.71Å; L311-W954 HydrophobicContact CD2-CH2 4.24Å; I314-W954 HydrophobicContact CD1-CH2 3.47Å; I314-W954 VanDerWaalsContact CD1-CH2 3.47Å; I314-W954 HydrophobicContact CD1-CZ2 4.47Å; I314-W954 HydrophobicContact CD1-CZ3 3.86Å; T950-W954 PolarHBondContact O-N 2.97Å; T950-W954 VanDerWaalsContact O-N 3.09Å; K951-W954 PolarHBondContact O-N 3.34Å; V952-W954 PolarHBondContact O-N 2.93Å; W954-H956 PolarHBondContact O-N 3.26Å; W954-C957 HydrophobicContact CE3-CB 3.87Å; W954-C957 HydrophobicContact CZ3-CB 4.15Å; W954-C957 PolarHBondContact O-N 3.07Å; W954-I958 WeakPolarHBondContact O-CB 3.32Å; W954-I958 VanDerWaalsContact O-CG1 3.27Å; W954-I958 WeakPolarHBondContact O-CG1 3.34Å; W954-I958 PolarHBondContact O-N 3.08Å
955	G	92.3	Very high	89.7	Confident	40 Å²	40	47.2 Å²	47.2	41%	0.412	26%	0.256	S	S	.	.	H	α-helix	trans	-57	-46.7	169.8	0	0	0	0	0	112.8	K951 V952 F953 N959	K951-G955 PolarHBondContact O-N 3.02Å; V952-G955 WeakPolarHBondContact O-CA 3.39Å; V952-G955 PolarHBondContact O-N 2.87Å; V952-G955 VanDerWaalsContact O-N 3.1Å; F953-G955 VanDerWaalsContact C-N 3.3Å; F953-G955 PolarHBondContact O-N 3.48Å; G955-N959 WeakPolarHBondContact O-CB 3.43Å; G955-N959 PolarHBondContact O-N 2.85Å
956	H	91.8	Very high	90.3	Very high	40 Å²	40	48.1 Å²	48.1	19%	0.185	26%	0.256	C	S	.	.	H	α-helix	trans	-67.2	-35.5	175.1	-78.2	-89.8	0	0	0	112.9	V952 F953 W954 N959 A960 E1011	V952-H956 PolarHBondContact O-CD2 3.11Å; V952-H956 PolarHBondContact O-N 3.19Å; F953-H956 PolarHBondContact O-N 3.33Å; W954-H956 PolarHBondContact O-N 3.26Å; H956-N959 WeakPolarHBondContact O-CB 3.2Å; H956-N959 PolarHBondContact O-N 3.11Å; H956-A960 WeakPolarHBondContact O-CB 3.16Å; H956-A960 PolarHBondContact O-N 2.94Å; H956-E1011 IonicContact CE1-OE1 2.66Å
957	C	92.1	Very high	91.2	Very high	10 Å²	10	43.6 Å²	43.6	7%	0.068	24%	0.235	C	C	.	.	H	α-helix	trans	-69.7	-41.7	177	-62.9	0	0	0	0	112.6	F953 W954 N959 A960 L961	F953-C957 PolarHBondContact O-N 2.96Å; F953-C957 PolarHBondContact O-SG 3.41Å; W954-C957 HydrophobicContact CE3-CB 3.87Å; W954-C957 HydrophobicContact CZ3-CB 4.15Å; W954-C957 PolarHBondContact O-N 3.07Å; C957-N959 VanDerWaalsContact C-N 3.28Å; C957-N959 PolarHBondContact O-N 3.21Å; C957-A960 WeakPolarHBondContact O-CB 3.31Å; C957-A960 PolarHBondContact O-N 3.27Å; C957-L961 PolarHBondContact O-N 3.08Å
958	I	93.4	Very high	92.2	Very high	97 Å²	97	42.5 Å²	42.5	50%	0.497	22%	0.222	S	C	.	.	H	α-helix	trans	-64.6	-36.2	172.9	-67.8	164.7	0	0	0	110.2	W954 L961 I962	W954-I958 WeakPolarHBondContact O-CB 3.32Å; W954-I958 VanDerWaalsContact O-CG1 3.27Å; W954-I958 WeakPolarHBondContact O-CG1 3.34Å; W954-I958 PolarHBondContact O-N 3.08Å; I958-L961 WeakPolarHBondContact O-CB 3.44Å; I958-L961 PolarHBondContact O-N 3.24Å; I958-I962 HydrophobicContact CG2-CD1 4.18Å; I958-I962 WeakPolarHBondContact O-CG1 3.3Å; I958-I962 PolarHBondContact O-N 2.82Å
959	N	94.1	Very high	92.7	Very high	17 Å²	17	46.5 Å²	46.5	9%	0.091	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-44.5	174.2	-160.1	43.3	0	0	0	112.3	G955 H956 C957 L961 I962 H963 K1077 D1078	G955-N959 WeakPolarHBondContact O-CB 3.43Å; G955-N959 PolarHBondContact O-N 2.85Å; H956-N959 WeakPolarHBondContact O-CB 3.2Å; H956-N959 PolarHBondContact O-N 3.11Å; C957-N959 VanDerWaalsContact C-N 3.28Å; C957-N959 PolarHBondContact O-N 3.21Å; N959-L961 VanDerWaalsContact C-N 3.31Å; N959-L961 PolarHBondContact O-N 3.25Å; N959-I962 PolarHBondContact O-N 3.37Å; N959-H963 PolarHBondContact O-CD2 2.97Å; N959-H963 PolarHBondContact O-N 3.09Å; N959-H963 PolarHBondContact OD1-NE2 3.48Å; N959-K1077 WeakPolarHBondContact OD1-CE 3.36Å; N959-K1077 PolarHBondContact OD1-NZ 3.29Å; N959-D1078 PolarHBondContact ND2-OD1 3.18Å; N959-D1078 PolarHBondContact ND2-OD2 3.39Å; N959-D1078 PolarHBondContact OD1-OD1 3.22Å
960	A	94.6	Very high	93	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-39.7	174.4	0	0	0	0	0	112.3	Y876 V879 V880 H956 C957 H963 S964	Y876-A960 HydrophobicContact CD2-CB 3.72Å; Y876-A960 HydrophobicContact CE2-CB 4.2Å; Y876-A960 HydrophobicContact CG-CB 4.43Å; V879-A960 HydrophobicContact CB-CB 3.7Å; V879-A960 HydrophobicContact CG1-CB 3.48Å; V879-A960 VanDerWaalsContact CG1-CB 3.48Å; V880-A960 HydrophobicContact CG2-CB 3.67Å; H956-A960 WeakPolarHBondContact O-CB 3.16Å; H956-A960 PolarHBondContact O-N 2.94Å; C957-A960 WeakPolarHBondContact O-CB 3.31Å; C957-A960 PolarHBondContact O-N 3.27Å; A960-H963 PolarHBondContact O-N 3.46Å; A960-S964 WeakPolarHBondContact O-CB 3.37Å; A960-S964 PolarHBondContact O-N 3.35Å
961	L	94	Very high	93.2	Very high	64 Å²	64	45 Å²	45	34%	0.335	22%	0.222	S	C	.	.	H	α-helix	trans	-59.2	-50.8	173.7	-177.9	64.8	0	0	0	111.4	I883 W887 C957 I958 N959 H963 S964 I965	I883-L961 HydrophobicContact CD1-CD1 4.05Å; I883-L961 HydrophobicContact CG2-CD1 3.89Å; W887-L961 HydrophobicContact CH2-CD1 4.39Å; W887-L961 HydrophobicContact CZ2-CD1 3.66Å; C957-L961 PolarHBondContact O-N 3.08Å; I958-L961 WeakPolarHBondContact O-CB 3.44Å; I958-L961 PolarHBondContact O-N 3.24Å; N959-L961 VanDerWaalsContact C-N 3.31Å; N959-L961 PolarHBondContact O-N 3.25Å; L961-H963 VanDerWaalsContact C-N 3.3Å; L961-H963 PolarHBondContact O-N 3.33Å; L961-S964 PolarHBondContact O-N 3.05Å; L961-S964 PolarHBondContact O-OG 2.86Å; L961-I965 HydrophobicContact CG-CD1 4.47Å; L961-I965 WeakPolarHBondContact O-CG1 3.47Å; L961-I965 PolarHBondContact O-N 3.38Å; L961-I965 VanDerWaalsContact O-N 3.12Å
962	I	94.6	Very high	93.2	Very high	63 Å²	63	39.3 Å²	39.3	32%	0.323	20%	0.2	S	C	.	.	H	α-helix	trans	-58.9	-42.3	176.8	-66.4	164.7	0	0	0	111.1	I958 N959 I965 I966	I958-I962 HydrophobicContact CG2-CD1 4.18Å; I958-I962 WeakPolarHBondContact O-CG1 3.3Å; I958-I962 PolarHBondContact O-N 2.82Å; N959-I962 PolarHBondContact O-N 3.37Å; I962-I965 PolarHBondContact O-N 3.43Å; I962-I966 HydrophobicContact CG2-CD1 4.22Å; I962-I966 WeakPolarHBondContact O-CG1 3.2Å; I962-I966 PolarHBondContact O-N 3.26Å
963	H	95.6	Very high	93.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-68.2	-39.5	179.6	-71.3	-157.3	0	0	0	111.5	Y876 V880 N959 A960 L961 I965 I966 L967 C1074 D1078	Y876-H963 AromaticContact CE2-ND1 3.9Å; Y876-H963 AromaticContact CZ-ND1 3.82Å; Y876-H963 PolarHBondContact OH-ND1 3.02Å; V880-H963 HydrophobicContact CG2-CB 4.16Å; N959-H963 PolarHBondContact O-CD2 2.97Å; N959-H963 PolarHBondContact O-N 3.09Å; N959-H963 PolarHBondContact OD1-NE2 3.48Å; A960-H963 PolarHBondContact O-N 3.46Å; L961-H963 VanDerWaalsContact C-N 3.3Å; L961-H963 PolarHBondContact O-N 3.33Å; H963-I965 VanDerWaalsContact C-N 3.31Å; H963-I965 PolarHBondContact O-N 2.92Å; H963-I966 PolarHBondContact O-N 3.25Å; H963-L967 HydrophobicContact CB-CD1 4.4Å; H963-L967 VanDerWaalsContact O-CB 3.31Å; H963-L967 WeakPolarHBondContact O-CB 3.49Å; H963-L967 WeakPolarHBondContact O-CD1 3.27Å; H963-L967 VanDerWaalsContact O-CG 3.31Å; H963-L967 WeakPolarHBondContact O-CG 3.47Å; H963-L967 PolarHBondContact O-N 2.88Å; H963-C1074 PolarHBondContact NE2-O 3.09Å; H963-D1078 IonicContact CE1-OD2 2.69Å; H963-D1078 IonicContact NE2-OD1 3.91Å; H963-D1078 IonicContact NE2-OD2 3.66Å
964	S	95.7	Very high	92.9	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-37.1	175.5	75.2	0	0	0	0	113	V880 I883 W887 A960 L961 F968	V880-S964 WeakPolarHBondContact O-CB 3.3Å; I883-S964 WeakPolarHBondContact CG2-OG 3.47Å; W887-S964 PolarHBondContact NE1-OG 3.33Å; A960-S964 WeakPolarHBondContact O-CB 3.37Å; A960-S964 PolarHBondContact O-N 3.35Å; L961-S964 PolarHBondContact O-N 3.05Å; L961-S964 PolarHBondContact O-OG 2.86Å; S964-F968 WeakPolarHBondContact O-CB 3.37Å; S964-F968 PolarHBondContact O-N 3.01Å
965	I	95.1	Very high	92.5	Very high	67 Å²	67	42 Å²	42	34%	0.344	21%	0.212	S	C	.	.	H	α-helix	trans	-62.6	-50.1	176	-69.3	166.3	0	0	0	109.9	W887 L961 I962 H963 F968 W969	W887-I965 HydrophobicContact CH2-CD1 4.38Å; W887-I965 HydrophobicContact CH2-CG1 4.27Å; W887-I965 HydrophobicContact CZ2-CD1 3.78Å; W887-I965 HydrophobicContact CZ2-CG1 3.36Å; L961-I965 HydrophobicContact CG-CD1 4.47Å; L961-I965 WeakPolarHBondContact O-CG1 3.47Å; L961-I965 PolarHBondContact O-N 3.38Å; L961-I965 VanDerWaalsContact O-N 3.12Å; I962-I965 PolarHBondContact O-N 3.43Å; H963-I965 VanDerWaalsContact C-N 3.31Å; H963-I965 PolarHBondContact O-N 2.92Å; I965-F968 PolarHBondContact O-N 3.13Å; I965-W969 WeakPolarHBondContact O-CB 3.32Å; I965-W969 VanDerWaalsContact O-CD1 3.31Å; I965-W969 PolarHBondContact O-N 3.31Å
966	I	95.1	Very high	92	Very high	45 Å²	45	45.2 Å²	45.2	23%	0.231	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-45	179.5	-61.2	165.8	0	0	0	110.6	I962 H963 F968 F970 V1070 A1073 C1074	I962-I966 HydrophobicContact CG2-CD1 4.22Å; I962-I966 WeakPolarHBondContact O-CG1 3.2Å; I962-I966 PolarHBondContact O-N 3.26Å; H963-I966 PolarHBondContact O-N 3.25Å; I966-F968 VanDerWaalsContact C-N 3.3Å; I966-F968 PolarHBondContact O-N 2.86Å; I966-F970 HydrophobicContact CG2-CB 4.45Å; I966-F970 WeakPolarHBondContact O-CB 3.44Å; I966-F970 PolarHBondContact O-N 3.06Å; I966-F970 VanDerWaalsContact O-N 3.1Å; I966-V1070 HydrophobicContact CG2-CG1 4.4Å; I966-A1073 HydrophobicContact CG2-CB 4.29Å; I966-C1074 VanDerWaalsContact CG2-SG 3.54Å
967	L	95.1	Very high	91	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.9	-27.4	-177.3	-77	159.8	0	0	0	113.8	V880 I884 H963 P971 V1000 T1003 V1070	V880-L967 HydrophobicContact CG1-CD1 3.57Å; I884-L967 HydrophobicContact CD1-CB 4.01Å; H963-L967 HydrophobicContact CB-CD1 4.4Å; H963-L967 VanDerWaalsContact O-CB 3.31Å; H963-L967 WeakPolarHBondContact O-CB 3.49Å; H963-L967 WeakPolarHBondContact O-CD1 3.27Å; H963-L967 VanDerWaalsContact O-CG 3.31Å; H963-L967 WeakPolarHBondContact O-CG 3.47Å; H963-L967 PolarHBondContact O-N 2.88Å; L967-P971 VanDerWaalsContact O-CD 3.23Å; L967-P971 WeakPolarHBondContact O-CD 3.48Å; L967-P971 VanDerWaalsContact O-CG 3.28Å; L967-P971 WeakPolarHBondContact O-CG 3.48Å; L967-V1000 HydrophobicContact CB-CG2 4.27Å; L967-V1000 HydrophobicContact CD1-CG2 4.08Å; L967-V1000 HydrophobicContact CD2-CG2 4.26Å; L967-V1000 HydrophobicContact CG-CG2 4.44Å; L967-T1003 HydrophobicContact CD1-CG2 4.34Å; L967-V1070 HydrophobicContact CD2-CG1 3.81Å; L967-V1070 HydrophobicContact CG-CG1 4.48Å
968	F	95	Very high	89.6	Confident	7 Å²	7	56.9 Å²	56.9	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-90.3	-53.7	174.5	179.1	-106.5	0	0	0	113.1	I884 W887 F888 V891 L899 S964 I965 I966 P971 L972	I884-F968 HydrophobicContact CG1-CB 4.34Å; I884-F968 HydrophobicContact CG2-CB 4.03Å; I884-F968 HydrophobicContact CG2-CD2 3.67Å; I884-F968 HydrophobicContact CG2-CG 4.18Å; W887-F968 HydrophobicContact CB-CB 4.3Å; W887-F968 HydrophobicContact CB-CD1 3.4Å; W887-F968 HydrophobicContact CB-CE1 3.74Å; W887-F968 HydrophobicContact CB-CG 3.82Å; W887-F968 HydrophobicContact CB-CZ 4.42Å; W887-F968 HydrophobicContact CG-CD1 4.28Å; F888-F968 HydrophobicContact CB-CE2 3.93Å; F888-F968 HydrophobicContact CB-CZ 4.17Å; F888-F968 HydrophobicContact CD2-CE2 4.17Å; F888-F968 HydrophobicContact CD2-CZ 4.29Å; F888-F968 HydrophobicContact CG-CE2 4.49Å; V891-F968 HydrophobicContact CG2-CE1 4.02Å; V891-F968 HydrophobicContact CG2-CZ 3.96Å; L899-F968 HydrophobicContact CD2-CD2 4.09Å; L899-F968 HydrophobicContact CD2-CE2 4.09Å; S964-F968 WeakPolarHBondContact O-CB 3.37Å; S964-F968 PolarHBondContact O-N 3.01Å; I965-F968 PolarHBondContact O-N 3.13Å; I966-F968 VanDerWaalsContact C-N 3.3Å; I966-F968 PolarHBondContact O-N 2.86Å; F968-P971 WeakPolarHBondContact O-CD 3.47Å; F968-L972 HydrophobicContact CE1-CD2 3.89Å; F968-L972 HydrophobicContact CZ-CD2 3.87Å; F968-L972 WeakPolarHBondContact O-CB 3.47Å; F968-L972 PolarHBondContact O-N 2.75Å
969	W	94	Very high	88.4	Confident	96 Å²	96	54.9 Å²	54.9	36%	0.364	27%	0.269	S	S	.	.	H	α-helix	trans	-75.5	-31.3	-170.1	-70.1	103.1	0	0	0	113.3	V891 I965 L972 K973	V891-W969 HydrophobicContact CG2-CH2 3.84Å; V891-W969 HydrophobicContact CG2-CZ3 4.33Å; I965-W969 WeakPolarHBondContact O-CB 3.32Å; I965-W969 VanDerWaalsContact O-CD1 3.31Å; I965-W969 PolarHBondContact O-N 3.31Å; W969-L972 HydrophobicContact CE3-CD2 4.06Å; W969-L972 HydrophobicContact CZ3-CD2 4Å; W969-K973 WeakPolarHBondContact O-CB 3.32Å; W969-K973 WeakPolarHBondContact O-CG 3.47Å; W969-K973 PolarHBondContact O-N 2.99Å
970	F	92.6	Very high	87.2	Confident	91 Å²	91	55 Å²	55	40%	0.399	27%	0.271	S	S	.	.	H	α-helix	trans	-68	-48.4	180	-161.7	-65.2	0	0	0	111.7	I966 L972 K973 M974 V1070	I966-F970 HydrophobicContact CG2-CB 4.45Å; I966-F970 WeakPolarHBondContact O-CB 3.44Å; I966-F970 PolarHBondContact O-N 3.06Å; I966-F970 VanDerWaalsContact O-N 3.1Å; F970-L972 PolarHBondContact O-N 2.92Å; F970-K973 PolarHBondContact O-N 2.78Å; F970-M974 WeakPolarHBondContact O-CB 3.28Å; F970-M974 PolarHBondContact O-N 3.43Å; F970-V1070 HydrophobicContact CB-CG2 4.35Å; F970-V1070 HydrophobicContact CD1-CG2 3.59Å; F970-V1070 HydrophobicContact CE1-CG2 4.11Å; F970-V1070 HydrophobicContact CG-CG2 4.1Å
971	P	90	Very high	86.4	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.013	28%	0.275	C	S	.	.	H	α-helix	trans	-65.4	-37	175	-24.5	38.2	0	0	0	113.2	L967 F968 M974 L975 V996 Y999 V1070	L967-P971 VanDerWaalsContact O-CD 3.23Å; L967-P971 WeakPolarHBondContact O-CD 3.48Å; L967-P971 VanDerWaalsContact O-CG 3.28Å; L967-P971 WeakPolarHBondContact O-CG 3.48Å; F968-P971 WeakPolarHBondContact O-CD 3.47Å; P971-M974 PolarHBondContact O-N 2.99Å; P971-L975 WeakPolarHBondContact O-CG 3.39Å; P971-L975 PolarHBondContact O-N 2.91Å; P971-V996 HydrophobicContact CB-CG2 3.85Å; P971-V996 HydrophobicContact CG-CG2 4Å; P971-Y999 HydrophobicContact CB-CD2 4.36Å; P971-Y999 HydrophobicContact CB-CE2 3.96Å; P971-Y999 HydrophobicContact CG-CD2 3.57Å; P971-Y999 HydrophobicContact CG-CE2 3.59Å; P971-V1070 HydrophobicContact CG-CG2 4.33Å
972	L	89.1	Confident	85.2	Confident	62 Å²	62	59.6 Å²	59.6	33%	0.325	31%	0.306	S	S	.	.	H	α-helix	trans	-63.2	-44.6	177.6	-174.9	62.4	0	0	0	111.4	V891 F968 W969 F970 L975 E976	V891-L972 HydrophobicContact CG2-CD2 4.37Å; F968-L972 HydrophobicContact CE1-CD2 3.89Å; F968-L972 HydrophobicContact CZ-CD2 3.87Å; F968-L972 WeakPolarHBondContact O-CB 3.47Å; F968-L972 PolarHBondContact O-N 2.75Å; W969-L972 HydrophobicContact CE3-CD2 4.06Å; W969-L972 HydrophobicContact CZ3-CD2 4Å; F970-L972 PolarHBondContact O-N 2.92Å; L972-L975 CarbonylContact O-C 3.58Å; L972-L975 PolarHBondContact O-N 3.31Å; L972-E976 PolarHBondContact O-N 3.07Å
973	K	88.7	Confident	84.2	Confident	113 Å²	113	60.9 Å²	60.9	49%	0.491	31%	0.313	S	S	.	.	H	α-helix	trans	-68.4	-32	174.9	-75.8	-60.2	-162.6	177.8	0	113.6	W969 F970 L975 E976	W969-K973 WeakPolarHBondContact O-CB 3.32Å; W969-K973 WeakPolarHBondContact O-CG 3.47Å; W969-K973 PolarHBondContact O-N 2.99Å; F970-K973 PolarHBondContact O-N 2.78Å; K973-L975 PolarHBondContact O-N 3.44Å; K973-E976 WeakPolarHBondContact CD-OE2 3.45Å; K973-E976 IonicContact NZ-OE1 2.63Å; K973-E976 PolarHBondContact NZ-OE1 3.42Å; K973-E976 IonicContact NZ-OE2 2.69Å; K973-E976 PolarHBondContact NZ-OE2 3.29Å; K973-E976 WeakPolarHBondContact O-CB 3.47Å; K973-E976 PolarHBondContact O-N 3.4Å
974	M	86.3	Confident	83.1	Confident	35 Å²	35	64 Å²	64	17%	0.172	35%	0.346	C	S	.	.	H	α-helix	trans	-66	-20.3	173.1	-171.8	-179.9	68.1	0	0	113	F970 P971 M995 Y1062	F970-M974 WeakPolarHBondContact O-CB 3.28Å; F970-M974 PolarHBondContact O-N 3.43Å; P971-M974 PolarHBondContact O-N 2.99Å; M974-M995 HydrophobicContact CE-CE 3.57Å; M974-Y1062 VanDerWaalsContact CE-O 3.24Å; M974-Y1062 WeakPolarHBondContact CE-O 3.34Å; M974-Y1062 HydrophobicContact CG-CD1 4.17Å
975	L	84.1	Confident	82.2	Confident	34 Å²	34	68.8 Å²	68.8	18%	0.178	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	12.3	178	-63.7	173.7	0	0	0	113.1	P971 L972 K973 P980 F991 A992 M995	P971-L975 WeakPolarHBondContact O-CG 3.39Å; P971-L975 PolarHBondContact O-N 2.91Å; L972-L975 CarbonylContact O-C 3.58Å; L972-L975 PolarHBondContact O-N 3.31Å; K973-L975 PolarHBondContact O-N 3.44Å; L975-P980 HydrophobicContact CD2-CG 4.41Å; L975-F991 HydrophobicContact CD1-CD1 4.48Å; L975-F991 HydrophobicContact CD1-CE1 4.39Å; L975-F991 HydrophobicContact CD2-CE1 4.24Å; L975-A992 HydrophobicContact CD1-CB 4.09Å; L975-M995 HydrophobicContact CD1-CE 4.17Å; L975-M995 HydrophobicContact CD1-SD 3.99Å; L975-M995 HydrophobicContact CD2-CE 4.33Å; L975-M995 HydrophobicContact CG-CE 4.48Å
976	E	80.5	Confident	81.1	Confident	107 Å²	107	68.3 Å²	68.3	50%	0.5	38%	0.381	S	S	.	.	S	Bend	trans	-80.6	-17.5	-175.4	-171.8	171.6	-118	0	0	113.6	L972 K973	L972-E976 PolarHBondContact O-N 3.07Å; K973-E976 WeakPolarHBondContact CD-OE2 3.45Å; K973-E976 IonicContact NZ-OE1 2.63Å; K973-E976 PolarHBondContact NZ-OE1 3.42Å; K973-E976 IonicContact NZ-OE2 2.69Å; K973-E976 PolarHBondContact NZ-OE2 3.29Å; K973-E976 WeakPolarHBondContact O-CB 3.47Å; K973-E976 PolarHBondContact O-N 3.4Å
977	H	70.3	Confident	80.4	Confident	145 Å²	145	69.1 Å²	69.1	67%	0.671	39%	0.385	S	S	*	.	S	Bend	trans	-132.6	134.1	-175	-64.6	23.1	0	0	0	110.7
978	D	64	Low	79.8	Confident	149 Å²	149	71.9 Å²	71.9	80%	0.797	40%	0.4	S	S	*	.	S	Bend	trans	57.1	162.2	-176	-70.6	-35.7	0	0	0	116.7
979	S	68.3	Low	79.4	Confident	56 Å²	56	76.5 Å²	76.5	39%	0.392	42%	0.418	S	S	.	.			trans	-76.1	132.2	167.5	174.9	0	0	0	0	109.5	F981 Q985	S979-F981 PolarHBondContact O-N 3.09Å; S979-F981 VanDerWaalsContact O-N 3.17Å; S979-F981 PolarHBondContact OG-N 3.46Å; S979-Q985 PolarHBondContact OG-O 3.17Å
980	P	69.5	Low	79.1	Confident	19 Å²	19	72.7 Å²	72.7	12%	0.123	41%	0.405	C	S	.	.	S	Bend	trans	-72.4	-4.2	178.1	32	-36.9	0	0	0	113.4	L975 N987 F991 Y1062	L975-P980 HydrophobicContact CD2-CG 4.41Å; P980-N987 VanDerWaalsContact CD-ND2 3.28Å; P980-N987 WeakPolarHBondContact CD-ND2 3.44Å; P980-N987 WeakPolarHBondContact CG-ND2 3.28Å; P980-N987 VanDerWaalsContact CG-OD1 3.3Å; P980-N987 WeakPolarHBondContact CG-OD1 3.41Å; P980-F991 HydrophobicContact CG-CE1 4.39Å; P980-F991 HydrophobicContact CG-CZ 4.5Å; P980-Y1062 HydrophobicContact CB-CD2 3.5Å; P980-Y1062 VanDerWaalsContact CB-CD2 3.5Å; P980-Y1062 HydrophobicContact CB-CE2 3.65Å; P980-Y1062 HydrophobicContact CB-CG 4.42Å
981	F	76.1	Confident	78.9	Confident	18 Å²	18	68.4 Å²	68.4	8%	0.079	39%	0.386	C	S	.	.			trans	-110.3	121.6	-179.1	-60.3	-74.4	0	0	0	112.5	S979 N983 G984 Q985 N987 F991 K1056 C1060	S979-F981 PolarHBondContact O-N 3.09Å; S979-F981 VanDerWaalsContact O-N 3.17Å; S979-F981 PolarHBondContact OG-N 3.46Å; F981-N983 WeakPolarHBondContact CB-OD1 3.22Å; F981-N983 PolarHBondContact O-N 3.03Å; F981-G984 PolarHBondContact O-N 3.5Å; F981-G984 VanDerWaalsContact O-N 3.09Å; F981-Q985 HydrophobicContact CD2-CB 4.42Å; F981-N987 WeakPolarHBondContact CE2-OD1 3.22Å; F981-F991 HydrophobicContact CE2-CE2 4.01Å; F981-F991 AromaticContact CE2-CZ 3.96Å; F981-F991 HydrophobicContact CE2-CZ 3.96Å; F981-F991 AromaticContact CZ-CE2 3.59Å; F981-F991 HydrophobicContact CZ-CE2 3.59Å; F981-F991 AromaticContact CZ-CZ 3.77Å; F981-F991 HydrophobicContact CZ-CZ 3.77Å; F981-K1056 WeakPolarHBondContact CE1-O 3.34Å; F981-K1056 HydrophobicContact CZ-CB 3.99Å; F981-K1056 WeakPolarHBondContact CZ-O 3.45Å; F981-C1060 HydrophobicContact CE1-CB 4.24Å; F981-C1060 HydrophobicContact CZ-CB 4.34Å
982	S	69.1	Low	78.9	Confident	142 Å²	142	69.3 Å²	69.3	99%	0.993	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-5	173.8	54.5	0	0	0	0	114.9
983	N	73.3	Confident	79	Confident	90 Å²	90	66.4 Å²	66.4	48%	0.481	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-0.3	175.2	69.9	10.9	0	0	0	113.6	F981 Q985	F981-N983 WeakPolarHBondContact CB-OD1 3.22Å; F981-N983 PolarHBondContact O-N 3.03Å; N983-Q985 VanDerWaalsContact C-N 3.33Å; N983-Q985 VanDerWaalsContact ND2-CD 3.31Å; N983-Q985 PolarHBondContact ND2-OE1 3.11Å; N983-Q985 PolarHBondContact O-N 3.31Å; N983-Q985 VanDerWaalsContact OD1-CB 3.24Å; N983-Q985 WeakPolarHBondContact OD1-CB 3.39Å; N983-Q985 VanDerWaalsContact OD1-CG 3.26Å; N983-Q985 WeakPolarHBondContact OD1-CG 3.48Å; N983-Q985 PolarHBondContact OD1-N 2.9Å
984	G	73.6	Confident	79.2	Confident	67 Å²	67	61.3 Å²	61.3	69%	0.691	36%	0.357	S	S	*	.			trans	76.9	9.5	179.5	0	0	0	0	0	115.7	F981	F981-G984 PolarHBondContact O-N 3.5Å; F981-G984 VanDerWaalsContact O-N 3.09Å
985	Q	77	Confident	79.4	Confident	99 Å²	99	59.7 Å²	59.7	46%	0.463	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-68.9	147	172.6	-70.1	176	-5.8	0	0	111.2	S979 F981 N983	S979-Q985 PolarHBondContact OG-O 3.17Å; F981-Q985 HydrophobicContact CD2-CB 4.42Å; N983-Q985 VanDerWaalsContact C-N 3.33Å; N983-Q985 VanDerWaalsContact ND2-CD 3.31Å; N983-Q985 PolarHBondContact ND2-OE1 3.11Å; N983-Q985 PolarHBondContact O-N 3.31Å; N983-Q985 VanDerWaalsContact OD1-CB 3.24Å; N983-Q985 WeakPolarHBondContact OD1-CB 3.39Å; N983-Q985 VanDerWaalsContact OD1-CG 3.26Å; N983-Q985 WeakPolarHBondContact OD1-CG 3.48Å; N983-Q985 PolarHBondContact OD1-N 2.9Å
986	G	72.3	Confident	79.9	Confident	58 Å²	58	58.3 Å²	58.3	60%	0.598	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-91.6	155.3	176.2	0	0	0	0	0	113.1
987	N	78.8	Confident	80.6	Confident	62 Å²	62	53.3 Å²	53.3	33%	0.332	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-85.6	153.1	171.7	-57.9	-23.4	0	0	0	110.7	P980 F981 F991	P980-N987 VanDerWaalsContact CD-ND2 3.28Å; P980-N987 WeakPolarHBondContact CD-ND2 3.44Å; P980-N987 WeakPolarHBondContact CG-ND2 3.28Å; P980-N987 VanDerWaalsContact CG-OD1 3.3Å; P980-N987 WeakPolarHBondContact CG-OD1 3.41Å; F981-N987 WeakPolarHBondContact CE2-OD1 3.22Å; N987-F991 HydrophobicContact CB-CD1 3.95Å; N987-F991 HydrophobicContact CB-CE1 4.47Å
988	D	83.9	Confident	81.7	Confident	58 Å²	58	46.4 Å²	46.4	31%	0.31	29%	0.286	S	S	.	.			trans	-114.5	175.3	166.2	57.6	45.3	0	0	0	110.3	L990 F991 Q1053 K1056	D988-L990 VanDerWaalsContact C-N 3.27Å; D988-L990 PolarHBondContact O-N 3.09Å; D988-L990 WeakPolarHBondContact OD1-CA 3.42Å; D988-L990 WeakPolarHBondContact OD1-CB 3.45Å; D988-L990 PolarHBondContact OD1-N 3.36Å; D988-L990 VanDerWaalsContact OD1-N 3.1Å; D988-F991 WeakPolarHBondContact O-CB 3.42Å; D988-F991 PolarHBondContact O-N 3.5Å; D988-F991 WeakPolarHBondContact OD1-CB 3.21Å; D988-F991 PolarHBondContact OD1-N 2.95Å; D988-Q1053 PolarHBondContact OD1-NE2 2.84Å; D988-Q1053 PolarHBondContact OD2-NE2 3.29Å; D988-K1056 IonicContact OD2-NZ 2.68Å
989	Y	86.1	Confident	83.2	Confident	104 Å²	104	39.3 Å²	39.3	41%	0.408	25%	0.248	S	C	.	.	H	α-helix	trans	-68.9	-26.5	179.3	76.6	-86.2	0	0	0	112.6	F888 Q897 A992 G993	F888-Y989 HydrophobicContact CZ-CD2 4.48Å; Q897-Y989 PolarHBondContact NE2-OH 3.34Å; Y989-A992 PolarHBondContact O-N 2.94Å; Y989-G993 PolarHBondContact O-N 3.3Å
990	L	87.6	Confident	84.5	Confident	16 Å²	16	36.6 Å²	36.6	8%	0.084	23%	0.23	C	C	.	.	H	α-helix	trans	-73	-32.8	178.7	-69.7	169.2	0	0	0	111.8	D988 G993 N994 D1049	D988-L990 VanDerWaalsContact C-N 3.27Å; D988-L990 PolarHBondContact O-N 3.09Å; D988-L990 WeakPolarHBondContact OD1-CA 3.42Å; D988-L990 WeakPolarHBondContact OD1-CB 3.45Å; D988-L990 PolarHBondContact OD1-N 3.36Å; D988-L990 VanDerWaalsContact OD1-N 3.1Å; L990-G993 PolarHBondContact O-N 3.37Å; L990-N994 VanDerWaalsContact O-CB 3.29Å; L990-N994 WeakPolarHBondContact O-CB 3.32Å; L990-N994 VanDerWaalsContact O-CG 3.31Å; L990-N994 PolarHBondContact O-N 3.48Å; L990-N994 PolarHBondContact O-ND2 2.88Å; L990-D1049 HydrophobicContact CD1-CB 3.69Å
991	F	89.3	Confident	85.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.8	-51.2	170.8	177.1	-97.2	0	0	0	110.6	L975 P980 F981 N987 D988 N994 M995 K1056 V1057 C1060	L975-F991 HydrophobicContact CD1-CD1 4.48Å; L975-F991 HydrophobicContact CD1-CE1 4.39Å; L975-F991 HydrophobicContact CD2-CE1 4.24Å; P980-F991 HydrophobicContact CG-CE1 4.39Å; P980-F991 HydrophobicContact CG-CZ 4.5Å; F981-F991 HydrophobicContact CE2-CE2 4.01Å; F981-F991 AromaticContact CE2-CZ 3.96Å; F981-F991 HydrophobicContact CE2-CZ 3.96Å; F981-F991 AromaticContact CZ-CE2 3.59Å; F981-F991 HydrophobicContact CZ-CE2 3.59Å; F981-F991 AromaticContact CZ-CZ 3.77Å; F981-F991 HydrophobicContact CZ-CZ 3.77Å; N987-F991 HydrophobicContact CB-CD1 3.95Å; N987-F991 HydrophobicContact CB-CE1 4.47Å; D988-F991 WeakPolarHBondContact O-CB 3.42Å; D988-F991 PolarHBondContact O-N 3.5Å; D988-F991 WeakPolarHBondContact OD1-CB 3.21Å; D988-F991 PolarHBondContact OD1-N 2.95Å; F991-N994 PolarHBondContact O-N 2.94Å; F991-M995 HydrophobicContact CD1-SD 3.89Å; F991-M995 HydrophobicContact CE1-SD 3.43Å; F991-M995 WeakPolarHBondContact CE1-SD 3.39Å; F991-M995 HydrophobicContact CE2-SD 4.49Å; F991-M995 HydrophobicContact CZ-SD 3.78Å; F991-M995 WeakPolarHBondContact O-CG 3.39Å; F991-M995 PolarHBondContact O-N 3.04Å; F991-M995 VanDerWaalsContact O-N 3.09Å; F991-K1056 HydrophobicContact CD2-CB 4.09Å; F991-K1056 HydrophobicContact CE2-CB 4.08Å; F991-V1057 HydrophobicContact CD2-CG2 3.49Å; F991-V1057 VanDerWaalsContact CD2-CG2 3.49Å; F991-V1057 HydrophobicContact CE2-CB 4.32Å; F991-V1057 HydrophobicContact CE2-CG2 3.7Å; F991-V1057 HydrophobicContact CG-CG2 4.33Å; F991-C1060 HydrophobicContact CE2-CB 4.34Å; F991-C1060 HydrophobicContact CZ-CB 3.87Å
992	A	89.1	Confident	86.7	Confident	22 Å²	22	35.8 Å²	35.8	18%	0.182	23%	0.226	C	C	.	.	H	α-helix	trans	-62.4	-44	174.7	0	0	0	0	0	112	L975 Y989 N994 M995 V996	L975-A992 HydrophobicContact CD1-CB 4.09Å; Y989-A992 PolarHBondContact O-N 2.94Å; A992-N994 PolarHBondContact O-N 3.08Å; A992-M995 PolarHBondContact O-N 3.35Å; A992-V996 VanDerWaalsContact O-CG2 3.32Å; A992-V996 WeakPolarHBondContact O-CG2 3.25Å; A992-V996 PolarHBondContact O-N 2.85Å
993	G	91.3	Very high	88	Confident	1 Å²	1	29 Å²	29	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-59.3	-43.3	176.5	0	0	0	0	0	113.4	F900 Y989 L990 V996 Y997	F900-G993 WeakPolarHBondContact CD1-O 3.3Å; F900-G993 WeakPolarHBondContact CE1-O 3.42Å; Y989-G993 PolarHBondContact O-N 3.3Å; L990-G993 PolarHBondContact O-N 3.37Å; G993-V996 PolarHBondContact O-N 3.07Å; G993-Y997 VanDerWaalsContact O-CB 3.26Å; G993-Y997 WeakPolarHBondContact O-CB 3.45Å; G993-Y997 PolarHBondContact O-N 3.19Å
994	N	91.9	Very high	89.1	Confident	6 Å²	6	24.7 Å²	24.7	3%	0.032	16%	0.155	C	C	.	.	H	α-helix	trans	-68.7	-35.3	177.7	-78.3	-52.6	0	0	0	112.9	L990 F991 A992 T998 F1034 M1050 V1057	L990-N994 VanDerWaalsContact O-CB 3.29Å; L990-N994 WeakPolarHBondContact O-CB 3.32Å; L990-N994 VanDerWaalsContact O-CG 3.31Å; L990-N994 PolarHBondContact O-N 3.48Å; L990-N994 PolarHBondContact O-ND2 2.88Å; F991-N994 PolarHBondContact O-N 2.94Å; A992-N994 PolarHBondContact O-N 3.08Å; N994-T998 WeakPolarHBondContact O-CB 3.41Å; N994-T998 PolarHBondContact O-N 2.88Å; N994-T998 VanDerWaalsContact O-N 3.13Å; N994-T998 PolarHBondContact O-OG1 3.49Å; N994-F1034 HydrophobicContact CB-CE2 3.98Å; N994-F1034 HydrophobicContact CB-CZ 3.75Å; N994-M1050 WeakPolarHBondContact OD1-CE 3.29Å; N994-V1057 HydrophobicContact CB-CG2 4.35Å
995	M	92.1	Very high	90.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.7	-53.5	170.6	-69.8	174.1	59.7	0	0	110.8	M974 L975 F991 A992 Y997 T998 Y999 V1057 F1063	M974-M995 HydrophobicContact CE-CE 3.57Å; L975-M995 HydrophobicContact CD1-CE 4.17Å; L975-M995 HydrophobicContact CD1-SD 3.99Å; L975-M995 HydrophobicContact CD2-CE 4.33Å; L975-M995 HydrophobicContact CG-CE 4.48Å; F991-M995 HydrophobicContact CD1-SD 3.89Å; F991-M995 HydrophobicContact CE1-SD 3.43Å; F991-M995 WeakPolarHBondContact CE1-SD 3.39Å; F991-M995 HydrophobicContact CE2-SD 4.49Å; F991-M995 HydrophobicContact CZ-SD 3.78Å; F991-M995 WeakPolarHBondContact O-CG 3.39Å; F991-M995 PolarHBondContact O-N 3.04Å; F991-M995 VanDerWaalsContact O-N 3.09Å; A992-M995 PolarHBondContact O-N 3.35Å; M995-Y997 PolarHBondContact O-N 3.02Å; M995-T998 PolarHBondContact O-N 2.96Å; M995-Y999 HydrophobicContact CB-CE2 4.35Å; M995-Y999 WeakPolarHBondContact CE-OH 3.25Å; M995-Y999 WeakPolarHBondContact O-CD1 3.37Å; M995-Y999 WeakPolarHBondContact O-CD2 3.37Å; M995-Y999 VanDerWaalsContact O-CG 3.26Å; M995-Y999 PolarHBondContact O-N 3.08Å; M995-Y999 VanDerWaalsContact O-N 3.09Å; M995-V1057 HydrophobicContact CG-CG1 3.98Å; M995-V1057 HydrophobicContact CG-CG2 4.39Å; M995-F1063 HydrophobicContact CB-CD2 4.36Å; M995-F1063 HydrophobicContact CE-CB 4.17Å; M995-F1063 HydrophobicContact CG-CB 4.42Å; M995-F1063 HydrophobicContact CG-CD2 3.9Å
996	V	94.3	Very high	90.9	Very high	5 Å²	5	19.2 Å²	19.2	3%	0.03	11%	0.113	C	C	.	.	H	α-helix	trans	-57.1	-48.5	178.5	170.9	0	0	0	0	111.3	I884 L899 F900 P971 A992 G993 T998 Y999 V1000	I884-V996 HydrophobicContact CD1-CG1 4.02Å; I884-V996 HydrophobicContact CG2-CG1 4.16Å; L899-V996 HydrophobicContact CD2-CG1 4.47Å; F900-V996 HydrophobicContact CE1-CB 4.2Å; F900-V996 HydrophobicContact CE1-CG1 3.91Å; F900-V996 HydrophobicContact CZ-CG1 3.91Å; P971-V996 HydrophobicContact CB-CG2 3.85Å; P971-V996 HydrophobicContact CG-CG2 4Å; A992-V996 VanDerWaalsContact O-CG2 3.32Å; A992-V996 WeakPolarHBondContact O-CG2 3.25Å; A992-V996 PolarHBondContact O-N 2.85Å; G993-V996 PolarHBondContact O-N 3.07Å; V996-T998 VanDerWaalsContact C-N 3.32Å; V996-T998 PolarHBondContact O-N 3.37Å; V996-Y999 PolarHBondContact O-N 3.06Å; V996-Y999 VanDerWaalsContact O-N 3.15Å; V996-V1000 HydrophobicContact CG1-CG2 4.34Å; V996-V1000 WeakPolarHBondContact O-CG2 3.49Å; V996-V1000 PolarHBondContact O-N 3.49Å
997	Y	94.4	Very high	92	Very high	2 Å²	2	17 Å²	17	1%	0.008	9%	0.087	C	C	.	.	H	α-helix	trans	-58.4	-43.3	179.6	-171.7	-79.6	0	0	0	111.8	L881 F900 C904 Y908 F912 G993 M995 Y999 V1000 V1001 W1030	L881-Y997 HydrophobicContact CD1-CD2 4.17Å; L881-Y997 HydrophobicContact CD1-CE2 4.46Å; L881-Y997 HydrophobicContact CD2-CE2 4.4Å; F900-Y997 HydrophobicContact CB-CD2 4.27Å; F900-Y997 AromaticContact CD1-CD2 3.78Å; F900-Y997 HydrophobicContact CD1-CD2 3.78Å; F900-Y997 HydrophobicContact CD1-CG 4.28Å; F900-Y997 HydrophobicContact CE1-CD2 4.22Å; F900-Y997 AromaticContact CG-CD2 3.93Å; F900-Y997 HydrophobicContact CG-CD2 3.93Å; C904-Y997 HydrophobicContact CB-CE2 4Å; C904-Y997 WeakPolarHBondContact O-CE2 3.41Å; C904-Y997 PolarHBondContact O-OH 3.24Å; Y908-Y997 WeakPolarHBondContact CA-OH 3.42Å; Y908-Y997 WeakPolarHBondContact CB-OH 3.44Å; Y908-Y997 HydrophobicContact CD2-CE2 4.4Å; F912-Y997 HydrophobicContact CD2-CE1 4.43Å; F912-Y997 VanDerWaalsContact CD2-OH 3.31Å; F912-Y997 WeakPolarHBondContact CD2-OH 3.41Å; G993-Y997 VanDerWaalsContact O-CB 3.26Å; G993-Y997 WeakPolarHBondContact O-CB 3.45Å; G993-Y997 PolarHBondContact O-N 3.19Å; M995-Y997 PolarHBondContact O-N 3.02Å; Y997-Y999 VanDerWaalsContact C-N 3.35Å; Y997-Y999 PolarHBondContact O-N 3.32Å; Y997-V1000 WeakPolarHBondContact O-CB 3.22Å; Y997-V1000 PolarHBondContact O-N 3.44Å; Y997-V1001 HydrophobicContact CD1-CG2 3.87Å; Y997-V1001 HydrophobicContact CE1-CG2 3.55Å; Y997-V1001 WeakPolarHBondContact O-CG2 3.33Å; Y997-V1001 PolarHBondContact O-N 3.37Å; Y997-W1030 HydrophobicContact CD1-CD2 4.13Å; Y997-W1030 AromaticContact CD1-CE2 3.67Å; Y997-W1030 HydrophobicContact CD1-CE3 4.26Å; Y997-W1030 AromaticContact CD1-CH2 3.57Å; Y997-W1030 HydrophobicContact CD1-CH2 3.57Å; Y997-W1030 AromaticContact CD1-CZ2 3.39Å; Y997-W1030 HydrophobicContact CD1-CZ2 3.39Å; Y997-W1030 HydrophobicContact CD1-CZ3 4Å; Y997-W1030 AromaticContact CE1-CD2 3.85Å; Y997-W1030 HydrophobicContact CE1-CD2 3.85Å; Y997-W1030 AromaticContact CE1-CE2 3.89Å; Y997-W1030 AromaticContact CE1-CE3 3.64Å; Y997-W1030 HydrophobicContact CE1-CE3 3.64Å; Y997-W1030 AromaticContact CE1-CH2 3.55Å; Y997-W1030 HydrophobicContact CE1-CH2 3.55Å; Y997-W1030 AromaticContact CE1-CZ2 3.77Å; Y997-W1030 HydrophobicContact CE1-CZ2 3.77Å; Y997-W1030 AromaticContact CE1-CZ3 3.48Å; Y997-W1030 HydrophobicContact CE1-CZ3 3.48Å; Y997-W1030 VanDerWaalsContact CE1-CZ3 3.48Å; Y997-W1030 HydrophobicContact CG-CH2 4.47Å; Y997-W1030 HydrophobicContact CG-CZ2 4.37Å
998	T	94.7	Very high	92.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-62.5	-42.7	177.4	-57.7	0	0	0	0	111.4	N994 M995 V996 V1000 V1001 V1002 W1030 M1031 F1063 L1067	N994-T998 WeakPolarHBondContact O-CB 3.41Å; N994-T998 PolarHBondContact O-N 2.88Å; N994-T998 VanDerWaalsContact O-N 3.13Å; N994-T998 PolarHBondContact O-OG1 3.49Å; M995-T998 PolarHBondContact O-N 2.96Å; V996-T998 VanDerWaalsContact C-N 3.32Å; V996-T998 PolarHBondContact O-N 3.37Å; T998-V1000 VanDerWaalsContact C-N 3.34Å; T998-V1000 PolarHBondContact O-N 3.11Å; T998-V1001 PolarHBondContact O-N 3Å; T998-V1002 WeakPolarHBondContact O-CG2 3.21Å; T998-V1002 PolarHBondContact O-N 3.3Å; T998-W1030 PolarHBondContact OG1-NE1 3.49Å; T998-M1031 HydrophobicContact CG2-SD 3.81Å; T998-F1063 HydrophobicContact CG2-CE2 3.91Å; T998-F1063 HydrophobicContact CG2-CZ 3.96Å; T998-L1067 HydrophobicContact CG2-CD1 3.87Å
999	Y	95.6	Very high	93.1	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-65.7	-36.3	175.6	-53	-22.3	0	0	0	112.1	P971 M995 V996 Y997 T1003 F1063 L1067 V1070	P971-Y999 HydrophobicContact CB-CD2 4.36Å; P971-Y999 HydrophobicContact CB-CE2 3.96Å; P971-Y999 HydrophobicContact CG-CD2 3.57Å; P971-Y999 HydrophobicContact CG-CE2 3.59Å; M995-Y999 HydrophobicContact CB-CE2 4.35Å; M995-Y999 WeakPolarHBondContact CE-OH 3.25Å; M995-Y999 WeakPolarHBondContact O-CD1 3.37Å; M995-Y999 WeakPolarHBondContact O-CD2 3.37Å; M995-Y999 VanDerWaalsContact O-CG 3.26Å; M995-Y999 PolarHBondContact O-N 3.08Å; M995-Y999 VanDerWaalsContact O-N 3.09Å; V996-Y999 PolarHBondContact O-N 3.06Å; V996-Y999 VanDerWaalsContact O-N 3.15Å; Y997-Y999 VanDerWaalsContact C-N 3.35Å; Y997-Y999 PolarHBondContact O-N 3.32Å; Y999-T1003 WeakPolarHBondContact O-CB 3.44Å; Y999-T1003 PolarHBondContact O-N 3.41Å; Y999-T1003 PolarHBondContact O-OG1 3.08Å; Y999-F1063 AromaticContact CE1-CD2 3.79Å; Y999-F1063 HydrophobicContact CE1-CD2 3.79Å; Y999-F1063 AromaticContact CE1-CE2 3.91Å; Y999-F1063 HydrophobicContact CE1-CE2 3.91Å; Y999-F1063 WeakPolarHBondContact OH-CA 3.45Å; Y999-F1063 PolarHBondContact OH-O 2.89Å; Y999-L1067 HydrophobicContact CD1-CB 4.37Å; Y999-L1067 HydrophobicContact CD1-CD1 3.88Å; Y999-L1067 HydrophobicContact CE1-CB 3.97Å; Y999-L1067 HydrophobicContact CE1-CD1 4.15Å; Y999-L1067 VanDerWaalsContact CE1-N 3.28Å; Y999-V1070 HydrophobicContact CD2-CB 4.12Å; Y999-V1070 HydrophobicContact CD2-CG1 4.24Å; Y999-V1070 HydrophobicContact CD2-CG2 4.15Å; Y999-V1070 HydrophobicContact CE2-CG2 4.22Å; Y999-V1070 HydrophobicContact CG-CB 4.44Å
1000	V	95.8	Very high	93.3	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-61.1	-52	173.7	174.1	0	0	0	0	110.2	V880 L881 I884 Y908 L967 V996 Y997 T998 V1002 T1003 V1004	V880-V1000 HydrophobicContact CG1-CG1 4.01Å; L881-V1000 HydrophobicContact CB-CG1 4.28Å; L881-V1000 HydrophobicContact CD1-CB 4.35Å; L881-V1000 HydrophobicContact CD1-CG1 3.93Å; L881-V1000 HydrophobicContact CD1-CG2 4.28Å; I884-V1000 HydrophobicContact CD1-CG2 3.45Å; I884-V1000 VanDerWaalsContact CD1-CG2 3.45Å; Y908-V1000 HydrophobicContact CE2-CG1 4.27Å; L967-V1000 HydrophobicContact CB-CG2 4.27Å; L967-V1000 HydrophobicContact CD1-CG2 4.08Å; L967-V1000 HydrophobicContact CD2-CG2 4.26Å; L967-V1000 HydrophobicContact CG-CG2 4.44Å; V996-V1000 HydrophobicContact CG1-CG2 4.34Å; V996-V1000 WeakPolarHBondContact O-CG2 3.49Å; V996-V1000 PolarHBondContact O-N 3.49Å; Y997-V1000 WeakPolarHBondContact O-CB 3.22Å; Y997-V1000 PolarHBondContact O-N 3.44Å; T998-V1000 VanDerWaalsContact C-N 3.34Å; T998-V1000 PolarHBondContact O-N 3.11Å; V1000-V1002 PolarHBondContact O-N 3.29Å; V1000-T1003 PolarHBondContact O-N 3.23Å; V1000-V1004 HydrophobicContact CG1-CG2 4.13Å; V1000-V1004 WeakPolarHBondContact O-CB 3.48Å; V1000-V1004 VanDerWaalsContact O-CG2 3.25Å; V1000-V1004 WeakPolarHBondContact O-CG2 3.22Å; V1000-V1004 PolarHBondContact O-N 3.02Å
1001	V	95.3	Very high	93.4	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-57.2	-47.4	179.7	172	0	0	0	0	111.2	Y908 Y997 T998 C1005 W1030	Y908-V1001 HydrophobicContact CD2-CG2 4.27Å; Y908-V1001 HydrophobicContact CE2-CG2 4.19Å; Y997-V1001 HydrophobicContact CD1-CG2 3.87Å; Y997-V1001 HydrophobicContact CE1-CG2 3.55Å; Y997-V1001 WeakPolarHBondContact O-CG2 3.33Å; Y997-V1001 PolarHBondContact O-N 3.37Å; T998-V1001 PolarHBondContact O-N 3Å; V1001-C1005 WeakPolarHBondContact O-CB 3.36Å; V1001-C1005 PolarHBondContact O-N 3.2Å; V1001-C1005 PolarHBondContact O-SG 3.33Å; V1001-W1030 HydrophobicContact CG1-CB 4.02Å; V1001-W1030 HydrophobicContact CG1-CG 4.23Å; V1001-W1030 HydrophobicContact CG2-CG 4.42Å
1002	V	95.4	Very high	93.4	Very high	19 Å²	19	12.9 Å²	12.9	12%	0.115	7%	0.071	C	C	.	.	H	α-helix	trans	-63.4	-49.5	178.5	170.3	0	0	0	0	111.5	T998 V1000 V1004 C1005 L1006 M1027 L1067 P1071	T998-V1002 WeakPolarHBondContact O-CG2 3.21Å; T998-V1002 PolarHBondContact O-N 3.3Å; V1000-V1002 PolarHBondContact O-N 3.29Å; V1002-V1004 VanDerWaalsContact C-N 3.31Å; V1002-V1004 PolarHBondContact O-N 3.46Å; V1002-C1005 PolarHBondContact O-N 3.17Å; V1002-L1006 HydrophobicContact CG1-CD1 3.72Å; V1002-L1006 HydrophobicContact CG1-CG 4.31Å; V1002-L1006 WeakPolarHBondContact O-CB 3.34Å; V1002-L1006 VanDerWaalsContact O-CG 3.32Å; V1002-L1006 WeakPolarHBondContact O-CG 3.38Å; V1002-L1006 PolarHBondContact O-N 3.44Å; V1002-M1027 HydrophobicContact CB-SD 4.09Å; V1002-M1027 HydrophobicContact CG1-SD 3.92Å; V1002-M1027 HydrophobicContact CG2-CG 4.16Å; V1002-M1027 HydrophobicContact CG2-SD 3.94Å; V1002-L1067 HydrophobicContact CG2-CD1 3.98Å; V1002-P1071 HydrophobicContact CB-CG 4.4Å; V1002-P1071 HydrophobicContact CG1-CB 4.19Å; V1002-P1071 HydrophobicContact CG1-CG 3.88Å
1003	T	96	Very high	93.3	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-60.3	-41.1	179.9	-56	0	0	0	0	111.8	L967 Y999 V1000 K1007 P1071 C1074 L1075	L967-T1003 HydrophobicContact CD1-CG2 4.34Å; Y999-T1003 WeakPolarHBondContact O-CB 3.44Å; Y999-T1003 PolarHBondContact O-N 3.41Å; Y999-T1003 PolarHBondContact O-OG1 3.08Å; V1000-T1003 PolarHBondContact O-N 3.23Å; T1003-K1007 WeakPolarHBondContact O-CB 3.29Å; T1003-K1007 PolarHBondContact O-N 3.1Å; T1003-P1071 WeakPolarHBondContact OG1-CA 3.01Å; T1003-P1071 WeakPolarHBondContact OG1-CB 3.5Å; T1003-C1074 HydrophobicContact CG2-CB 3.72Å; T1003-L1075 HydrophobicContact CG2-CD2 4.12Å; T1003-L1075 HydrophobicContact CG2-CG 4.17Å
1004	V	95.8	Very high	93.1	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-68.5	-44.4	178.9	163.2	0	0	0	0	111.4	Y873 Y876 K877 V880 T913 V1000 V1002 K1007 A1008	Y873-V1004 HydrophobicContact CE2-CG1 4.41Å; Y873-V1004 WeakPolarHBondContact OH-CG1 3.45Å; Y873-V1004 PolarHBondContact OH-O 3.27Å; Y873-V1004 VanDerWaalsContact OH-O 3.05Å; Y876-V1004 HydrophobicContact CE1-CG2 4.31Å; K877-V1004 HydrophobicContact CB-CG1 3.68Å; K877-V1004 HydrophobicContact CB-CG2 4.43Å; V880-V1004 HydrophobicContact CG1-CG2 4.32Å; T913-V1004 HydrophobicContact CG2-CG1 4.03Å; V1000-V1004 HydrophobicContact CG1-CG2 4.13Å; V1000-V1004 WeakPolarHBondContact O-CB 3.48Å; V1000-V1004 VanDerWaalsContact O-CG2 3.25Å; V1000-V1004 WeakPolarHBondContact O-CG2 3.22Å; V1000-V1004 PolarHBondContact O-N 3.02Å; V1002-V1004 VanDerWaalsContact C-N 3.31Å; V1002-V1004 PolarHBondContact O-N 3.46Å; V1004-K1007 WeakPolarHBondContact O-CB 3.43Å; V1004-K1007 PolarHBondContact O-N 3.45Å; V1004-A1008 PolarHBondContact O-N 3.32Å
1005	C	95.1	Very high	93	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-67.1	-43.3	177.7	-64.6	0	0	0	0	112.2	V1001 V1002 K1007 A1008 G1009 V1023 S1026 M1027	V1001-C1005 WeakPolarHBondContact O-CB 3.36Å; V1001-C1005 PolarHBondContact O-N 3.2Å; V1001-C1005 PolarHBondContact O-SG 3.33Å; V1002-C1005 PolarHBondContact O-N 3.17Å; C1005-K1007 VanDerWaalsContact C-N 3.31Å; C1005-K1007 PolarHBondContact O-N 2.84Å; C1005-A1008 WeakPolarHBondContact O-CB 3.32Å; C1005-A1008 PolarHBondContact O-N 3.07Å; C1005-G1009 PolarHBondContact O-N 3.15Å; C1005-V1023 HydrophobicContact CB-CG1 4.47Å; C1005-V1023 WeakPolarHBondContact O-CG1 3.39Å; C1005-S1026 VanDerWaalsContact SG-CB 3.6Å; C1005-M1027 HydrophobicContact CB-CE 3.81Å; C1005-M1027 HydrophobicContact CB-CG 3.75Å; C1005-M1027 HydrophobicContact CB-SD 4.03Å
1006	L	94.6	Very high	92.8	Very high	51 Å²	51	22 Å²	22	27%	0.267	11%	0.114	S	C	.	.	H	α-helix	trans	-62.2	-38.4	173.5	-70.2	174.7	0	0	0	111.7	V1002 A1008 G1009 M1010 W1024 M1027 P1071 L1075	V1002-L1006 HydrophobicContact CG1-CD1 3.72Å; V1002-L1006 HydrophobicContact CG1-CG 4.31Å; V1002-L1006 WeakPolarHBondContact O-CB 3.34Å; V1002-L1006 VanDerWaalsContact O-CG 3.32Å; V1002-L1006 WeakPolarHBondContact O-CG 3.38Å; V1002-L1006 PolarHBondContact O-N 3.44Å; L1006-A1008 VanDerWaalsContact C-N 3.34Å; L1006-A1008 PolarHBondContact O-N 3.1Å; L1006-G1009 WeakPolarHBondContact O-CA 3.49Å; L1006-G1009 PolarHBondContact O-N 3.24Å; L1006-G1009 VanDerWaalsContact O-N 3.09Å; L1006-M1010 PolarHBondContact O-N 3.49Å; L1006-M1010 VanDerWaalsContact O-N 3.07Å; L1006-W1024 HydrophobicContact CD2-CH2 3.83Å; L1006-W1024 HydrophobicContact CD2-CZ3 3.87Å; L1006-M1027 HydrophobicContact CD2-CE 4.04Å; L1006-M1027 HydrophobicContact CG-CE 4.24Å; L1006-M1027 HydrophobicContact CG-SD 4.34Å; L1006-P1071 HydrophobicContact CD1-CB 4.34Å; L1006-L1075 HydrophobicContact CB-CD1 3.52Å; L1006-L1075 HydrophobicContact CD1-CD1 4.12Å; L1006-L1075 HydrophobicContact CG-CD1 4.49Å
1007	K	94.7	Very high	92.7	Very high	12 Å²	12	32.7 Å²	32.7	5%	0.052	15%	0.154	C	C	.	.	H	α-helix	trans	-60.9	-39.5	173.7	-179.6	61.6	-174.6	173.7	0	112.5	Y876 T1003 V1004 C1005 G1009 M1010 E1011 L1075 D1078	Y876-K1007 HydrophobicContact CD1-CG 4.38Å; Y876-K1007 HydrophobicContact CE1-CB 4.14Å; Y876-K1007 HydrophobicContact CE1-CG 3.64Å; T1003-K1007 WeakPolarHBondContact O-CB 3.29Å; T1003-K1007 PolarHBondContact O-N 3.1Å; V1004-K1007 WeakPolarHBondContact O-CB 3.43Å; V1004-K1007 PolarHBondContact O-N 3.45Å; C1005-K1007 VanDerWaalsContact C-N 3.31Å; C1005-K1007 PolarHBondContact O-N 2.84Å; K1007-G1009 VanDerWaalsContact C-N 3.29Å; K1007-G1009 PolarHBondContact O-N 3.3Å; K1007-M1010 PolarHBondContact O-N 3.15Å; K1007-M1010 VanDerWaalsContact O-N 3.15Å; K1007-E1011 HydrophobicContact CD-CG 4.41Å; K1007-E1011 WeakPolarHBondContact CE-OE1 3.39Å; K1007-E1011 IonicContact NZ-OE1 3.65Å; K1007-E1011 PolarHBondContact NZ-OE1 3.48Å; K1007-E1011 WeakPolarHBondContact O-CG 3.47Å; K1007-E1011 PolarHBondContact O-N 3.09Å; K1007-E1011 VanDerWaalsContact O-N 3.1Å; K1007-L1075 HydrophobicContact CB-CD2 3.92Å; K1007-L1075 HydrophobicContact CD-CD2 4.11Å; K1007-D1078 VanDerWaalsContact CE-OD2 3.29Å; K1007-D1078 WeakPolarHBondContact CE-OD2 3.34Å; K1007-D1078 IonicContact NZ-OD2 3.76Å; K1007-D1078 PolarHBondContact NZ-OD2 3.1Å
1008	A	93.3	Very high	92.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.3	-39.4	172.9	0	0	0	0	0	112.1	Y873 P916 L920 V1004 C1005 L1006 M1010 E1011 T1012 V1023	Y873-A1008 HydrophobicContact CD2-CB 4.4Å; Y873-A1008 HydrophobicContact CE1-CB 4.42Å; Y873-A1008 HydrophobicContact CE2-CB 3.66Å; P916-A1008 HydrophobicContact CB-CB 3.63Å; L920-A1008 HydrophobicContact CD1-CB 4.45Å; V1004-A1008 PolarHBondContact O-N 3.32Å; C1005-A1008 WeakPolarHBondContact O-CB 3.32Å; C1005-A1008 PolarHBondContact O-N 3.07Å; L1006-A1008 VanDerWaalsContact C-N 3.34Å; L1006-A1008 PolarHBondContact O-N 3.1Å; A1008-M1010 VanDerWaalsContact C-N 3.28Å; A1008-M1010 PolarHBondContact O-N 2.99Å; A1008-E1011 PolarHBondContact O-N 2.69Å; A1008-T1012 WeakPolarHBondContact O-CB 3.47Å; A1008-T1012 PolarHBondContact O-N 3.43Å; A1008-T1012 PolarHBondContact O-OG1 3Å; A1008-V1023 HydrophobicContact CB-CG2 4.45Å
1009	G	92.2	Very high	92.4	Very high	6 Å²	6	37.9 Å²	37.9	6%	0.062	18%	0.177	C	C	.	.	H	α-helix	trans	-61	-33.5	173.3	0	0	0	0	0	113.6	C1005 L1006 K1007 W1015	C1005-G1009 PolarHBondContact O-N 3.15Å; L1006-G1009 WeakPolarHBondContact O-CA 3.49Å; L1006-G1009 PolarHBondContact O-N 3.24Å; L1006-G1009 VanDerWaalsContact O-N 3.09Å; K1007-G1009 VanDerWaalsContact C-N 3.29Å; K1007-G1009 PolarHBondContact O-N 3.3Å; G1009-W1015 VanDerWaalsContact O-CZ2 3.27Å; G1009-W1015 WeakPolarHBondContact O-CZ2 3.34Å; G1009-W1015 PolarHBondContact O-NE1 2.87Å
1010	M	90.8	Very high	92.3	Very high	74 Å²	74	41.8 Å²	41.8	37%	0.365	20%	0.195	S	C	.	.	H	α-helix	trans	-76	-31.7	175.7	-65.5	174	68.9	0	0	113.9	L1006 K1007 A1008 L1075 D1078 F1079	L1006-M1010 PolarHBondContact O-N 3.49Å; L1006-M1010 VanDerWaalsContact O-N 3.07Å; K1007-M1010 PolarHBondContact O-N 3.15Å; K1007-M1010 VanDerWaalsContact O-N 3.15Å; A1008-M1010 VanDerWaalsContact C-N 3.28Å; A1008-M1010 PolarHBondContact O-N 2.99Å; M1010-L1075 HydrophobicContact SD-CB 4Å; M1010-L1075 HydrophobicContact SD-CD1 4.23Å; M1010-L1075 HydrophobicContact SD-CD2 3.93Å; M1010-L1075 HydrophobicContact SD-CG 4.26Å; M1010-D1078 HydrophobicContact CE-CB 3.99Å; M1010-F1079 HydrophobicContact CE-CB 3.82Å; M1010-F1079 HydrophobicContact CE-CD2 4.5Å
1011	E	89.9	Confident	92.2	Very high	59 Å²	59	47.2 Å²	47.2	28%	0.276	22%	0.224	S	C	.	.	H	α-helix	trans	-84.1	-15.4	177.8	-63.5	-68.9	175.1	0	0	112.9	K869 H956 K1007 A1008 T1013	K869-E1011 PolarHBondContact NZ-O 3.47Å; H956-E1011 IonicContact CE1-OE1 2.66Å; K1007-E1011 HydrophobicContact CD-CG 4.41Å; K1007-E1011 WeakPolarHBondContact CE-OE1 3.39Å; K1007-E1011 IonicContact NZ-OE1 3.65Å; K1007-E1011 PolarHBondContact NZ-OE1 3.48Å; K1007-E1011 WeakPolarHBondContact O-CG 3.47Å; K1007-E1011 PolarHBondContact O-N 3.09Å; K1007-E1011 VanDerWaalsContact O-N 3.1Å; A1008-E1011 PolarHBondContact O-N 2.69Å; E1011-T1013 PolarHBondContact O-N 2.67Å
1012	T	90.3	Very high	92.1	Very high	14 Å²	14	47.4 Å²	47.4	9%	0.086	23%	0.225	C	C	.	.			trans	-68.9	124.6	175.8	-64.9	0	0	0	0	110.4	L920 A1008 A1014	L920-T1012 WeakPolarHBondContact CD2-OG1 3.49Å; A1008-T1012 WeakPolarHBondContact O-CB 3.47Å; A1008-T1012 PolarHBondContact O-N 3.43Å; A1008-T1012 PolarHBondContact O-OG1 3Å; T1012-A1014 WeakPolarHBondContact CG2-O 3.43Å
1013	T	87.1	Confident	92	Very high	51 Å²	51	46.5 Å²	46.5	31%	0.313	22%	0.22	S	C	.	.	S	Bend	trans	-84.5	-35.4	174.6	19.9	0	0	0	0	112.7	K869 D924 E1011	K869-T1013 PolarHBondContact NZ-OG1 3.32Å; D924-T1013 WeakPolarHBondContact OD1-CA 3.22Å; D924-T1013 WeakPolarHBondContact OD1-CB 3.42Å; D924-T1013 PolarHBondContact OD1-N 3.39Å; D924-T1013 PolarHBondContact OD1-OG1 3.37Å; D924-T1013 PolarHBondContact OD2-OG1 2.76Å; E1011-T1013 PolarHBondContact O-N 2.67Å
1014	A	85.1	Confident	92	Very high	24 Å²	24	53 Å²	53	20%	0.198	24%	0.244	C	C	.	.	S	Bend	trans	-115.8	109.5	177.1	0	0	0	0	0	112.2	D924 R925 T1012 T1016 S1019	D924-A1014 PolarHBondContact OD1-N 2.89Å; R925-A1014 HydrophobicContact CB-CB 4.06Å; T1012-A1014 WeakPolarHBondContact CG2-O 3.43Å; A1014-T1016 PolarHBondContact O-N 3.36Å; A1014-T1016 VanDerWaalsContact O-N 3.12Å; A1014-S1019 PolarHBondContact O-OG 3.36Å
1015	W	90	Very high	92	Very high	113 Å²	113	54 Å²	54	43%	0.428	26%	0.255	S	S	.	.			trans	-74.8	99.8	172.6	-81.3	93.4	0	0	0	110.7	G1009 H1020 V1023	G1009-W1015 VanDerWaalsContact O-CZ2 3.27Å; G1009-W1015 WeakPolarHBondContact O-CZ2 3.34Å; G1009-W1015 PolarHBondContact O-NE1 2.87Å; W1015-H1020 AromaticContact CD2-CE1 3.92Å; W1015-H1020 AromaticContact CE3-CE1 3.24Å; W1015-H1020 AromaticContact CE3-CG 3.91Å; W1015-H1020 AromaticContact CE3-ND1 3.22Å; W1015-H1020 AromaticContact CE3-NE2 3.91Å; W1015-H1020 AromaticContact CZ3-CE1 3.79Å; W1015-H1020 AromaticContact CZ3-ND1 3.37Å; W1015-H1020 WeakPolarHBondContact CZ3-ND1 3.5Å; W1015-V1023 HydrophobicContact CH2-CB 4.38Å; W1015-V1023 HydrophobicContact CH2-CG1 4.25Å; W1015-V1023 HydrophobicContact CH2-CG2 4.24Å; W1015-V1023 HydrophobicContact CZ3-CB 4.34Å; W1015-V1023 HydrophobicContact CZ3-CG2 4.29Å
1016	T	89.6	Confident	91.9	Very high	33 Å²	33	54 Å²	54	20%	0.202	26%	0.255	C	S	.	.			trans	-100.2	167.9	175.8	73.5	0	0	0	0	111.2	A1014 F1018 S1019 H1020	A1014-T1016 PolarHBondContact O-N 3.36Å; A1014-T1016 VanDerWaalsContact O-N 3.12Å; T1016-F1018 PolarHBondContact O-N 3.3Å; T1016-F1018 PolarHBondContact OG1-N 3.09Å; T1016-S1019 PolarHBondContact N-OG 3.25Å; T1016-S1019 WeakPolarHBondContact O-CB 3.36Å; T1016-S1019 PolarHBondContact O-N 2.83Å; T1016-S1019 PolarHBondContact OG1-N 2.92Å; T1016-S1019 PolarHBondContact OG1-OG 2.65Å; T1016-H1020 PolarHBondContact O-CD2 3.41Å; T1016-H1020 VanDerWaalsContact O-CD2 3.27Å; T1016-H1020 PolarHBondContact O-N 3.44Å
1017	R	92.1	Very high	91.9	Very high	228 Å²	228	52.6 Å²	52.6	86%	0.86	25%	0.247	S	C	*	.	H	α-helix	trans	-54.2	-36.2	170.3	-64.5	-178.4	-177	170.2	1.2	112.1	L1021	R1017-L1021 WeakPolarHBondContact O-CB 3.49Å; R1017-L1021 PolarHBondContact O-N 2.71Å
1018	F	91.8	Very high	91.9	Very high	111 Å²	111	54.7 Å²	54.7	49%	0.487	27%	0.267	S	S	.	.	H	α-helix	trans	-71.2	-41.2	175	-58.1	-66.7	0	0	0	112.1	T919 F923 T1016 H1020 L1021 A1022	T919-F1018 HydrophobicContact CG2-CB 4.25Å; T919-F1018 WeakPolarHBondContact CG2-O 3.42Å; F923-F1018 AromaticContact CD1-CD2 3.91Å; F923-F1018 HydrophobicContact CD1-CD2 3.91Å; F923-F1018 HydrophobicContact CD1-CE2 4.4Å; F923-F1018 HydrophobicContact CD2-CB 3.69Å; F923-F1018 HydrophobicContact CD2-CD2 4.13Å; F923-F1018 HydrophobicContact CD2-CG 4.04Å; F923-F1018 AromaticContact CE1-CD2 3.82Å; F923-F1018 HydrophobicContact CE1-CD2 3.82Å; F923-F1018 AromaticContact CE1-CE2 3.98Å; F923-F1018 HydrophobicContact CE1-CE2 3.98Å; F923-F1018 HydrophobicContact CE1-CG 4.44Å; F923-F1018 HydrophobicContact CE2-CB 3.89Å; F923-F1018 HydrophobicContact CE2-CD1 4.38Å; F923-F1018 HydrophobicContact CE2-CD2 4.05Å; F923-F1018 AromaticContact CE2-CG 3.85Å; F923-F1018 HydrophobicContact CE2-CG 3.85Å; F923-F1018 HydrophobicContact CG-CB 4.23Å; F923-F1018 HydrophobicContact CG-CD2 4.07Å; F923-F1018 HydrophobicContact CG-CG 4.43Å; F923-F1018 HydrophobicContact CZ-CD1 4.47Å; F923-F1018 AromaticContact CZ-CD2 3.89Å; F923-F1018 HydrophobicContact CZ-CD2 3.89Å; F923-F1018 HydrophobicContact CZ-CE2 4.16Å; F923-F1018 HydrophobicContact CZ-CG 4.06Å; T1016-F1018 PolarHBondContact O-N 3.3Å; T1016-F1018 PolarHBondContact OG1-N 3.09Å; F1018-H1020 VanDerWaalsContact C-N 3.33Å; F1018-H1020 PolarHBondContact O-N 3.13Å; F1018-L1021 PolarHBondContact O-N 3.46Å; F1018-A1022 PolarHBondContact O-N 3.41Å
1019	S	90.4	Very high	92	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.007	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-43.8	175.6	-40.4	0	0	0	0	111.3	A1014 T1016 A1022 V1023	A1014-S1019 PolarHBondContact O-OG 3.36Å; T1016-S1019 PolarHBondContact N-OG 3.25Å; T1016-S1019 WeakPolarHBondContact O-CB 3.36Å; T1016-S1019 PolarHBondContact O-N 2.83Å; T1016-S1019 PolarHBondContact OG1-N 2.92Å; T1016-S1019 PolarHBondContact OG1-OG 2.65Å; S1019-A1022 PolarHBondContact O-N 2.94Å; S1019-V1023 WeakPolarHBondContact O-CG2 3.37Å; S1019-V1023 PolarHBondContact O-N 3.45Å
1020	H	92.8	Very high	92.1	Very high	82 Å²	82	58 Å²	58	38%	0.38	28%	0.283	S	S	.	.	H	α-helix	trans	-63	-45.9	173.1	-72.3	-57.8	0	0	0	112.7	W1015 T1016 F1018 A1022 V1023 W1024	W1015-H1020 AromaticContact CD2-CE1 3.92Å; W1015-H1020 AromaticContact CE3-CE1 3.24Å; W1015-H1020 AromaticContact CE3-CG 3.91Å; W1015-H1020 AromaticContact CE3-ND1 3.22Å; W1015-H1020 AromaticContact CE3-NE2 3.91Å; W1015-H1020 AromaticContact CZ3-CE1 3.79Å; W1015-H1020 AromaticContact CZ3-ND1 3.37Å; W1015-H1020 WeakPolarHBondContact CZ3-ND1 3.5Å; T1016-H1020 PolarHBondContact O-CD2 3.41Å; T1016-H1020 VanDerWaalsContact O-CD2 3.27Å; T1016-H1020 PolarHBondContact O-N 3.44Å; F1018-H1020 VanDerWaalsContact C-N 3.33Å; F1018-H1020 PolarHBondContact O-N 3.13Å; H1020-A1022 VanDerWaalsContact C-N 3.32Å; H1020-A1022 PolarHBondContact O-N 2.83Å; H1020-V1023 PolarHBondContact O-N 2.89Å; H1020-W1024 AromaticContact ND1-CD1 3.97Å; H1020-W1024 AromaticContact ND1-NE1 3.54Å; H1020-W1024 WeakPolarHBondContact O-CB 3.23Å; H1020-W1024 VanDerWaalsContact O-CD1 3.3Å; H1020-W1024 PolarHBondContact O-N 3.34Å
1021	L	93.9	Very high	92.1	Very high	114 Å²	114	56.6 Å²	56.6	60%	0.597	28%	0.275	S	S	*	.	H	α-helix	trans	-61.2	-39.4	177.9	179.6	61.6	0	0	0	111.9	R1017 F1018 G1025	R1017-L1021 WeakPolarHBondContact O-CB 3.49Å; R1017-L1021 PolarHBondContact O-N 2.71Å; F1018-L1021 PolarHBondContact O-N 3.46Å; L1021-G1025 WeakPolarHBondContact O-CA 3.42Å; L1021-G1025 PolarHBondContact O-N 3.12Å
1022	A	93.6	Very high	92.3	Very high	3 Å²	3	58.2 Å²	58.2	3%	0.025	29%	0.289	C	S	.	.	H	α-helix	trans	-68.9	-50.7	176.8	0	0	0	0	0	112.3	L915 T919 F1018 S1019 H1020 S1026	L915-A1022 HydrophobicContact CB-CB 3.69Å; T919-A1022 HydrophobicContact CG2-CB 3.44Å; T919-A1022 VanDerWaalsContact CG2-CB 3.44Å; F1018-A1022 PolarHBondContact O-N 3.41Å; S1019-A1022 PolarHBondContact O-N 2.94Å; H1020-A1022 VanDerWaalsContact C-N 3.32Å; H1020-A1022 PolarHBondContact O-N 2.83Å; A1022-S1026 WeakPolarHBondContact O-CB 3.44Å; A1022-S1026 PolarHBondContact O-N 2.74Å; A1022-S1026 PolarHBondContact O-OG 2.88Å
1023	V	94.1	Very high	92.3	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-66.6	-54.1	-176.5	171.8	0	0	0	0	111.5	C1005 A1008 W1015 S1019 H1020 M1027	C1005-V1023 HydrophobicContact CB-CG1 4.47Å; C1005-V1023 WeakPolarHBondContact O-CG1 3.39Å; A1008-V1023 HydrophobicContact CB-CG2 4.45Å; W1015-V1023 HydrophobicContact CH2-CB 4.38Å; W1015-V1023 HydrophobicContact CH2-CG1 4.25Å; W1015-V1023 HydrophobicContact CH2-CG2 4.24Å; W1015-V1023 HydrophobicContact CZ3-CB 4.34Å; W1015-V1023 HydrophobicContact CZ3-CG2 4.29Å; S1019-V1023 WeakPolarHBondContact O-CG2 3.37Å; S1019-V1023 PolarHBondContact O-N 3.45Å; H1020-V1023 PolarHBondContact O-N 2.89Å; V1023-M1027 HydrophobicContact CG1-CE 3.6Å; V1023-M1027 WeakPolarHBondContact O-CE 3.44Å
1024	W	95.4	Very high	92.5	Very high	135 Å²	135	57.2 Å²	57.2	51%	0.511	28%	0.279	S	S	.	.	H	α-helix	trans	-77.5	-36.9	-176.7	-55.5	124.7	0	0	0	112.2	L1006 H1020 M1027 A1028	L1006-W1024 HydrophobicContact CD2-CH2 3.83Å; L1006-W1024 HydrophobicContact CD2-CZ3 3.87Å; H1020-W1024 AromaticContact ND1-CD1 3.97Å; H1020-W1024 AromaticContact ND1-NE1 3.54Å; H1020-W1024 WeakPolarHBondContact O-CB 3.23Å; H1020-W1024 VanDerWaalsContact O-CD1 3.3Å; H1020-W1024 PolarHBondContact O-N 3.34Å; W1024-M1027 HydrophobicContact CD2-CE 4.32Å; W1024-M1027 HydrophobicContact CE3-CE 3.38Å; W1024-M1027 HydrophobicContact CZ3-CE 3.55Å; W1024-M1027 PolarHBondContact O-N 3.14Å; W1024-A1028 WeakPolarHBondContact O-CB 3.32Å; W1024-A1028 PolarHBondContact O-N 3.12Å
1025	G	94.6	Very high	92.8	Very high	22 Å²	22	58 Å²	58	23%	0.227	29%	0.286	C	S	.	.	H	α-helix	trans	-66.3	-38.4	177.1	0	0	0	0	0	112.9	L1021 M1027 A1028 L1029	L1021-G1025 WeakPolarHBondContact O-CA 3.42Å; L1021-G1025 PolarHBondContact O-N 3.12Å; G1025-M1027 PolarHBondContact O-N 3.1Å; G1025-A1028 PolarHBondContact O-N 3.39Å; G1025-L1029 WeakPolarHBondContact O-CB 3.46Å; G1025-L1029 PolarHBondContact O-N 3.19Å
1026	S	94.8	Very high	92.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.9	-43.8	172.7	-89.4	0	0	0	0	112.7	F912 C1005 A1022 W1030	F912-S1026 WeakPolarHBondContact O-CB 3.19Å; F912-S1026 PolarHBondContact O-OG 2.74Å; C1005-S1026 VanDerWaalsContact SG-CB 3.6Å; A1022-S1026 WeakPolarHBondContact O-CB 3.44Å; A1022-S1026 PolarHBondContact O-N 2.74Å; A1022-S1026 PolarHBondContact O-OG 2.88Å; S1026-W1030 PolarHBondContact O-N 3.46Å; S1026-W1030 VanDerWaalsContact O-N 3.1Å
1027	M	94.3	Very high	92.7	Very high	22 Å²	22	55 Å²	55	11%	0.108	28%	0.279	C	S	.	.	H	α-helix	trans	-68.3	-44.2	178.5	-71.2	-176.4	-89.9	0	0	111.9	V1002 C1005 L1006 V1023 W1024 G1025 W1030 M1031	V1002-M1027 HydrophobicContact CB-SD 4.09Å; V1002-M1027 HydrophobicContact CG1-SD 3.92Å; V1002-M1027 HydrophobicContact CG2-CG 4.16Å; V1002-M1027 HydrophobicContact CG2-SD 3.94Å; C1005-M1027 HydrophobicContact CB-CE 3.81Å; C1005-M1027 HydrophobicContact CB-CG 3.75Å; C1005-M1027 HydrophobicContact CB-SD 4.03Å; L1006-M1027 HydrophobicContact CD2-CE 4.04Å; L1006-M1027 HydrophobicContact CG-CE 4.24Å; L1006-M1027 HydrophobicContact CG-SD 4.34Å; V1023-M1027 HydrophobicContact CG1-CE 3.6Å; V1023-M1027 WeakPolarHBondContact O-CE 3.44Å; W1024-M1027 HydrophobicContact CD2-CE 4.32Å; W1024-M1027 HydrophobicContact CE3-CE 3.38Å; W1024-M1027 HydrophobicContact CZ3-CE 3.55Å; W1024-M1027 PolarHBondContact O-N 3.14Å; G1025-M1027 PolarHBondContact O-N 3.1Å; M1027-W1030 PolarHBondContact O-N 3.43Å; M1027-M1031 WeakPolarHBondContact O-CG 3.33Å; M1027-M1031 PolarHBondContact O-N 3.32Å
1028	A	94.7	Very high	92.4	Very high	56 Å²	56	44.3 Å²	44.3	46%	0.463	24%	0.239	S	C	.	.	H	α-helix	trans	-63.6	-41.3	175.6	0	0	0	0	0	112.3	W1024 G1025 W1030 M1031 V1032	W1024-A1028 WeakPolarHBondContact O-CB 3.32Å; W1024-A1028 PolarHBondContact O-N 3.12Å; G1025-A1028 PolarHBondContact O-N 3.39Å; A1028-W1030 PolarHBondContact O-N 2.87Å; A1028-M1031 PolarHBondContact O-N 3.04Å; A1028-V1032 WeakPolarHBondContact O-CG2 3.38Å; A1028-V1032 PolarHBondContact O-N 3.38Å
1029	L	94.3	Very high	92.2	Very high	75 Å²	75	44 Å²	44	39%	0.393	25%	0.246	S	C	.	.	H	α-helix	trans	-63.1	-40	178.8	-179.6	59.8	0	0	0	112.1	I911 F912 G1025 F1033	I911-L1029 HydrophobicContact CG2-CD2 3.59Å; I911-L1029 HydrophobicContact CG2-CG 4.25Å; F912-L1029 HydrophobicContact CD1-CG 4.43Å; G1025-L1029 WeakPolarHBondContact O-CB 3.46Å; G1025-L1029 PolarHBondContact O-N 3.19Å; L1029-F1033 WeakPolarHBondContact O-CB 3.21Å; L1029-F1033 PolarHBondContact O-N 3.01Å
1030	W	94.1	Very high	91.9	Very high	1 Å²	1	47.1 Å²	47.1	0%	0.004	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-49.3	171.8	168.4	-112	0	0	0	111.9	F912 Y997 T998 V1001 S1026 M1027 A1028 V1032 F1033 F1034	F912-W1030 HydrophobicContact CD1-CB 4.34Å; F912-W1030 HydrophobicContact CD1-CE3 4.22Å; F912-W1030 AromaticContact CD2-CE3 3.81Å; F912-W1030 HydrophobicContact CD2-CE3 3.81Å; F912-W1030 HydrophobicContact CD2-CZ3 4.25Å; F912-W1030 HydrophobicContact CE1-CE3 4.12Å; F912-W1030 AromaticContact CE2-CE3 3.68Å; F912-W1030 HydrophobicContact CE2-CE3 3.68Å; F912-W1030 AromaticContact CE2-CZ3 3.79Å; F912-W1030 HydrophobicContact CE2-CZ3 3.79Å; F912-W1030 HydrophobicContact CG-CE3 4.09Å; F912-W1030 AromaticContact CZ-CE3 3.87Å; F912-W1030 HydrophobicContact CZ-CE3 3.87Å; F912-W1030 HydrophobicContact CZ-CZ3 4.1Å; Y997-W1030 HydrophobicContact CD1-CD2 4.13Å; Y997-W1030 AromaticContact CD1-CE2 3.67Å; Y997-W1030 HydrophobicContact CD1-CE3 4.26Å; Y997-W1030 AromaticContact CD1-CH2 3.57Å; Y997-W1030 HydrophobicContact CD1-CH2 3.57Å; Y997-W1030 AromaticContact CD1-CZ2 3.39Å; Y997-W1030 HydrophobicContact CD1-CZ2 3.39Å; Y997-W1030 HydrophobicContact CD1-CZ3 4Å; Y997-W1030 AromaticContact CE1-CD2 3.85Å; Y997-W1030 HydrophobicContact CE1-CD2 3.85Å; Y997-W1030 AromaticContact CE1-CE2 3.89Å; Y997-W1030 AromaticContact CE1-CE3 3.64Å; Y997-W1030 HydrophobicContact CE1-CE3 3.64Å; Y997-W1030 AromaticContact CE1-CH2 3.55Å; Y997-W1030 HydrophobicContact CE1-CH2 3.55Å; Y997-W1030 AromaticContact CE1-CZ2 3.77Å; Y997-W1030 HydrophobicContact CE1-CZ2 3.77Å; Y997-W1030 AromaticContact CE1-CZ3 3.48Å; Y997-W1030 HydrophobicContact CE1-CZ3 3.48Å; Y997-W1030 VanDerWaalsContact CE1-CZ3 3.48Å; Y997-W1030 HydrophobicContact CG-CH2 4.47Å; Y997-W1030 HydrophobicContact CG-CZ2 4.37Å; T998-W1030 PolarHBondContact OG1-NE1 3.49Å; V1001-W1030 HydrophobicContact CG1-CB 4.02Å; V1001-W1030 HydrophobicContact CG1-CG 4.23Å; V1001-W1030 HydrophobicContact CG2-CG 4.42Å; S1026-W1030 PolarHBondContact O-N 3.46Å; S1026-W1030 VanDerWaalsContact O-N 3.1Å; M1027-W1030 PolarHBondContact O-N 3.43Å; A1028-W1030 PolarHBondContact O-N 2.87Å; W1030-V1032 PolarHBondContact O-N 2.94Å; W1030-F1033 HydrophobicContact CE3-CD1 4.09Å; W1030-F1033 AromaticContact CZ3-CD1 3.78Å; W1030-F1033 HydrophobicContact CZ3-CD1 3.78Å; W1030-F1033 HydrophobicContact CZ3-CE1 4.19Å; W1030-F1033 PolarHBondContact O-N 3.28Å; W1030-F1034 HydrophobicContact CH2-CB 4.15Å; W1030-F1034 HydrophobicContact CH2-CD2 4.28Å; W1030-F1034 HydrophobicContact CH2-CG 4.37Å; W1030-F1034 HydrophobicContact CZ2-CB 3.92Å; W1030-F1034 HydrophobicContact CZ2-CD2 4.2Å; W1030-F1034 AromaticContact CZ2-CG 3.99Å; W1030-F1034 HydrophobicContact CZ2-CG 3.99Å; W1030-F1034 WeakPolarHBondContact O-CB 3.38Å; W1030-F1034 PolarHBondContact O-N 3.41Å
1031	M	91.9	Very high	91.1	Very high	43 Å²	43	47.9 Å²	47.9	21%	0.212	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-40.5	-177.6	-67.3	-61.8	-71	0	0	112.5	T998 M1027 A1028 A1035 M1058 F1063 W1064	T998-M1031 HydrophobicContact CG2-SD 3.81Å; M1027-M1031 WeakPolarHBondContact O-CG 3.33Å; M1027-M1031 PolarHBondContact O-N 3.32Å; A1028-M1031 PolarHBondContact O-N 3.04Å; M1031-A1035 WeakPolarHBondContact O-CB 3.41Å; M1031-A1035 PolarHBondContact O-N 3.25Å; M1031-M1058 HydrophobicContact CE-CE 3.94Å; M1031-F1063 HydrophobicContact CE-CE1 4.43Å; M1031-F1063 HydrophobicContact CE-CZ 4.24Å; M1031-W1064 HydrophobicContact CE-CH2 4.07Å
1032	V	92.8	Very high	90.1	Very high	93 Å²	93	47.5 Å²	47.5	56%	0.564	26%	0.263	S	S	*	.	H	α-helix	trans	-67.1	-43.8	174.3	172.8	0	0	0	0	111.1	A1028 W1030 A1035 V1036	A1028-V1032 WeakPolarHBondContact O-CG2 3.38Å; A1028-V1032 PolarHBondContact O-N 3.38Å; W1030-V1032 PolarHBondContact O-N 2.94Å; V1032-A1035 PolarHBondContact O-N 3.2Å; V1032-V1036 WeakPolarHBondContact O-CG2 3.23Å; V1032-V1036 PolarHBondContact O-N 3.5Å; V1032-V1036 VanDerWaalsContact O-N 3.11Å
1033	F	91.8	Very high	89.6	Confident	44 Å²	44	51.8 Å²	51.8	19%	0.193	30%	0.299	C	S	.	.	H	α-helix	trans	-59.3	-50.3	176.1	175.6	-90.9	0	0	0	111.4	L907 F912 L1029 W1030 A1035 V1036 Y1037	L907-F1033 HydrophobicContact CD1-CE2 3.95Å; L907-F1033 HydrophobicContact CD1-CZ 3.76Å; F912-F1033 HydrophobicContact CE1-CB 3.78Å; F912-F1033 AromaticContact CE1-CD1 3.95Å; F912-F1033 HydrophobicContact CE1-CD1 3.95Å; F912-F1033 HydrophobicContact CE1-CD2 4.18Å; F912-F1033 AromaticContact CE1-CG 3.68Å; F912-F1033 HydrophobicContact CE1-CG 3.68Å; F912-F1033 HydrophobicContact CE2-CD1 4.28Å; F912-F1033 HydrophobicContact CE2-CE1 4.39Å; F912-F1033 HydrophobicContact CZ-CB 4.14Å; F912-F1033 AromaticContact CZ-CD1 3.4Å; F912-F1033 HydrophobicContact CZ-CD1 3.4Å; F912-F1033 AromaticContact CZ-CD2 3.99Å; F912-F1033 HydrophobicContact CZ-CD2 3.99Å; F912-F1033 AromaticContact CZ-CE1 3.73Å; F912-F1033 HydrophobicContact CZ-CE1 3.73Å; F912-F1033 HydrophobicContact CZ-CE2 4.27Å; F912-F1033 AromaticContact CZ-CG 3.55Å; F912-F1033 HydrophobicContact CZ-CG 3.55Å; F912-F1033 HydrophobicContact CZ-CZ 4.16Å; L1029-F1033 WeakPolarHBondContact O-CB 3.21Å; L1029-F1033 PolarHBondContact O-N 3.01Å; W1030-F1033 HydrophobicContact CE3-CD1 4.09Å; W1030-F1033 AromaticContact CZ3-CD1 3.78Å; W1030-F1033 HydrophobicContact CZ3-CD1 3.78Å; W1030-F1033 HydrophobicContact CZ3-CE1 4.19Å; W1030-F1033 PolarHBondContact O-N 3.28Å; F1033-A1035 VanDerWaalsContact C-N 3.34Å; F1033-A1035 PolarHBondContact O-N 3.45Å; F1033-V1036 PolarHBondContact O-N 3.48Å; F1033-Y1037 AromaticContact CE1-CD1 3.62Å; F1033-Y1037 HydrophobicContact CE1-CD1 3.62Å; F1033-Y1037 HydrophobicContact CE1-CD2 4.38Å; F1033-Y1037 HydrophobicContact CE1-CE1 4.19Å; F1033-Y1037 AromaticContact CE1-CG 3.73Å; F1033-Y1037 HydrophobicContact CE1-CG 3.73Å; F1033-Y1037 HydrophobicContact CE2-CD2 4.49Å; F1033-Y1037 HydrophobicContact CE2-CG 4.47Å; F1033-Y1037 AromaticContact CZ-CD1 3.91Å; F1033-Y1037 HydrophobicContact CZ-CD1 3.91Å; F1033-Y1037 AromaticContact CZ-CD2 3.86Å; F1033-Y1037 HydrophobicContact CZ-CD2 3.86Å; F1033-Y1037 HydrophobicContact CZ-CE1 4.29Å; F1033-Y1037 HydrophobicContact CZ-CE2 4.27Å; F1033-Y1037 AromaticContact CZ-CG 3.68Å; F1033-Y1037 HydrophobicContact CZ-CG 3.68Å; F1033-Y1037 WeakPolarHBondContact O-CB 3.49Å; F1033-Y1037 PolarHBondContact O-N 3.1Å
1034	F	91.3	Very high	88.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60.9	-41.2	-177.6	178.6	-132.8	0	0	0	112.5	N994 W1030 S1038 M1050 Q1053 A1054 V1057 M1058	N994-F1034 HydrophobicContact CB-CE2 3.98Å; N994-F1034 HydrophobicContact CB-CZ 3.75Å; W1030-F1034 HydrophobicContact CH2-CB 4.15Å; W1030-F1034 HydrophobicContact CH2-CD2 4.28Å; W1030-F1034 HydrophobicContact CH2-CG 4.37Å; W1030-F1034 HydrophobicContact CZ2-CB 3.92Å; W1030-F1034 HydrophobicContact CZ2-CD2 4.2Å; W1030-F1034 AromaticContact CZ2-CG 3.99Å; W1030-F1034 HydrophobicContact CZ2-CG 3.99Å; W1030-F1034 WeakPolarHBondContact O-CB 3.38Å; W1030-F1034 PolarHBondContact O-N 3.41Å; F1034-S1038 WeakPolarHBondContact O-CB 3.47Å; F1034-S1038 PolarHBondContact O-N 3.12Å; F1034-S1038 PolarHBondContact O-OG 3.1Å; F1034-M1050 HydrophobicContact CD2-CE 4Å; F1034-M1050 HydrophobicContact CE2-CE 3.86Å; F1034-Q1053 HydrophobicContact CE2-CB 4.47Å; F1034-A1054 HydrophobicContact CD1-CB 3.87Å; F1034-A1054 HydrophobicContact CD2-CB 4.24Å; F1034-A1054 HydrophobicContact CE1-CB 3.73Å; F1034-A1054 HydrophobicContact CE2-CB 4.1Å; F1034-A1054 HydrophobicContact CG-CB 4.12Å; F1034-A1054 VanDerWaalsContact CZ-CA 3.47Å; F1034-A1054 HydrophobicContact CZ-CB 3.84Å; F1034-A1054 WeakPolarHBondContact O-CB 3.35Å; F1034-V1057 HydrophobicContact CE1-CB 4.05Å; F1034-V1057 HydrophobicContact CE1-CG1 4.08Å; F1034-V1057 HydrophobicContact CE1-CG2 4.46Å; F1034-V1057 HydrophobicContact CZ-CB 4.15Å; F1034-V1057 HydrophobicContact CZ-CG1 4.49Å; F1034-V1057 HydrophobicContact CZ-CG2 4.09Å; F1034-M1058 HydrophobicContact CD1-CE 3.92Å; F1034-M1058 HydrophobicContact CE1-CE 4.44Å
1035	A	90.4	Very high	88.1	Confident	40 Å²	40	54.1 Å²	54.1	33%	0.331	33%	0.326	S	S	.	.	H	α-helix	trans	-61.7	-44.8	174.9	0	0	0	0	0	112.8	M1031 V1032 F1033 M1058	M1031-A1035 WeakPolarHBondContact O-CB 3.41Å; M1031-A1035 PolarHBondContact O-N 3.25Å; V1032-A1035 PolarHBondContact O-N 3.2Å; F1033-A1035 VanDerWaalsContact C-N 3.34Å; F1033-A1035 PolarHBondContact O-N 3.45Å; A1035-M1058 HydrophobicContact CB-CE 4.16Å
1036	V	89.3	Confident	87.3	Confident	74 Å²	74	56.3 Å²	56.3	45%	0.448	33%	0.332	S	S	.	.	H	α-helix	trans	-74.7	-42.8	-178.8	170.5	0	0	0	0	111.9	V1032 F1033 S1038 V1039 F1040	V1032-V1036 WeakPolarHBondContact O-CG2 3.23Å; V1032-V1036 PolarHBondContact O-N 3.5Å; V1032-V1036 VanDerWaalsContact O-N 3.11Å; F1033-V1036 PolarHBondContact O-N 3.48Å; V1036-S1038 VanDerWaalsContact C-N 3.3Å; V1036-S1038 PolarHBondContact O-N 3.09Å; V1036-V1039 PolarHBondContact O-N 2.99Å; V1036-V1039 VanDerWaalsContact O-N 3.07Å; V1036-F1040 HydrophobicContact CG1-CD1 4.21Å; V1036-F1040 HydrophobicContact CG1-CE1 3.45Å; V1036-F1040 VanDerWaalsContact CG1-CE1 3.45Å; V1036-F1040 HydrophobicContact CG1-CZ 3.99Å
1037	Y	88	Confident	86.3	Confident	10 Å²	10	57 Å²	57	4%	0.039	34%	0.338	C	S	.	.	H	α-helix	trans	-62	-37.1	-177.9	-173.4	-132.5	0	0	0	112.1	E901 W903 F1033 V1039 F1040 I1046 A1047 M1050	E901-Y1037 VanDerWaalsContact CD-OH 3.3Å; E901-Y1037 WeakPolarHBondContact OE2-CE1 3.4Å; E901-Y1037 PolarHBondContact OE2-OH 3.09Å; W903-Y1037 WeakPolarHBondContact CB-OH 3.36Å; W903-Y1037 VanDerWaalsContact CD1-OH 3.25Å; F1033-Y1037 AromaticContact CE1-CD1 3.62Å; F1033-Y1037 HydrophobicContact CE1-CD1 3.62Å; F1033-Y1037 HydrophobicContact CE1-CD2 4.38Å; F1033-Y1037 HydrophobicContact CE1-CE1 4.19Å; F1033-Y1037 AromaticContact CE1-CG 3.73Å; F1033-Y1037 HydrophobicContact CE1-CG 3.73Å; F1033-Y1037 HydrophobicContact CE2-CD2 4.49Å; F1033-Y1037 HydrophobicContact CE2-CG 4.47Å; F1033-Y1037 AromaticContact CZ-CD1 3.91Å; F1033-Y1037 HydrophobicContact CZ-CD1 3.91Å; F1033-Y1037 AromaticContact CZ-CD2 3.86Å; F1033-Y1037 HydrophobicContact CZ-CD2 3.86Å; F1033-Y1037 HydrophobicContact CZ-CE1 4.29Å; F1033-Y1037 HydrophobicContact CZ-CE2 4.27Å; F1033-Y1037 AromaticContact CZ-CG 3.68Å; F1033-Y1037 HydrophobicContact CZ-CG 3.68Å; F1033-Y1037 WeakPolarHBondContact O-CB 3.49Å; F1033-Y1037 PolarHBondContact O-N 3.1Å; Y1037-V1039 PolarHBondContact O-N 2.69Å; Y1037-F1040 AromaticContact CD2-CD2 3.68Å; Y1037-F1040 HydrophobicContact CD2-CD2 3.68Å; Y1037-F1040 HydrophobicContact CD2-CE2 4.01Å; Y1037-F1040 HydrophobicContact CD2-CG 4.49Å; Y1037-F1040 HydrophobicContact CE2-CD2 4.28Å; Y1037-F1040 PolarHBondContact O-N 3.3Å; Y1037-I1046 HydrophobicContact CE2-CG2 4.16Å; Y1037-A1047 HydrophobicContact CE1-CB 4.27Å; Y1037-A1047 HydrophobicContact CE2-CB 4.03Å; Y1037-A1047 WeakPolarHBondContact OH-CB 3.4Å; Y1037-M1050 HydrophobicContact CD1-CB 4.49Å; Y1037-M1050 HydrophobicContact CD1-CE 3.73Å; Y1037-M1050 HydrophobicContact CD1-CG 4.31Å; Y1037-M1050 HydrophobicContact CE1-CB 4.45Å; Y1037-M1050 HydrophobicContact CE1-CE 3.88Å; Y1037-M1050 HydrophobicContact CE1-CG 3.91Å
1038	S	86.9	Confident	85.7	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.021	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-1.5	175.9	-55.5	0	0	0	0	114.7	F1034 V1036 M1050 G1052 A1054	F1034-S1038 WeakPolarHBondContact O-CB 3.47Å; F1034-S1038 PolarHBondContact O-N 3.12Å; F1034-S1038 PolarHBondContact O-OG 3.1Å; V1036-S1038 VanDerWaalsContact C-N 3.3Å; V1036-S1038 PolarHBondContact O-N 3.09Å; S1038-M1050 WeakPolarHBondContact CA-O 3.44Å; S1038-M1050 WeakPolarHBondContact CB-O 3.12Å; S1038-G1052 PolarHBondContact O-N 2.97Å; S1038-A1054 WeakPolarHBondContact OG-CB 3.37Å; S1038-A1054 PolarHBondContact OG-N 3.13Å; S1038-A1054 VanDerWaalsContact OG-N 3.1Å
1039	V	86.9	Confident	85.1	Confident	105 Å²	105	60.5 Å²	60.5	64%	0.636	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.3	-1.5	-179.2	-171.3	0	0	0	0	111.8	V1036 Y1037	V1036-V1039 PolarHBondContact O-N 2.99Å; V1036-V1039 VanDerWaalsContact O-N 3.07Å; Y1037-V1039 PolarHBondContact O-N 2.69Å
1040	F	83.4	Confident	84.7	Confident	67 Å²	67	57 Å²	57	29%	0.294	33%	0.334	S	S	.	.			trans	-64.4	-41.1	179.2	-81.5	-2	0	0	0	113.2	V1036 Y1037 A1043 I1044	V1036-F1040 HydrophobicContact CG1-CD1 4.21Å; V1036-F1040 HydrophobicContact CG1-CE1 3.45Å; V1036-F1040 VanDerWaalsContact CG1-CE1 3.45Å; V1036-F1040 HydrophobicContact CG1-CZ 3.99Å; Y1037-F1040 AromaticContact CD2-CD2 3.68Å; Y1037-F1040 HydrophobicContact CD2-CD2 3.68Å; Y1037-F1040 HydrophobicContact CD2-CE2 4.01Å; Y1037-F1040 HydrophobicContact CD2-CG 4.49Å; Y1037-F1040 HydrophobicContact CE2-CD2 4.28Å; Y1037-F1040 PolarHBondContact O-N 3.3Å; F1040-A1043 CarbonylContact O-C 3.31Å; F1040-A1043 WeakPolarHBondContact O-CA 3.47Å; F1040-A1043 PolarHBondContact O-N 2.86Å; F1040-I1044 HydrophobicContact CB-CB 4.46Å; F1040-I1044 HydrophobicContact CD1-CD1 4.39Å; F1040-I1044 HydrophobicContact CG-CD1 4.39Å; F1040-I1044 PolarHBondContact O-N 2.83Å
1041	W	76.3	Confident	84.4	Confident	97 Å²	97	61.4 Å²	61.4	37%	0.367	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	136.5	174.1	-175.5	-90.2	0	0	0	110.6	P1045 P1048 L1051	W1041-P1045 HydrophobicContact CZ3-CB 4.08Å; W1041-P1048 HydrophobicContact CD2-CB 3.73Å; W1041-P1048 HydrophobicContact CE3-CB 3.89Å; W1041-P1048 HydrophobicContact CG-CB 4.19Å; W1041-P1048 HydrophobicContact CH2-CB 4.38Å; W1041-P1048 HydrophobicContact CZ2-CB 4.23Å; W1041-P1048 HydrophobicContact CZ3-CB 4.21Å; W1041-L1051 WeakPolarHBondContact O-CD1 3.35Å
1042	P	74.4	Confident	84	Confident	106 Å²	106	60.9 Å²	60.9	69%	0.688	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	cis	-93.6	2.7	2.1	37.7	-36.6	0	0	0	114.6	I1044	P1042-I1044 VanDerWaalsContact C-N 3.28Å; P1042-I1044 PolarHBondContact O-N 3.01Å
1043	A	82.4	Confident	83.8	Confident	93 Å²	93	56.8 Å²	56.8	77%	0.769	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-30.1	-175	0	0	0	0	0	113.6	F1040	F1040-A1043 CarbonylContact O-C 3.31Å; F1040-A1043 WeakPolarHBondContact O-CA 3.47Å; F1040-A1043 PolarHBondContact O-N 2.86Å
1044	I	79.2	Confident	83.6	Confident	75 Å²	75	54.9 Å²	54.9	39%	0.385	33%	0.33	S	S	.	.	S	Bend	trans	-125.6	128.4	169.4	-59.4	173.4	0	0	0	106.6	F1040 P1042 I1046	F1040-I1044 HydrophobicContact CB-CB 4.46Å; F1040-I1044 HydrophobicContact CD1-CD1 4.39Å; F1040-I1044 HydrophobicContact CG-CD1 4.39Å; F1040-I1044 PolarHBondContact O-N 2.83Å; P1042-I1044 VanDerWaalsContact C-N 3.28Å; P1042-I1044 PolarHBondContact O-N 3.01Å; I1044-I1046 HydrophobicContact CG2-CB 4.29Å; I1044-I1046 HydrophobicContact CG2-CD1 3.76Å; I1044-I1046 HydrophobicContact CG2-CG1 3.91Å; I1044-I1046 PolarHBondContact O-N 3.4Å
1045	P	79.4	Confident	83.3	Confident	110 Å²	110	56.6 Å²	56.6	71%	0.714	35%	0.348	S	S	*	.	S	Bend	trans	-79.7	60	-174.7	33.2	-36.9	0	0	0	112.5	W1041	W1041-P1045 HydrophobicContact CZ3-CB 4.08Å
1046	I	77	Confident	83.1	Confident	68 Å²	68	57.6 Å²	57.6	35%	0.349	35%	0.345	S	S	.	.	S	Bend	trans	-130.3	139.1	179.3	-65.7	175.2	0	0	0	108.6	Y1037 I1044	Y1037-I1046 HydrophobicContact CE2-CG2 4.16Å; I1044-I1046 HydrophobicContact CG2-CB 4.29Å; I1044-I1046 HydrophobicContact CG2-CD1 3.76Å; I1044-I1046 HydrophobicContact CG2-CG1 3.91Å; I1044-I1046 PolarHBondContact O-N 3.4Å
1047	A	74.3	Confident	83.1	Confident	14 Å²	14	54 Å²	54	12%	0.116	32%	0.323	C	S	.	.			trans	46.4	61.7	172.7	0	0	0	0	0	115.6	Y1037 D1049 M1050	Y1037-A1047 HydrophobicContact CE1-CB 4.27Å; Y1037-A1047 HydrophobicContact CE2-CB 4.03Å; Y1037-A1047 WeakPolarHBondContact OH-CB 3.4Å; A1047-D1049 PolarHBondContact O-N 3.39Å; A1047-D1049 VanDerWaalsContact O-N 3.16Å; A1047-M1050 HydrophobicContact CB-CB 4.29Å; A1047-M1050 HydrophobicContact CB-CG 4.12Å; A1047-M1050 PolarHBondContact O-N 3.16Å; A1047-M1050 VanDerWaalsContact O-N 3.12Å
1048	P	81.2	Confident	83.1	Confident	57 Å²	57	56.2 Å²	56.2	37%	0.37	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-55.5	-32.4	175.7	25.2	-35	0	0	0	112.7	W1041 M1050 L1051	W1041-P1048 HydrophobicContact CD2-CB 3.73Å; W1041-P1048 HydrophobicContact CE3-CB 3.89Å; W1041-P1048 HydrophobicContact CG-CB 4.19Å; W1041-P1048 HydrophobicContact CH2-CB 4.38Å; W1041-P1048 HydrophobicContact CZ2-CB 4.23Å; W1041-P1048 HydrophobicContact CZ3-CB 4.21Å; P1048-M1050 PolarHBondContact O-N 3.1Å; P1048-L1051 VanDerWaalsContact O-CB 3.29Å; P1048-L1051 WeakPolarHBondContact O-CB 3.34Å; P1048-L1051 PolarHBondContact O-N 3.04Å; P1048-L1051 VanDerWaalsContact O-N 3.15Å
1049	D	82.6	Confident	83.1	Confident	96 Å²	96	63.1 Å²	63.1	51%	0.513	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-67	-17.4	-177.4	-40.3	-66	0	0	0	113.6	L990 A1047 Q1053	L990-D1049 HydrophobicContact CD1-CB 3.69Å; A1047-D1049 PolarHBondContact O-N 3.39Å; A1047-D1049 VanDerWaalsContact O-N 3.16Å; D1049-Q1053 PolarHBondContact O-NE2 2.77Å
1050	M	85.6	Confident	83.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-89.6	-4.6	178.1	-68	-69.9	-80.2	0	0	113.4	E901 N994 F1034 Y1037 S1038 A1047 P1048 G1052 Q1053	E901-M1050 HydrophobicContact CB-CG 4.39Å; E901-M1050 HydrophobicContact CB-SD 4.08Å; E901-M1050 HydrophobicContact CG-CG 3.89Å; E901-M1050 HydrophobicContact CG-SD 4.23Å; N994-M1050 WeakPolarHBondContact OD1-CE 3.29Å; F1034-M1050 HydrophobicContact CD2-CE 4Å; F1034-M1050 HydrophobicContact CE2-CE 3.86Å; Y1037-M1050 HydrophobicContact CD1-CB 4.49Å; Y1037-M1050 HydrophobicContact CD1-CE 3.73Å; Y1037-M1050 HydrophobicContact CD1-CG 4.31Å; Y1037-M1050 HydrophobicContact CE1-CB 4.45Å; Y1037-M1050 HydrophobicContact CE1-CE 3.88Å; Y1037-M1050 HydrophobicContact CE1-CG 3.91Å; S1038-M1050 WeakPolarHBondContact CA-O 3.44Å; S1038-M1050 WeakPolarHBondContact CB-O 3.12Å; A1047-M1050 HydrophobicContact CB-CB 4.29Å; A1047-M1050 HydrophobicContact CB-CG 4.12Å; A1047-M1050 PolarHBondContact O-N 3.16Å; A1047-M1050 VanDerWaalsContact O-N 3.12Å; P1048-M1050 PolarHBondContact O-N 3.1Å; M1050-G1052 PolarHBondContact O-N 2.86Å; M1050-G1052 VanDerWaalsContact O-N 3.13Å; M1050-Q1053 WeakPolarHBondContact O-CB 3.31Å; M1050-Q1053 PolarHBondContact O-N 3.07Å; M1050-Q1053 VanDerWaalsContact O-N 3.09Å
1051	L	86.8	Confident	83.3	Confident	94 Å²	94	62.2 Å²	62.2	49%	0.492	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	118.4	-177.8	179.4	66.8	0	0	0	111.9	W1041 P1048 Q1053	W1041-L1051 WeakPolarHBondContact O-CD1 3.35Å; P1048-L1051 VanDerWaalsContact O-CB 3.29Å; P1048-L1051 WeakPolarHBondContact O-CB 3.34Å; P1048-L1051 PolarHBondContact O-N 3.04Å; P1048-L1051 VanDerWaalsContact O-N 3.15Å; L1051-Q1053 PolarHBondContact O-N 3.38Å; L1051-Q1053 VanDerWaalsContact O-N 3.13Å
1052	G	85.1	Confident	83.8	Confident	33 Å²	33	61.1 Å²	61.1	34%	0.34	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	2.5	177.2	0	0	0	0	0	115.6	S1038 M1050 A1054 G1055 K1056	S1038-G1052 PolarHBondContact O-N 2.97Å; M1050-G1052 PolarHBondContact O-N 2.86Å; M1050-G1052 VanDerWaalsContact O-N 3.13Å; G1052-A1054 PolarHBondContact O-N 3.29Å; G1052-G1055 WeakPolarHBondContact O-CA 3.28Å; G1052-G1055 PolarHBondContact O-N 3.39Å; G1052-K1056 PolarHBondContact O-N 3.23Å; G1052-K1056 VanDerWaalsContact O-N 3.13Å
1053	Q	87.4	Confident	84.5	Confident	6 Å²	6	56 Å²	56	3%	0.028	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-42.7	-176.9	-69	-68	8.1	0	0	112.1	D988 F1034 D1049 M1050 L1051 G1055 K1056 V1057	D988-Q1053 PolarHBondContact OD1-NE2 2.84Å; D988-Q1053 PolarHBondContact OD2-NE2 3.29Å; F1034-Q1053 HydrophobicContact CE2-CB 4.47Å; D1049-Q1053 PolarHBondContact O-NE2 2.77Å; M1050-Q1053 WeakPolarHBondContact O-CB 3.31Å; M1050-Q1053 PolarHBondContact O-N 3.07Å; M1050-Q1053 VanDerWaalsContact O-N 3.09Å; L1051-Q1053 PolarHBondContact O-N 3.38Å; L1051-Q1053 VanDerWaalsContact O-N 3.13Å; Q1053-G1055 VanDerWaalsContact C-N 3.26Å; Q1053-G1055 PolarHBondContact O-N 3.47Å; Q1053-K1056 PolarHBondContact O-N 3.4Å; Q1053-V1057 WeakPolarHBondContact O-CG2 3.28Å; Q1053-V1057 PolarHBondContact O-N 2.94Å
1054	A	87.7	Confident	85	Confident	4 Å²	4	57.3 Å²	57.3	3%	0.033	30%	0.298	C	S	.	.	H	α-helix	trans	-59.5	-35.5	172.8	0	0	0	0	0	113.2	F1034 S1038 G1052 V1057 M1058	F1034-A1054 HydrophobicContact CD1-CB 3.87Å; F1034-A1054 HydrophobicContact CD2-CB 4.24Å; F1034-A1054 HydrophobicContact CE1-CB 3.73Å; F1034-A1054 HydrophobicContact CE2-CB 4.1Å; F1034-A1054 HydrophobicContact CG-CB 4.12Å; F1034-A1054 VanDerWaalsContact CZ-CA 3.47Å; F1034-A1054 HydrophobicContact CZ-CB 3.84Å; F1034-A1054 WeakPolarHBondContact O-CB 3.35Å; S1038-A1054 WeakPolarHBondContact OG-CB 3.37Å; S1038-A1054 PolarHBondContact OG-N 3.13Å; S1038-A1054 VanDerWaalsContact OG-N 3.1Å; G1052-A1054 PolarHBondContact O-N 3.29Å; A1054-V1057 PolarHBondContact O-N 3.38Å; A1054-M1058 HydrophobicContact CB-CE 4.22Å; A1054-M1058 VanDerWaalsContact O-CB 3.25Å; A1054-M1058 WeakPolarHBondContact O-CB 3.07Å; A1054-M1058 WeakPolarHBondContact O-CG 3.04Å; A1054-M1058 PolarHBondContact O-N 3.39Å
1055	G	85.8	Confident	85.6	Confident	36 Å²	36	56.6 Å²	56.6	37%	0.371	30%	0.295	S	S	.	.	H	α-helix	trans	-61.6	-48.4	175	0	0	0	0	0	112	G1052 Q1053 Q1059	G1052-G1055 WeakPolarHBondContact O-CA 3.28Å; G1052-G1055 PolarHBondContact O-N 3.39Å; Q1053-G1055 VanDerWaalsContact C-N 3.26Å; Q1053-G1055 PolarHBondContact O-N 3.47Å; G1055-Q1059 WeakPolarHBondContact O-CB 3.06Å; G1055-Q1059 WeakPolarHBondContact O-CG 3.36Å; G1055-Q1059 PolarHBondContact O-N 2.85Å; G1055-Q1059 VanDerWaalsContact O-N 3.17Å
1056	K	85.8	Confident	86.1	Confident	61 Å²	61	51.3 Å²	51.3	27%	0.265	26%	0.261	S	S	.	.	H	α-helix	trans	-60.5	-51.7	174.7	-64	-179.7	-174.2	173.5	0	111.8	F981 D988 F991 G1052 Q1053 M1058 Q1059 C1060	F981-K1056 WeakPolarHBondContact CE1-O 3.34Å; F981-K1056 HydrophobicContact CZ-CB 3.99Å; F981-K1056 WeakPolarHBondContact CZ-O 3.45Å; D988-K1056 IonicContact OD2-NZ 2.68Å; F991-K1056 HydrophobicContact CD2-CB 4.09Å; F991-K1056 HydrophobicContact CE2-CB 4.08Å; G1052-K1056 PolarHBondContact O-N 3.23Å; G1052-K1056 VanDerWaalsContact O-N 3.13Å; Q1053-K1056 PolarHBondContact O-N 3.4Å; K1056-M1058 PolarHBondContact O-N 2.73Å; K1056-Q1059 PolarHBondContact O-N 2.9Å; K1056-C1060 PolarHBondContact O-N 3.1Å
1057	V	88.5	Confident	86.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-43.6	-175.7	173	0	0	0	0	111.4	F991 N994 M995 F1034 Q1053 A1054 Q1059 C1060 F1063	F991-V1057 HydrophobicContact CD2-CG2 3.49Å; F991-V1057 VanDerWaalsContact CD2-CG2 3.49Å; F991-V1057 HydrophobicContact CE2-CB 4.32Å; F991-V1057 HydrophobicContact CE2-CG2 3.7Å; F991-V1057 HydrophobicContact CG-CG2 4.33Å; N994-V1057 HydrophobicContact CB-CG2 4.35Å; M995-V1057 HydrophobicContact CG-CG1 3.98Å; M995-V1057 HydrophobicContact CG-CG2 4.39Å; F1034-V1057 HydrophobicContact CE1-CB 4.05Å; F1034-V1057 HydrophobicContact CE1-CG1 4.08Å; F1034-V1057 HydrophobicContact CE1-CG2 4.46Å; F1034-V1057 HydrophobicContact CZ-CB 4.15Å; F1034-V1057 HydrophobicContact CZ-CG1 4.49Å; F1034-V1057 HydrophobicContact CZ-CG2 4.09Å; Q1053-V1057 WeakPolarHBondContact O-CG2 3.28Å; Q1053-V1057 PolarHBondContact O-N 2.94Å; A1054-V1057 PolarHBondContact O-N 3.38Å; V1057-Q1059 VanDerWaalsContact C-N 3.34Å; V1057-Q1059 PolarHBondContact O-N 3.29Å; V1057-C1060 WeakPolarHBondContact O-CB 3.24Å; V1057-C1060 PolarHBondContact O-N 3.2Å; V1057-F1063 HydrophobicContact CG1-CB 4.27Å; V1057-F1063 HydrophobicContact CG1-CD1 3.89Å; V1057-F1063 HydrophobicContact CG1-CD2 3.59Å; V1057-F1063 HydrophobicContact CG1-CE1 4.09Å; V1057-F1063 HydrophobicContact CG1-CE2 3.79Å; V1057-F1063 HydrophobicContact CG1-CG 3.62Å; V1057-F1063 HydrophobicContact CG1-CZ 4.03Å; V1057-F1063 WeakPolarHBondContact O-CB 3.48Å; V1057-F1063 VanDerWaalsContact O-CD1 3.3Å; V1057-F1063 WeakPolarHBondContact O-CD1 3.38Å
1058	M	87.9	Confident	87.7	Confident	56 Å²	56	53.4 Å²	53.4	28%	0.276	27%	0.274	S	S	.	.	H	α-helix	trans	-74.2	-20.9	-179.8	-65.1	-179.4	-172.4	0	0	113.6	M1031 F1034 A1035 A1054 K1056 W1064	M1031-M1058 HydrophobicContact CE-CE 3.94Å; F1034-M1058 HydrophobicContact CD1-CE 3.92Å; F1034-M1058 HydrophobicContact CE1-CE 4.44Å; A1035-M1058 HydrophobicContact CB-CE 4.16Å; A1054-M1058 HydrophobicContact CB-CE 4.22Å; A1054-M1058 VanDerWaalsContact O-CB 3.25Å; A1054-M1058 WeakPolarHBondContact O-CB 3.07Å; A1054-M1058 WeakPolarHBondContact O-CG 3.04Å; A1054-M1058 PolarHBondContact O-N 3.39Å; K1056-M1058 PolarHBondContact O-N 2.73Å; M1058-W1064 HydrophobicContact CB-CZ2 4.29Å; M1058-W1064 HydrophobicContact CG-CZ2 4.33Å; M1058-W1064 PolarHBondContact O-NE1 2.95Å
1059	Q	87.3	Confident	88.3	Confident	147 Å²	147	54.4 Å²	54.4	69%	0.687	28%	0.276	S	S	*	.	H	α-helix	trans	-80.4	-19.9	170.9	-73.6	174	9.7	0	0	113.1	G1055 K1056 V1057 W1061	G1055-Q1059 WeakPolarHBondContact O-CB 3.06Å; G1055-Q1059 WeakPolarHBondContact O-CG 3.36Å; G1055-Q1059 PolarHBondContact O-N 2.85Å; G1055-Q1059 VanDerWaalsContact O-N 3.17Å; K1056-Q1059 PolarHBondContact O-N 2.9Å; V1057-Q1059 VanDerWaalsContact C-N 3.34Å; V1057-Q1059 PolarHBondContact O-N 3.29Å; Q1059-W1061 PolarHBondContact O-N 2.93Å
1060	C	86.8	Confident	88.8	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.007	25%	0.251	C	S	.	.			trans	-73.5	120.4	179.9	-179.1	0	0	0	0	111.5	F981 F991 K1056 V1057 Y1062 F1063	F981-C1060 HydrophobicContact CE1-CB 4.24Å; F981-C1060 HydrophobicContact CZ-CB 4.34Å; F991-C1060 HydrophobicContact CE2-CB 4.34Å; F991-C1060 HydrophobicContact CZ-CB 3.87Å; K1056-C1060 PolarHBondContact O-N 3.1Å; V1057-C1060 WeakPolarHBondContact O-CB 3.24Å; V1057-C1060 PolarHBondContact O-N 3.2Å; C1060-Y1062 VanDerWaalsContact C-N 3.34Å; C1060-Y1062 PolarHBondContact O-N 2.88Å; C1060-F1063 HydrophobicContact CB-CB 4.14Å; C1060-F1063 WeakPolarHBondContact O-CB 3.49Å; C1060-F1063 PolarHBondContact O-N 2.84Å
1061	W	86.8	Confident	89.2	Confident	153 Å²	153	50 Å²	50	58%	0.58	25%	0.252	S	S	*	.	H	α-helix	trans	-65.4	-37.8	177.9	114.9	-95	0	0	0	112.1	Q1059 F1063 W1064 L1065	Q1059-W1061 PolarHBondContact O-N 2.93Å; W1061-F1063 PolarHBondContact O-N 3.17Å; W1061-W1064 PolarHBondContact O-N 3.05Å; W1061-W1064 VanDerWaalsContact O-N 3.09Å; W1061-L1065 HydrophobicContact CE3-CB 4.24Å; W1061-L1065 HydrophobicContact CH2-CB 4.07Å; W1061-L1065 HydrophobicContact CH2-CD1 3.89Å; W1061-L1065 HydrophobicContact CH2-CD2 3.7Å; W1061-L1065 HydrophobicContact CH2-CG 4.09Å; W1061-L1065 HydrophobicContact CZ2-CD2 3.9Å; W1061-L1065 HydrophobicContact CZ3-CB 3.87Å; W1061-L1065 HydrophobicContact CZ3-CD1 4.04Å; W1061-L1065 HydrophobicContact CZ3-CD2 4.37Å; W1061-L1065 HydrophobicContact CZ3-CG 4.3Å; W1061-L1065 PolarHBondContact O-N 2.84Å; W1061-L1065 VanDerWaalsContact O-N 3.08Å
1062	Y	87.6	Confident	89.6	Confident	73 Å²	73	49.5 Å²	49.5	29%	0.286	25%	0.253	S	S	.	.	H	α-helix	trans	-60.6	-29.4	178.2	-59	-100	0	0	0	112.1	M974 P980 C1060 G1066	M974-Y1062 VanDerWaalsContact CE-O 3.24Å; M974-Y1062 WeakPolarHBondContact CE-O 3.34Å; M974-Y1062 HydrophobicContact CG-CD1 4.17Å; P980-Y1062 HydrophobicContact CB-CD2 3.5Å; P980-Y1062 VanDerWaalsContact CB-CD2 3.5Å; P980-Y1062 HydrophobicContact CB-CE2 3.65Å; P980-Y1062 HydrophobicContact CB-CG 4.42Å; C1060-Y1062 VanDerWaalsContact C-N 3.34Å; C1060-Y1062 PolarHBondContact O-N 2.88Å; Y1062-G1066 PolarHBondContact O-N 3.15Å
1063	F	90.3	Very high	90	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-47.2	173.4	165.6	-108.5	0	0	0	112	M995 T998 Y999 M1031 V1057 C1060 W1061 L1065 G1066 L1067	M995-F1063 HydrophobicContact CB-CD2 4.36Å; M995-F1063 HydrophobicContact CE-CB 4.17Å; M995-F1063 HydrophobicContact CG-CB 4.42Å; M995-F1063 HydrophobicContact CG-CD2 3.9Å; T998-F1063 HydrophobicContact CG2-CE2 3.91Å; T998-F1063 HydrophobicContact CG2-CZ 3.96Å; Y999-F1063 AromaticContact CE1-CD2 3.79Å; Y999-F1063 HydrophobicContact CE1-CD2 3.79Å; Y999-F1063 AromaticContact CE1-CE2 3.91Å; Y999-F1063 HydrophobicContact CE1-CE2 3.91Å; Y999-F1063 WeakPolarHBondContact OH-CA 3.45Å; Y999-F1063 PolarHBondContact OH-O 2.89Å; M1031-F1063 HydrophobicContact CE-CE1 4.43Å; M1031-F1063 HydrophobicContact CE-CZ 4.24Å; V1057-F1063 HydrophobicContact CG1-CB 4.27Å; V1057-F1063 HydrophobicContact CG1-CD1 3.89Å; V1057-F1063 HydrophobicContact CG1-CD2 3.59Å; V1057-F1063 HydrophobicContact CG1-CE1 4.09Å; V1057-F1063 HydrophobicContact CG1-CE2 3.79Å; V1057-F1063 HydrophobicContact CG1-CG 3.62Å; V1057-F1063 HydrophobicContact CG1-CZ 4.03Å; V1057-F1063 WeakPolarHBondContact O-CB 3.48Å; V1057-F1063 VanDerWaalsContact O-CD1 3.3Å; V1057-F1063 WeakPolarHBondContact O-CD1 3.38Å; C1060-F1063 HydrophobicContact CB-CB 4.14Å; C1060-F1063 WeakPolarHBondContact O-CB 3.49Å; C1060-F1063 PolarHBondContact O-N 2.84Å; W1061-F1063 PolarHBondContact O-N 3.17Å; F1063-L1065 PolarHBondContact O-N 2.79Å; F1063-G1066 PolarHBondContact O-N 3.31Å; F1063-L1067 HydrophobicContact CZ-CD2 4.44Å; F1063-L1067 VanDerWaalsContact O-CB 3.3Å; F1063-L1067 WeakPolarHBondContact O-CB 3.3Å; F1063-L1067 PolarHBondContact O-N 2.92Å
1064	W	91.6	Very high	90.3	Very high	120 Å²	120	49.6 Å²	49.6	46%	0.455	25%	0.252	S	S	.	.	H	α-helix	trans	-68.1	-33.5	178.4	-63.8	105.3	0	0	0	112.9	M1031 M1058 W1061 L1067	M1031-W1064 HydrophobicContact CE-CH2 4.07Å; M1058-W1064 HydrophobicContact CB-CZ2 4.29Å; M1058-W1064 HydrophobicContact CG-CZ2 4.33Å; M1058-W1064 PolarHBondContact O-NE1 2.95Å; W1061-W1064 PolarHBondContact O-N 3.05Å; W1061-W1064 VanDerWaalsContact O-N 3.09Å; W1064-L1067 HydrophobicContact CE3-CD2 3.64Å; W1064-L1067 HydrophobicContact CZ3-CD2 3.65Å
1065	L	91.3	Very high	90.6	Very high	59 Å²	59	50.2 Å²	50.2	31%	0.309	25%	0.254	S	S	.	.	H	α-helix	trans	-64.5	-50.2	171	-176.1	70.1	0	0	0	111.4	W1061 F1063 L1067 V1068 L1069	W1061-L1065 HydrophobicContact CE3-CB 4.24Å; W1061-L1065 HydrophobicContact CH2-CB 4.07Å; W1061-L1065 HydrophobicContact CH2-CD1 3.89Å; W1061-L1065 HydrophobicContact CH2-CD2 3.7Å; W1061-L1065 HydrophobicContact CH2-CG 4.09Å; W1061-L1065 HydrophobicContact CZ2-CD2 3.9Å; W1061-L1065 HydrophobicContact CZ3-CB 3.87Å; W1061-L1065 HydrophobicContact CZ3-CD1 4.04Å; W1061-L1065 HydrophobicContact CZ3-CD2 4.37Å; W1061-L1065 HydrophobicContact CZ3-CG 4.3Å; W1061-L1065 PolarHBondContact O-N 2.84Å; W1061-L1065 VanDerWaalsContact O-N 3.08Å; F1063-L1065 PolarHBondContact O-N 2.79Å; L1065-L1067 VanDerWaalsContact C-N 3.29Å; L1065-L1067 PolarHBondContact O-N 3.14Å; L1065-V1068 PolarHBondContact O-N 2.96Å; L1065-L1069 HydrophobicContact CD1-CD1 3.87Å; L1065-L1069 HydrophobicContact CD1-CG 4.14Å; L1065-L1069 HydrophobicContact CD2-CD1 4.08Å; L1065-L1069 HydrophobicContact CG-CD1 3.73Å; L1065-L1069 HydrophobicContact CG-CG 4.2Å; L1065-L1069 PolarHBondContact O-N 3.27Å
1066	G	90.8	Very high	90.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-63	-33.8	179.6	0	0	0	0	0	113.1	Y1062 F1063 V1068 L1069 V1070 P1071	Y1062-G1066 PolarHBondContact O-N 3.15Å; F1063-G1066 PolarHBondContact O-N 3.31Å; G1066-V1068 PolarHBondContact O-N 3.46Å; G1066-L1069 PolarHBondContact O-N 2.91Å; G1066-V1070 WeakPolarHBondContact O-CB 3.37Å; G1066-V1070 WeakPolarHBondContact O-CG2 3.35Å; G1066-V1070 PolarHBondContact O-N 2.75Å; G1066-P1071 WeakPolarHBondContact O-CD 3.5Å
1067	L	92.5	Very high	91.2	Very high	33 Å²	33	54.9 Å²	54.9	17%	0.173	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-27	176.2	-168.9	65.7	0	0	0	113	T998 Y999 V1002 F1063 W1064 L1065 P1071	T998-L1067 HydrophobicContact CG2-CD1 3.87Å; Y999-L1067 HydrophobicContact CD1-CB 4.37Å; Y999-L1067 HydrophobicContact CD1-CD1 3.88Å; Y999-L1067 HydrophobicContact CE1-CB 3.97Å; Y999-L1067 HydrophobicContact CE1-CD1 4.15Å; Y999-L1067 VanDerWaalsContact CE1-N 3.28Å; V1002-L1067 HydrophobicContact CG2-CD1 3.98Å; F1063-L1067 HydrophobicContact CZ-CD2 4.44Å; F1063-L1067 VanDerWaalsContact O-CB 3.3Å; F1063-L1067 WeakPolarHBondContact O-CB 3.3Å; F1063-L1067 PolarHBondContact O-N 2.92Å; W1064-L1067 HydrophobicContact CE3-CD2 3.64Å; W1064-L1067 HydrophobicContact CZ3-CD2 3.65Å; L1065-L1067 VanDerWaalsContact C-N 3.29Å; L1065-L1067 PolarHBondContact O-N 3.14Å; L1067-P1071 WeakPolarHBondContact O-CD 3.36Å; L1067-P1071 WeakPolarHBondContact O-CG 3.28Å
1068	V	92.2	Very high	91.3	Very high	93 Å²	93	55.4 Å²	55.4	56%	0.564	27%	0.272	S	S	*	.	H	α-helix	trans	-91.7	-54.5	172.1	-177.9	0	0	0	0	110.5	L1065 G1066 V1070 T1072	L1065-V1068 PolarHBondContact O-N 2.96Å; G1066-V1068 PolarHBondContact O-N 3.46Å; V1068-V1070 PolarHBondContact O-N 2.71Å; V1068-T1072 WeakPolarHBondContact O-CB 3.5Å; V1068-T1072 PolarHBondContact O-N 2.66Å; V1068-T1072 PolarHBondContact O-OG1 3.08Å; V1068-T1072 VanDerWaalsContact O-OG1 3.07Å
1069	L	93.6	Very high	91.5	Very high	78 Å²	78	59 Å²	59	41%	0.408	29%	0.286	S	S	.	.	H	α-helix	trans	-65.6	-42.3	-170.5	-67.2	-174.1	0	0	0	113.7	L1065 G1066 A1073	L1065-L1069 HydrophobicContact CD1-CD1 3.87Å; L1065-L1069 HydrophobicContact CD1-CG 4.14Å; L1065-L1069 HydrophobicContact CD2-CD1 4.08Å; L1065-L1069 HydrophobicContact CG-CD1 3.73Å; L1065-L1069 HydrophobicContact CG-CG 4.2Å; L1065-L1069 PolarHBondContact O-N 3.27Å; G1066-L1069 PolarHBondContact O-N 2.91Å; L1069-A1073 VanDerWaalsContact O-CB 3.29Å; L1069-A1073 WeakPolarHBondContact O-CB 3.26Å; L1069-A1073 PolarHBondContact O-N 2.68Å
1070	V	93.7	Very high	91.7	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-71.7	-48.8	-172.3	-176.6	0	0	0	0	111.6	I966 L967 F970 P971 Y999 G1066 V1068 T1072 A1073 C1074	I966-V1070 HydrophobicContact CG2-CG1 4.4Å; L967-V1070 HydrophobicContact CD2-CG1 3.81Å; L967-V1070 HydrophobicContact CG-CG1 4.48Å; F970-V1070 HydrophobicContact CB-CG2 4.35Å; F970-V1070 HydrophobicContact CD1-CG2 3.59Å; F970-V1070 HydrophobicContact CE1-CG2 4.11Å; F970-V1070 HydrophobicContact CG-CG2 4.1Å; P971-V1070 HydrophobicContact CG-CG2 4.33Å; Y999-V1070 HydrophobicContact CD2-CB 4.12Å; Y999-V1070 HydrophobicContact CD2-CG1 4.24Å; Y999-V1070 HydrophobicContact CD2-CG2 4.15Å; Y999-V1070 HydrophobicContact CE2-CG2 4.22Å; Y999-V1070 HydrophobicContact CG-CB 4.44Å; G1066-V1070 WeakPolarHBondContact O-CB 3.37Å; G1066-V1070 WeakPolarHBondContact O-CG2 3.35Å; G1066-V1070 PolarHBondContact O-N 2.75Å; V1068-V1070 PolarHBondContact O-N 2.71Å; V1070-T1072 VanDerWaalsContact C-N 3.33Å; V1070-T1072 PolarHBondContact O-N 3.27Å; V1070-A1073 PolarHBondContact O-N 2.85Å; V1070-C1074 PolarHBondContact O-N 2.84Å; V1070-C1074 VanDerWaalsContact O-N 3.09Å; V1070-C1074 PolarHBondContact O-SG 3.42Å
1071	P	94.4	Very high	91.9	Very high	3 Å²	3	62.7 Å²	62.7	2%	0.019	30%	0.303	C	S	.	.	H	α-helix	trans	-61.3	-38.8	173.6	-24.6	36.7	0	0	0	113	V1002 T1003 L1006 G1066 L1067 C1074 L1075	V1002-P1071 HydrophobicContact CB-CG 4.4Å; V1002-P1071 HydrophobicContact CG1-CB 4.19Å; V1002-P1071 HydrophobicContact CG1-CG 3.88Å; T1003-P1071 WeakPolarHBondContact OG1-CA 3.01Å; T1003-P1071 WeakPolarHBondContact OG1-CB 3.5Å; L1006-P1071 HydrophobicContact CD1-CB 4.34Å; G1066-P1071 WeakPolarHBondContact O-CD 3.5Å; L1067-P1071 WeakPolarHBondContact O-CD 3.36Å; L1067-P1071 WeakPolarHBondContact O-CG 3.28Å; P1071-C1074 PolarHBondContact O-N 3.45Å; P1071-L1075 WeakPolarHBondContact O-CB 3.2Å; P1071-L1075 VanDerWaalsContact O-CG 3.24Å; P1071-L1075 WeakPolarHBondContact O-CG 3.41Å; P1071-L1075 PolarHBondContact O-N 3.19Å
1072	T	93.8	Very high	91.9	Very high	84 Å²	84	57.5 Å²	57.5	52%	0.515	29%	0.293	S	S	.	.	H	α-helix	trans	-63	-43.5	174.8	-65.6	0	0	0	0	111.7	V1068 V1070 C1074 L1075 L1076	V1068-T1072 WeakPolarHBondContact O-CB 3.5Å; V1068-T1072 PolarHBondContact O-N 2.66Å; V1068-T1072 PolarHBondContact O-OG1 3.08Å; V1068-T1072 VanDerWaalsContact O-OG1 3.07Å; V1070-T1072 VanDerWaalsContact C-N 3.33Å; V1070-T1072 PolarHBondContact O-N 3.27Å; T1072-C1074 PolarHBondContact O-N 3.24Å; T1072-L1075 PolarHBondContact O-N 3.19Å; T1072-L1076 VanDerWaalsContact O-CB 3.23Å; T1072-L1076 WeakPolarHBondContact O-CB 3.24Å; T1072-L1076 PolarHBondContact O-N 3.47Å
1073	A	94	Very high	91.9	Very high	41 Å²	41	55.9 Å²	55.9	34%	0.339	30%	0.295	S	S	.	.	H	α-helix	trans	-61.6	-41.1	178.3	0	0	0	0	0	112.7	I966 L1069 V1070	I966-A1073 HydrophobicContact CG2-CB 4.29Å; L1069-A1073 VanDerWaalsContact O-CB 3.29Å; L1069-A1073 WeakPolarHBondContact O-CB 3.26Å; L1069-A1073 PolarHBondContact O-N 2.68Å; V1070-A1073 PolarHBondContact O-N 2.85Å
1074	C	93.6	Very high	91.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.7	-51.9	173.1	-64.4	0	0	0	0	111.9	H963 I966 T1003 V1070 P1071 T1072	H963-C1074 PolarHBondContact NE2-O 3.09Å; I966-C1074 VanDerWaalsContact CG2-SG 3.54Å; T1003-C1074 HydrophobicContact CG2-CB 3.72Å; V1070-C1074 PolarHBondContact O-N 2.84Å; V1070-C1074 VanDerWaalsContact O-N 3.09Å; V1070-C1074 PolarHBondContact O-SG 3.42Å; P1071-C1074 PolarHBondContact O-N 3.45Å; T1072-C1074 PolarHBondContact O-N 3.24Å
1075	L	94.1	Very high	91.7	Very high	17 Å²	17	59.5 Å²	59.5	9%	0.089	32%	0.317	C	S	.	.	H	α-helix	trans	-79.6	-19.9	-168.7	-61.1	174.7	0	0	0	113.8	T1003 L1006 K1007 M1010 P1071 T1072 K1077 D1078 F1079	T1003-L1075 HydrophobicContact CG2-CD2 4.12Å; T1003-L1075 HydrophobicContact CG2-CG 4.17Å; L1006-L1075 HydrophobicContact CB-CD1 3.52Å; L1006-L1075 HydrophobicContact CD1-CD1 4.12Å; L1006-L1075 HydrophobicContact CG-CD1 4.49Å; K1007-L1075 HydrophobicContact CB-CD2 3.92Å; K1007-L1075 HydrophobicContact CD-CD2 4.11Å; M1010-L1075 HydrophobicContact SD-CB 4Å; M1010-L1075 HydrophobicContact SD-CD1 4.23Å; M1010-L1075 HydrophobicContact SD-CD2 3.93Å; M1010-L1075 HydrophobicContact SD-CG 4.26Å; P1071-L1075 WeakPolarHBondContact O-CB 3.2Å; P1071-L1075 VanDerWaalsContact O-CG 3.24Å; P1071-L1075 WeakPolarHBondContact O-CG 3.41Å; P1071-L1075 PolarHBondContact O-N 3.19Å; T1072-L1075 PolarHBondContact O-N 3.19Å; L1075-K1077 VanDerWaalsContact C-N 3.29Å; L1075-K1077 PolarHBondContact O-N 2.87Å; L1075-D1078 PolarHBondContact O-N 3.33Å; L1075-D1078 VanDerWaalsContact O-N 3.09Å; L1075-F1079 WeakPolarHBondContact O-CB 3.24Å; L1075-F1079 PolarHBondContact O-N 2.91Å
1076	L	93.4	Very high	91.3	Very high	110 Å²	110	61.9 Å²	61.9	58%	0.576	32%	0.322	S	S	*	.	H	α-helix	trans	-55.5	-42.2	178.3	178.2	61.7	0	0	0	112.3	T1072 F1079 A1080	T1072-L1076 VanDerWaalsContact O-CB 3.23Å; T1072-L1076 WeakPolarHBondContact O-CB 3.24Å; T1072-L1076 PolarHBondContact O-N 3.47Å; L1076-F1079 PolarHBondContact O-N 3.07Å; L1076-A1080 VanDerWaalsContact O-CB 3.29Å; L1076-A1080 WeakPolarHBondContact O-CB 3.4Å; L1076-A1080 PolarHBondContact O-N 3.23Å
1077	K	91.1	Very high	91.1	Very high	85 Å²	85	66.9 Å²	66.9	37%	0.37	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-43.7	176.9	-174.5	-169.9	58.4	53.5	0	111.7	N959 L1075 W1081	N959-K1077 WeakPolarHBondContact OD1-CE 3.36Å; N959-K1077 PolarHBondContact OD1-NZ 3.29Å; L1075-K1077 VanDerWaalsContact C-N 3.29Å; L1075-K1077 PolarHBondContact O-N 2.87Å; K1077-W1081 WeakPolarHBondContact O-CB 3.42Å; K1077-W1081 PolarHBondContact O-N 2.92Å
1078	D	91.1	Very high	90.8	Very high	10 Å²	10	71.6 Å²	71.6	5%	0.053	38%	0.377	C	S	.	.	H	α-helix	trans	-70.6	-37.9	-179.3	-80.6	8	0	0	0	111.9	N959 H963 K1007 M1010 L1075 A1082	N959-D1078 PolarHBondContact ND2-OD1 3.18Å; N959-D1078 PolarHBondContact ND2-OD2 3.39Å; N959-D1078 PolarHBondContact OD1-OD1 3.22Å; H963-D1078 IonicContact CE1-OD2 2.69Å; H963-D1078 IonicContact NE2-OD1 3.91Å; H963-D1078 IonicContact NE2-OD2 3.66Å; K1007-D1078 VanDerWaalsContact CE-OD2 3.29Å; K1007-D1078 WeakPolarHBondContact CE-OD2 3.34Å; K1007-D1078 IonicContact NZ-OD2 3.76Å; K1007-D1078 PolarHBondContact NZ-OD2 3.1Å; M1010-D1078 HydrophobicContact CE-CB 3.99Å; L1075-D1078 PolarHBondContact O-N 3.33Å; L1075-D1078 VanDerWaalsContact O-N 3.09Å; D1078-A1082 VanDerWaalsContact O-CB 3.28Å; D1078-A1082 WeakPolarHBondContact O-CB 3.39Å; D1078-A1082 PolarHBondContact O-N 3.46Å
1079	F	91.8	Very high	90.3	Very high	133 Å²	133	77 Å²	77	58%	0.583	39%	0.387	S	S	*	.	H	α-helix	trans	-64.6	-48.4	174	-178.4	-97.6	0	0	0	111.1	M1010 L1075 L1076 W1081 A1082 A1083	M1010-F1079 HydrophobicContact CE-CB 3.82Å; M1010-F1079 HydrophobicContact CE-CD2 4.5Å; L1075-F1079 WeakPolarHBondContact O-CB 3.24Å; L1075-F1079 PolarHBondContact O-N 2.91Å; L1076-F1079 PolarHBondContact O-N 3.07Å; F1079-W1081 VanDerWaalsContact C-N 3.34Å; F1079-W1081 PolarHBondContact O-N 3.47Å; F1079-A1082 PolarHBondContact O-N 2.87Å; F1079-A1083 VanDerWaalsContact O-CB 3.3Å; F1079-A1083 WeakPolarHBondContact O-CB 3.34Å; F1079-A1083 PolarHBondContact O-N 3.26Å
1080	A	92.1	Very high	89.7	Confident	45 Å²	45	77.4 Å²	77.4	37%	0.372	39%	0.386	S	S	.	.	H	α-helix	trans	-60.5	-42.1	177.2	0	0	0	0	0	112	L1076 T1084	L1076-A1080 VanDerWaalsContact O-CB 3.29Å; L1076-A1080 WeakPolarHBondContact O-CB 3.4Å; L1076-A1080 PolarHBondContact O-N 3.23Å; A1080-T1084 WeakPolarHBondContact O-CB 3.39Å; A1080-T1084 PolarHBondContact O-N 3.41Å; A1080-T1084 PolarHBondContact O-OG1 3.31Å
1081	W	89.8	Confident	89.1	Confident	180 Å²	180	79.5 Å²	79.5	68%	0.682	40%	0.398	S	S	*	.	H	α-helix	trans	-63.4	-48.4	174.8	175.6	-108.5	0	0	0	112.4	K1077 F1079 T1084 R1085	K1077-W1081 WeakPolarHBondContact O-CB 3.42Å; K1077-W1081 PolarHBondContact O-N 2.92Å; F1079-W1081 VanDerWaalsContact C-N 3.34Å; F1079-W1081 PolarHBondContact O-N 3.47Å; W1081-T1084 PolarHBondContact O-N 3.44Å; W1081-R1085 WeakPolarHBondContact O-CB 3.24Å; W1081-R1085 PolarHBondContact O-N 2.87Å
1082	A	86.8	Confident	88.5	Confident	44 Å²	44	82 Å²	82	36%	0.364	41%	0.411	S	S	.	.	H	α-helix	trans	-62.3	-45.6	179.6	0	0	0	0	0	112	D1078 F1079 R1086	D1078-A1082 VanDerWaalsContact O-CB 3.28Å; D1078-A1082 WeakPolarHBondContact O-CB 3.39Å; D1078-A1082 PolarHBondContact O-N 3.46Å; F1079-A1082 PolarHBondContact O-N 2.87Å; A1082-R1086 WeakPolarHBondContact O-CB 3.35Å; A1082-R1086 PolarHBondContact O-N 2.94Å
1083	A	89.1	Confident	87.9	Confident	39 Å²	39	79.2 Å²	79.2	32%	0.322	39%	0.393	S	S	.	.	H	α-helix	trans	-62.9	-45.8	176.1	0	0	0	0	0	111.9	F1079 R1086 T1087	F1079-A1083 VanDerWaalsContact O-CB 3.3Å; F1079-A1083 WeakPolarHBondContact O-CB 3.34Å; F1079-A1083 PolarHBondContact O-N 3.26Å; A1083-R1086 PolarHBondContact O-N 2.77Å; A1083-T1087 WeakPolarHBondContact O-CB 3.28Å; A1083-T1087 PolarHBondContact O-N 2.94Å; A1083-T1087 PolarHBondContact O-OG1 3.46Å
1084	T	89.2	Confident	87.5	Confident	73 Å²	73	78.2 Å²	78.2	45%	0.448	38%	0.381	S	S	.	.	H	α-helix	trans	-62.7	-45.5	178.6	-58.5	0	0	0	0	111.4	A1080 W1081 T1087 L1088	A1080-T1084 WeakPolarHBondContact O-CB 3.39Å; A1080-T1084 PolarHBondContact O-N 3.41Å; A1080-T1084 PolarHBondContact O-OG1 3.31Å; W1081-T1084 PolarHBondContact O-N 3.44Å; T1084-T1087 PolarHBondContact O-N 3.02Å; T1084-L1088 HydrophobicContact CG2-CD1 3.78Å; T1084-L1088 HydrophobicContact CG2-CG 4.45Å; T1084-L1088 WeakPolarHBondContact O-CB 3.23Å; T1084-L1088 WeakPolarHBondContact O-CG 3.48Å; T1084-L1088 PolarHBondContact O-N 2.9Å
1085	R	87.4	Confident	87	Confident	123 Å²	123	80.3 Å²	80.3	46%	0.464	39%	0.391	S	S	.	.	H	α-helix	trans	-60.4	-52.3	176.3	178.5	-178.9	168.1	178.6	-2.1	111.2	W1081 T1087 L1088 R1089	W1081-R1085 WeakPolarHBondContact O-CB 3.24Å; W1081-R1085 PolarHBondContact O-N 2.87Å; R1085-T1087 PolarHBondContact O-N 2.92Å; R1085-L1088 PolarHBondContact O-N 3.09Å; R1085-R1089 CarbonylContact O-C 3.26Å; R1085-R1089 VanDerWaalsContact O-C 3.26Å; R1085-R1089 WeakPolarHBondContact O-CA 3.39Å; R1085-R1089 PolarHBondContact O-N 3.23Å
1086	R	84.2	Confident	86.5	Confident	109 Å²	109	79.5 Å²	79.5	41%	0.411	39%	0.387	S	S	.	.	H	α-helix	trans	-64.2	-25.7	179.9	-79	-178.6	162.6	-163.3	-12	113.5	A1082 A1083 K1090 E1094 Q1097	A1082-R1086 WeakPolarHBondContact O-CB 3.35Å; A1082-R1086 PolarHBondContact O-N 2.94Å; A1083-R1086 PolarHBondContact O-N 2.77Å; R1086-K1090 WeakPolarHBondContact O-CE 3.43Å; R1086-K1090 WeakPolarHBondContact O-CG 3.43Å; R1086-E1094 VanDerWaalsContact CG-OE1 3.22Å; R1086-E1094 WeakPolarHBondContact CG-OE1 3.31Å; R1086-E1094 IonicContact NE-OE1 2.72Å; R1086-E1094 PolarHBondContact NE-OE1 3.21Å; R1086-E1094 VanDerWaalsContact NE-OE1 3.1Å; R1086-Q1097 VanDerWaalsContact NH2-OE1 3.12Å
1087	T	86.4	Confident	86.1	Confident	104 Å²	104	76 Å²	76	64%	0.638	37%	0.368	S	S	*	.	H	α-helix	trans	-81.7	-43.5	176.1	-52.9	0	0	0	0	112.1	A1083 T1084 R1085	A1083-T1087 WeakPolarHBondContact O-CB 3.28Å; A1083-T1087 PolarHBondContact O-N 2.94Å; A1083-T1087 PolarHBondContact O-OG1 3.46Å; T1084-T1087 PolarHBondContact O-N 3.02Å; R1085-T1087 PolarHBondContact O-N 2.92Å
1088	L	86.3	Confident	85.7	Confident	132 Å²	132	74.4 Å²	74.4	69%	0.691	36%	0.362	S	S	*	.	H	α-helix	trans	-101.1	-22.8	-168.4	-59	-179	0	0	0	115.4	T1084 R1085	T1084-L1088 HydrophobicContact CG2-CD1 3.78Å; T1084-L1088 HydrophobicContact CG2-CG 4.45Å; T1084-L1088 WeakPolarHBondContact O-CB 3.23Å; T1084-L1088 WeakPolarHBondContact O-CG 3.48Å; T1084-L1088 PolarHBondContact O-N 2.9Å; R1085-L1088 PolarHBondContact O-N 3.09Å
1089	R	81.4	Confident	85.3	Confident	206 Å²	206	75.5 Å²	75.5	78%	0.777	37%	0.367	S	S	*	.	S	Bend	trans	-146.8	67.7	-175.6	-67.9	-170.5	180	-179.3	0.6	111.2	R1085	R1085-R1089 CarbonylContact O-C 3.26Å; R1085-R1089 VanDerWaalsContact O-C 3.26Å; R1085-R1089 WeakPolarHBondContact O-CA 3.39Å; R1085-R1089 PolarHBondContact O-N 3.23Å
1090	K	80.8	Confident	84.9	Confident	88 Å²	88	72.4 Å²	72.4	38%	0.383	36%	0.355	S	S	.	.			trans	-63	137.3	173.3	-63.1	-176.2	-171.3	-170.3	0	111	R1086 E1098	R1086-K1090 WeakPolarHBondContact O-CE 3.43Å; R1086-K1090 WeakPolarHBondContact O-CG 3.43Å; K1090-E1098 WeakPolarHBondContact CE-OE1 3.45Å; K1090-E1098 IonicContact NZ-OE1 3.93Å; K1090-E1098 PolarHBondContact NZ-OE1 3.37Å; K1090-E1098 IonicContact NZ-OE2 2.91Å; K1090-E1098 PolarHBondContact NZ-OE2 3.19Å
1091	T	81.4	Confident	84.3	Confident	43 Å²	43	74.7 Å²	74.7	26%	0.264	37%	0.373	S	S	.	.			trans	-82.9	160.8	162.2	59.2	0	0	0	0	110.6	L1093 E1094 E1095	T1091-L1093 PolarHBondContact O-N 3.45Å; T1091-E1094 WeakPolarHBondContact CB-OE2 3.31Å; T1091-E1094 WeakPolarHBondContact CG2-OE2 3.39Å; T1091-E1094 PolarHBondContact N-OE2 2.84Å; T1091-E1094 PolarHBondContact O-N 2.99Å; T1091-E1094 WeakPolarHBondContact OG1-CG 3.28Å; T1091-E1094 PolarHBondContact OG1-N 3.45Å; T1091-E1094 PolarHBondContact OG1-OE2 3.09Å; T1091-E1095 PolarHBondContact O-N 3.3Å
1092	L	80.6	Confident	83.9	Confident	56 Å²	56	73.6 Å²	73.6	29%	0.293	37%	0.369	S	S	.	.	H	α-helix	trans	-55.6	-38.3	176.9	-176.8	65.3	0	0	0	112.1	Q937 L938 E1095 V1096 V1110	Q937-L1092 HydrophobicContact CB-CD2 4.31Å; L938-L1092 HydrophobicContact CD2-CB 4.45Å; L938-L1092 HydrophobicContact CD2-CD2 4.14Å; L938-L1092 HydrophobicContact CD2-CG 3.94Å; L1092-E1095 PolarHBondContact O-N 3.32Å; L1092-V1096 WeakPolarHBondContact O-CG2 3.36Å; L1092-V1096 PolarHBondContact O-N 3.29Å; L1092-V1110 HydrophobicContact CD1-CG2 4.32Å
1093	L	82.3	Confident	83.5	Confident	26 Å²	26	76.2 Å²	76.2	14%	0.136	39%	0.39	C	S	.	.	H	α-helix	trans	-62.4	-40.9	175.2	179.4	63.5	0	0	0	112.3	P926 C927 L938 I941 T1091 Q1097	P926-L1093 HydrophobicContact CB-CD1 4.45Å; P926-L1093 HydrophobicContact CB-CD2 4.24Å; C927-L1093 HydrophobicContact CB-CD1 4.02Å; L938-L1093 HydrophobicContact CD2-CB 4.19Å; L938-L1093 HydrophobicContact CD2-CD1 4.29Å; I941-L1093 HydrophobicContact CD1-CB 3.86Å; T1091-L1093 PolarHBondContact O-N 3.45Å; L1093-Q1097 WeakPolarHBondContact O-CB 3.47Å; L1093-Q1097 VanDerWaalsContact O-CG 3.22Å; L1093-Q1097 WeakPolarHBondContact O-CG 3.46Å; L1093-Q1097 PolarHBondContact O-N 2.89Å
1094	E	84.5	Confident	82.8	Confident	20 Å²	20	78.1 Å²	78.1	9%	0.093	40%	0.398	C	S	.	.	H	α-helix	trans	-72.2	-32.3	178.1	-70.3	166.9	124.6	0	0	112.4	R1086 T1091 E1098	R1086-E1094 VanDerWaalsContact CG-OE1 3.22Å; R1086-E1094 WeakPolarHBondContact CG-OE1 3.31Å; R1086-E1094 IonicContact NE-OE1 2.72Å; R1086-E1094 PolarHBondContact NE-OE1 3.21Å; R1086-E1094 VanDerWaalsContact NE-OE1 3.1Å; T1091-E1094 WeakPolarHBondContact CB-OE2 3.31Å; T1091-E1094 WeakPolarHBondContact CG2-OE2 3.39Å; T1091-E1094 PolarHBondContact N-OE2 2.84Å; T1091-E1094 PolarHBondContact O-N 2.99Å; T1091-E1094 WeakPolarHBondContact OG1-CG 3.28Å; T1091-E1094 PolarHBondContact OG1-N 3.45Å; T1091-E1094 PolarHBondContact OG1-OE2 3.09Å; E1094-E1098 PolarHBondContact O-N 3.4Å
1095	E	83.3	Confident	81.9	Confident	44 Å²	44	78.7 Å²	78.7	21%	0.206	40%	0.398	C	S	.	.	H	α-helix	trans	-69.3	-40.1	173.5	-170.6	159.7	-137.4	0	0	111.8	T1091 L1092 E1098 L1099 A1109 R1112	T1091-E1095 PolarHBondContact O-N 3.3Å; L1092-E1095 PolarHBondContact O-N 3.32Å; E1095-E1098 PolarHBondContact O-N 3.28Å; E1095-L1099 HydrophobicContact CG-CD1 4.35Å; E1095-L1099 WeakPolarHBondContact O-CG 3.46Å; E1095-L1099 PolarHBondContact O-N 2.66Å; E1095-A1109 HydrophobicContact CG-CB 3.84Å; E1095-R1112 IonicContact OE1-CZ 3.55Å; E1095-R1112 IonicContact OE1-NH1 3.92Å; E1095-R1112 PolarHBondContact OE1-NH1 3.26Å; E1095-R1112 IonicContact OE1-NH2 3.66Å; E1095-R1112 IonicContact OE2-NH1 3.97Å; E1095-R1112 PolarHBondContact OE2-NH1 2.89Å
1096	V	84	Confident	80.9	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-65.4	-43.2	171.8	174.7	0	0	0	0	111.4	N931 L938 L1092 E1098 L1099 E1100 P1106 V1110	N931-V1096 HydrophobicContact CB-CG1 4.28Å; L938-V1096 HydrophobicContact CD1-CG1 4.49Å; L938-V1096 HydrophobicContact CD2-CG2 4.36Å; L1092-V1096 WeakPolarHBondContact O-CG2 3.36Å; L1092-V1096 PolarHBondContact O-N 3.29Å; V1096-E1098 VanDerWaalsContact C-N 3.33Å; V1096-E1098 PolarHBondContact O-N 3.32Å; V1096-L1099 PolarHBondContact O-N 2.75Å; V1096-E1100 WeakPolarHBondContact O-CB 3.41Å; V1096-E1100 PolarHBondContact O-N 3.48Å; V1096-P1106 HydrophobicContact CG1-CB 4.16Å; V1096-P1106 HydrophobicContact CG1-CG 4.46Å; V1096-P1106 HydrophobicContact CG2-CB 4.32Å; V1096-V1110 HydrophobicContact CG2-CG2 4.18Å
1097	Q	83.8	Confident	79.8	Confident	36 Å²	36	68.8 Å²	68.8	17%	0.168	37%	0.367	C	S	.	.	H	α-helix	trans	-56.1	-43.6	174.4	-79.2	170.7	5.1	0	0	112.5	P926 R1086 L1093 A1101	P926-Q1097 VanDerWaalsContact O-CG 3.32Å; P926-Q1097 WeakPolarHBondContact O-CG 3.37Å; P926-Q1097 PolarHBondContact O-NE2 2.92Å; R1086-Q1097 VanDerWaalsContact NH2-OE1 3.12Å; L1093-Q1097 WeakPolarHBondContact O-CB 3.47Å; L1093-Q1097 VanDerWaalsContact O-CG 3.22Å; L1093-Q1097 WeakPolarHBondContact O-CG 3.46Å; L1093-Q1097 PolarHBondContact O-N 2.89Å; Q1097-A1101 WeakPolarHBondContact O-CB 3.43Å; Q1097-A1101 PolarHBondContact O-N 2.86Å
1098	E	83.1	Confident	78.4	Confident	52 Å²	52	67.7 Å²	67.7	24%	0.243	37%	0.368	C	S	.	.	H	α-helix	trans	-67	-33.5	179.1	-88.1	-172.5	-135.4	0	0	113.6	K1090 E1094 E1095 V1096 R1102	K1090-E1098 WeakPolarHBondContact CE-OE1 3.45Å; K1090-E1098 IonicContact NZ-OE1 3.93Å; K1090-E1098 PolarHBondContact NZ-OE1 3.37Å; K1090-E1098 IonicContact NZ-OE2 2.91Å; K1090-E1098 PolarHBondContact NZ-OE2 3.19Å; E1094-E1098 PolarHBondContact O-N 3.4Å; E1095-E1098 PolarHBondContact O-N 3.28Å; V1096-E1098 VanDerWaalsContact C-N 3.33Å; V1096-E1098 PolarHBondContact O-N 3.32Å; E1098-R1102 WeakPolarHBondContact O-CD 3.27Å; E1098-R1102 WeakPolarHBondContact O-CG 3.43Å; E1098-R1102 PolarHBondContact O-N 3.37Å; E1098-R1102 IonicContact OE2-CZ 3.41Å; E1098-R1102 IonicContact OE2-NH2 2.74Å; E1098-R1102 PolarHBondContact OE2-NH2 2.96Å
1099	L	82.7	Confident	77	Confident	33 Å²	33	61.7 Å²	61.7	17%	0.173	34%	0.338	C	S	.	.	H	α-helix	trans	-78.5	-41.6	179.4	-67.5	167.9	0	0	0	110.9	E1095 V1096 A1101 R1102 A1103 V1104 P1106 A1109	E1095-L1099 HydrophobicContact CG-CD1 4.35Å; E1095-L1099 WeakPolarHBondContact O-CG 3.46Å; E1095-L1099 PolarHBondContact O-N 2.66Å; V1096-L1099 PolarHBondContact O-N 2.75Å; L1099-A1101 PolarHBondContact O-N 3.05Å; L1099-R1102 CarbonylContact O-C 3.51Å; L1099-R1102 PolarHBondContact O-N 3.32Å; L1099-A1103 PolarHBondContact O-N 3.29Å; L1099-A1103 VanDerWaalsContact O-N 3.13Å; L1099-V1104 CarbonylContact C-O 3.55Å; L1099-V1104 HydrophobicContact CD2-CB 4.25Å; L1099-V1104 HydrophobicContact CD2-CG1 4.14Å; L1099-V1104 PolarHBondContact O-N 3.44Å; L1099-P1106 HydrophobicContact CB-CB 4.05Å; L1099-P1106 HydrophobicContact CD1-CB 4.23Å; L1099-A1109 HydrophobicContact CD1-CB 3.68Å
1100	E	83.1	Confident	75.7	Confident	68 Å²	68	53 Å²	53	32%	0.318	31%	0.308	S	S	.	.	H	α-helix	trans	-58.3	-46.2	171	-176.1	171.6	172.4	0	0	111.6	C927 S928 N931 V1096 R1102 A1103	C927-E1100 PolarHBondContact SG-OE2 3Å; S928-E1100 WeakPolarHBondContact CB-OE1 3.38Å; S928-E1100 PolarHBondContact N-OE1 3.4Å; S928-E1100 PolarHBondContact N-OE2 3.24Å; S928-E1100 PolarHBondContact OG-OE1 2.69Å; S928-E1100 PolarHBondContact OG-OE2 3.45Å; N931-E1100 VanDerWaalsContact ND2-CD 3.28Å; N931-E1100 PolarHBondContact ND2-OE2 2.86Å; V1096-E1100 WeakPolarHBondContact O-CB 3.41Å; V1096-E1100 PolarHBondContact O-N 3.48Å; E1100-R1102 PolarHBondContact O-N 3.12Å; E1100-R1102 VanDerWaalsContact O-N 3.16Å; E1100-A1103 PolarHBondContact O-N 3.03Å
1101	A	81	Confident	74.3	Confident	92 Å²	92	53.7 Å²	53.7	76%	0.76	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-14	176.4	0	0	0	0	0	114.3	Q1097 L1099	Q1097-A1101 WeakPolarHBondContact O-CB 3.43Å; Q1097-A1101 PolarHBondContact O-N 2.86Å; L1099-A1101 PolarHBondContact O-N 3.05Å
1102	R	81.1	Confident	72.9	Confident	157 Å²	157	57.4 Å²	57.4	59%	0.592	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-0.7	172.9	-69.7	172.8	-168.7	163.3	16.1	113.2	E1098 L1099 E1100 V1104	E1098-R1102 WeakPolarHBondContact O-CD 3.27Å; E1098-R1102 WeakPolarHBondContact O-CG 3.43Å; E1098-R1102 PolarHBondContact O-N 3.37Å; E1098-R1102 IonicContact OE2-CZ 3.41Å; E1098-R1102 IonicContact OE2-NH2 2.74Å; E1098-R1102 PolarHBondContact OE2-NH2 2.96Å; L1099-R1102 CarbonylContact O-C 3.51Å; L1099-R1102 PolarHBondContact O-N 3.32Å; E1100-R1102 PolarHBondContact O-N 3.12Å; E1100-R1102 VanDerWaalsContact O-N 3.16Å; R1102-V1104 HydrophobicContact CB-CB 4.5Å; R1102-V1104 HydrophobicContact CB-CG2 3.98Å; R1102-V1104 PolarHBondContact O-N 3.34Å
1103	A	77.3	Confident	70.9	Confident	99 Å²	99	58.9 Å²	58.9	82%	0.818	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	31.8	-169.9	0	0	0	0	0	113.9	L1099 E1100	L1099-A1103 PolarHBondContact O-N 3.29Å; L1099-A1103 VanDerWaalsContact O-N 3.13Å; E1100-A1103 PolarHBondContact O-N 3.03Å
1104	V	75.7	Confident	68.8	Low	79 Å²	79	63.4 Å²	63.4	48%	0.479	37%	0.367	S	S	.	.			trans	-100.4	140.7	175.1	176.1	0	0	0	0	108.7	L1099 R1102 P1106	L1099-V1104 CarbonylContact C-O 3.55Å; L1099-V1104 HydrophobicContact CD2-CB 4.25Å; L1099-V1104 HydrophobicContact CD2-CG1 4.14Å; L1099-V1104 PolarHBondContact O-N 3.44Å; R1102-V1104 HydrophobicContact CB-CB 4.5Å; R1102-V1104 HydrophobicContact CB-CG2 3.98Å; R1102-V1104 PolarHBondContact O-N 3.34Å; V1104-P1106 WeakPolarHBondContact O-CD 3.45Å; V1104-P1106 VanDerWaalsContact O-N 3.14Å
1105	D	70.1	Confident	66.4	Low	86 Å²	86	66.4 Å²	66.4	46%	0.46	39%	0.39	S	S	.	.			trans	-59.5	115.7	178.5	-171.9	-14.2	0	0	0	111.3	R934 G1107	R934-D1105 IonicContact CZ-OD1 2.77Å; R934-D1105 IonicContact CZ-OD2 2.72Å; R934-D1105 VanDerWaalsContact NH1-CG 3.29Å; R934-D1105 IonicContact NH1-OD1 2.92Å; R934-D1105 PolarHBondContact NH1-OD1 3.32Å; R934-D1105 IonicContact NH1-OD2 3.63Å; R934-D1105 PolarHBondContact NH1-OD2 2.9Å; R934-D1105 IonicContact NH2-OD1 2.71Å; R934-D1105 PolarHBondContact NH2-OD1 3.29Å; R934-D1105 IonicContact NH2-OD2 3.97Å; R934-D1105 PolarHBondContact NH2-OD2 2.98Å; D1105-G1107 PolarHBondContact O-N 2.95Å; D1105-G1107 PolarHBondContact OD1-N 3.47Å
1106	P	65.7	Low	64.3	Low	6 Å²	6	67.3 Å²	67.3	4%	0.039	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-7.3	178	28.9	-37.2	0	0	0	115	F935 V1096 L1099 V1104 A1108 A1109	F935-P1106 HydrophobicContact CD2-CG 4.38Å; F935-P1106 HydrophobicContact CE2-CB 4.22Å; F935-P1106 HydrophobicContact CE2-CG 3.49Å; F935-P1106 VanDerWaalsContact CE2-CG 3.49Å; F935-P1106 HydrophobicContact CZ-CB 4.46Å; F935-P1106 HydrophobicContact CZ-CG 3.91Å; V1096-P1106 HydrophobicContact CG1-CB 4.16Å; V1096-P1106 HydrophobicContact CG1-CG 4.46Å; V1096-P1106 HydrophobicContact CG2-CB 4.32Å; L1099-P1106 HydrophobicContact CB-CB 4.05Å; L1099-P1106 HydrophobicContact CD1-CB 4.23Å; V1104-P1106 WeakPolarHBondContact O-CD 3.45Å; V1104-P1106 VanDerWaalsContact O-N 3.14Å; P1106-A1108 PolarHBondContact O-N 2.84Å; P1106-A1108 VanDerWaalsContact O-N 3.11Å; P1106-A1109 WeakPolarHBondContact O-CB 3.43Å; P1106-A1109 PolarHBondContact O-N 3.48Å
1107	G	60.9	Low	61.9	Low	17 Å²	17	76.5 Å²	76.5	18%	0.175	45%	0.445	C	S	.	.	H	α-helix	trans	-52.7	-35.5	-175.7	0	0	0	0	0	114.8	D1105 A1109 V1110	D1105-G1107 PolarHBondContact O-N 2.95Å; D1105-G1107 PolarHBondContact OD1-N 3.47Å; G1107-A1109 VanDerWaalsContact C-N 3.31Å; G1107-A1109 PolarHBondContact O-N 3.44Å; G1107-V1110 PolarHBondContact O-N 3.47Å
1108	A	56.7	Low	59.4	Low	81 Å²	81	79.2 Å²	79.2	67%	0.669	47%	0.468	S	S	*	.	H	α-helix	trans	-67.8	-24.8	178.4	0	0	0	0	0	114.2	P1106	P1106-A1108 PolarHBondContact O-N 2.84Å; P1106-A1108 VanDerWaalsContact O-N 3.11Å
1109	A	56.6	Low	57.1	Low	6 Å²	6	79.4 Å²	79.4	5%	0.05	47%	0.471	C	S	.	.	H	α-helix	trans	-77.3	-38.5	178.8	0	0	0	0	0	112.3	E1095 L1099 P1106 G1107 L1111 R1112	E1095-A1109 HydrophobicContact CG-CB 3.84Å; L1099-A1109 HydrophobicContact CD1-CB 3.68Å; P1106-A1109 WeakPolarHBondContact O-CB 3.43Å; P1106-A1109 PolarHBondContact O-N 3.48Å; G1107-A1109 VanDerWaalsContact C-N 3.31Å; G1107-A1109 PolarHBondContact O-N 3.44Å; A1109-L1111 PolarHBondContact O-N 3.11Å; A1109-R1112 WeakPolarHBondContact O-CB 3.5Å; A1109-R1112 PolarHBondContact O-N 3.04Å
1110	V	55.3	Low	55.1	Low	24 Å²	24	83.9 Å²	83.9	15%	0.145	50%	0.495	C	S	.	.	H	α-helix	trans	-75.6	-13.6	-175	-169.1	0	0	0	0	112.5	F935 L1092 V1096 G1107 R1112	F935-V1110 HydrophobicContact CB-CG1 4.5Å; F935-V1110 HydrophobicContact CB-CG2 4.24Å; F935-V1110 HydrophobicContact CD1-CB 3.8Å; F935-V1110 HydrophobicContact CD1-CG1 3.93Å; F935-V1110 HydrophobicContact CD1-CG2 3.48Å; F935-V1110 VanDerWaalsContact CD1-CG2 3.48Å; F935-V1110 HydrophobicContact CE1-CB 4.21Å; F935-V1110 HydrophobicContact CE1-CG2 3.95Å; F935-V1110 HydrophobicContact CG-CG2 3.81Å; L1092-V1110 HydrophobicContact CD1-CG2 4.32Å; V1096-V1110 HydrophobicContact CG2-CG2 4.18Å; G1107-V1110 PolarHBondContact O-N 3.47Å; V1110-R1112 PolarHBondContact O-N 3.37Å
1111	L	51.4	Low	53.1	Low	102 Å²	102	88.3 Å²	88.3	53%	0.534	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-2.6	169.5	-70.3	171.8	0	0	0	114.1	A1109 D1113	A1109-L1111 PolarHBondContact O-N 3.11Å; L1111-D1113 PolarHBondContact O-N 3.3Å
1112	R	51.5	Low	51.1	Low	122 Å²	122	94 Å²	94	46%	0.46	52%	0.518	S	S	.	.			trans	-78.7	102.1	168.2	-70.4	178.5	175.8	157	2.3	110.4	E1095 A1109 V1110	E1095-R1112 IonicContact OE1-CZ 3.55Å; E1095-R1112 IonicContact OE1-NH1 3.92Å; E1095-R1112 PolarHBondContact OE1-NH1 3.26Å; E1095-R1112 IonicContact OE1-NH2 3.66Å; E1095-R1112 IonicContact OE2-NH1 3.97Å; E1095-R1112 PolarHBondContact OE2-NH1 2.89Å; A1109-R1112 WeakPolarHBondContact O-CB 3.5Å; A1109-R1112 PolarHBondContact O-N 3.04Å; V1110-R1112 PolarHBondContact O-N 3.37Å
1113	D	38.2	Very low	49	Very low	86 Å²	86	88 Å²	88	46%	0.46	50%	0.501	S	S	.	.			trans	-59.1	157.9	169.9	-176.2	23.1	0	0	0	111.5	L1111 S1115 G1116	L1111-D1113 PolarHBondContact O-N 3.3Å; D1113-S1115 PolarHBondContact O-N 3.35Å; D1113-G1116 PolarHBondContact O-N 2.94Å
1114	S	38.2	Very low	47.2	Very low	122 Å²	122	87.6 Å²	87.6	85%	0.853	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.2	-8.1	177.9	56.5	0	0	0	0	117.9
1115	S	34.9	Very low	45.6	Very low	83 Å²	83	89.2 Å²	89.2	58%	0.58	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-1.3	173.4	60.8	0	0	0	0	114.6	D1113 R1117	D1113-S1115 PolarHBondContact O-N 3.35Å; S1115-R1117 VanDerWaalsContact C-N 3.33Å; S1115-R1117 PolarHBondContact O-N 3.32Å
1116	G	38.9	Very low	44.1	Very low	63 Å²	63	89.5 Å²	89.5	65%	0.649	49%	0.489	S	S	*	.			trans	74.6	12.8	172.1	0	0	0	0	0	115.8	D1113	D1113-G1116 PolarHBondContact O-N 2.94Å
1117	R	34.7	Very low	42.9	Very low	192 Å²	192	92.6 Å²	92.6	73%	0.725	51%	0.507	S	S	*	.			trans	-99.3	137	176.5	-71.2	-174	173.4	-171.9	-2.6	111.6	S1115 L1119	S1115-R1117 VanDerWaalsContact C-N 3.33Å; S1115-R1117 PolarHBondContact O-N 3.32Å; R1117-L1119 PolarHBondContact O-N 3.46Å
1118	S	30.5	Very low	41.9	Very low	93 Å²	93	101.9 Å²	101.9	65%	0.65	54%	0.537	S	S	*	.			trans	-69.9	112.1	169.1	-168.7	0	0	0	0	109.4
1119	L	35.4	Very low	41.1	Very low	57 Å²	57	103.3 Å²	103.3	30%	0.298	54%	0.537	S	S	.	.			trans	-105.8	119.3	171.9	-69.6	174.2	0	0	0	108.8	R1117 A1123	R1117-L1119 PolarHBondContact O-N 3.46Å; L1119-A1123 HydrophobicContact CB-CB 4.33Å; L1119-A1123 HydrophobicContact CD2-CB 4Å
1120	N	40.9	Very low	39.9	Very low	127 Å²	127	110.8 Å²	110.8	68%	0.679	57%	0.569	S	S	*	*			trans	-61.8	151.8	168.7	-65.8	0.8	0	0	0	109.2	R1122 A1123 H1124	N1120-R1122 VanDerWaalsContact C-N 3.29Å; N1120-R1122 PolarHBondContact O-N 3.44Å; N1120-R1122 VanDerWaalsContact O-N 3.14Å; N1120-A1123 WeakPolarHBondContact O-CA 3.2Å; N1120-A1123 VanDerWaalsContact O-CB 3.28Å; N1120-A1123 WeakPolarHBondContact O-CB 3.46Å; N1120-A1123 PolarHBondContact O-N 3.44Å; N1120-H1124 PolarHBondContact O-N 2.91Å; N1120-H1124 VanDerWaalsContact O-N 3.15Å
1121	E	39.4	Very low	38.8	Very low	161 Å²	161	119.6 Å²	119.6	75%	0.752	60%	0.6	S	S	*	*	H	α-helix	trans	-48.8	-44	-175.8	-169.6	169.3	-135	0	0	114.1	A1123 H1124 L1125	E1121-A1123 VanDerWaalsContact C-N 3.3Å; E1121-A1123 PolarHBondContact O-N 2.93Å; E1121-H1124 WeakPolarHBondContact O-CB 3.31Å; E1121-H1124 PolarHBondContact O-N 3.25Å; E1121-L1125 PolarHBondContact O-N 3.14Å; E1121-L1125 VanDerWaalsContact O-N 3.08Å
1122	R	39.1	Very low	37.8	Very low	212 Å²	212	124.2 Å²	124.2	80%	0.8	62%	0.615	S	S	*	*	H	α-helix	trans	-57.7	-37	172.3	-73.6	-176.8	172.7	177.8	-2.6	113.7	N1120 L1126	N1120-R1122 VanDerWaalsContact C-N 3.29Å; N1120-R1122 PolarHBondContact O-N 3.44Å; N1120-R1122 VanDerWaalsContact O-N 3.14Å; R1122-L1126 WeakPolarHBondContact O-CB 3.37Å; R1122-L1126 WeakPolarHBondContact O-CD1 3.43Å; R1122-L1126 VanDerWaalsContact O-CG 3.24Å; R1122-L1126 WeakPolarHBondContact O-CG 3.36Å; R1122-L1126 PolarHBondContact O-N 3.4Å
1123	A	37.8	Very low	36.7	Very low	29 Å²	29	124.3 Å²	124.3	24%	0.24	63%	0.63	C	S	.	*	H	α-helix	trans	-73.3	-29	176.2	0	0	0	0	0	112.2	L1119 N1120 E1121 L1126 T1127	L1119-A1123 HydrophobicContact CB-CB 4.33Å; L1119-A1123 HydrophobicContact CD2-CB 4Å; N1120-A1123 WeakPolarHBondContact O-CA 3.2Å; N1120-A1123 VanDerWaalsContact O-CB 3.28Å; N1120-A1123 WeakPolarHBondContact O-CB 3.46Å; N1120-A1123 PolarHBondContact O-N 3.44Å; E1121-A1123 VanDerWaalsContact C-N 3.3Å; E1121-A1123 PolarHBondContact O-N 2.93Å; A1123-L1126 PolarHBondContact O-N 2.78Å; A1123-T1127 WeakPolarHBondContact O-CB 3.39Å; A1123-T1127 PolarHBondContact O-N 3.41Å; A1123-T1127 PolarHBondContact O-OG1 2.84Å
1124	H	40.2	Very low	36.4	Very low	91 Å²	91	126 Å²	126	42%	0.421	65%	0.646	S	S	.	*	H	α-helix	trans	-70.2	-36	173.4	-154.6	-47.8	0	0	0	112	N1120 E1121 R1128	N1120-H1124 PolarHBondContact O-N 2.91Å; N1120-H1124 VanDerWaalsContact O-N 3.15Å; E1121-H1124 WeakPolarHBondContact O-CB 3.31Å; E1121-H1124 PolarHBondContact O-N 3.25Å; H1124-R1128 PolarHBondContact O-N 2.85Å
1125	L	41.7	Very low	36.1	Very low	114 Å²	114	125 Å²	125	60%	0.597	64%	0.638	S	S	*	*	H	α-helix	trans	-64.3	-50.8	167.8	-74.6	165	0	0	0	111.5	E1121 T1127 R1128 V1129	E1121-L1125 PolarHBondContact O-N 3.14Å; E1121-L1125 VanDerWaalsContact O-N 3.08Å; L1125-T1127 VanDerWaalsContact C-N 3.25Å; L1125-T1127 PolarHBondContact O-N 2.82Å; L1125-R1128 WeakPolarHBondContact O-CB 3.39Å; L1125-R1128 PolarHBondContact O-N 3.34Å; L1125-R1128 VanDerWaalsContact O-N 3.08Å; L1125-V1129 PolarHBondContact O-N 3.3Å
1126	L	38.7	Very low	36.1	Very low	92 Å²	92	126.2 Å²	126.2	48%	0.482	65%	0.647	S	S	.	*	H	α-helix	trans	-59.8	-33.9	177.7	-71.6	163.5	0	0	0	112.5	R1122 A1123 R1128 V1129 F1130	R1122-L1126 WeakPolarHBondContact O-CB 3.37Å; R1122-L1126 WeakPolarHBondContact O-CD1 3.43Å; R1122-L1126 VanDerWaalsContact O-CG 3.24Å; R1122-L1126 WeakPolarHBondContact O-CG 3.36Å; R1122-L1126 PolarHBondContact O-N 3.4Å; A1123-L1126 PolarHBondContact O-N 2.78Å; L1126-R1128 VanDerWaalsContact C-N 3.32Å; L1126-R1128 PolarHBondContact O-N 2.98Å; L1126-V1129 PolarHBondContact O-N 2.92Å; L1126-V1129 VanDerWaalsContact O-N 3.1Å; L1126-F1130 HydrophobicContact CB-CD2 4.37Å; L1126-F1130 HydrophobicContact CD2-CD2 4.43Å; L1126-F1130 HydrophobicContact CD2-CE2 4.03Å; L1126-F1130 WeakPolarHBondContact O-CB 3.33Å; L1126-F1130 WeakPolarHBondContact O-CD2 3.34Å; L1126-F1130 PolarHBondContact O-N 3.4Å
1127	T	40.1	Very low	35.9	Very low	71 Å²	71	128.6 Å²	128.6	44%	0.436	65%	0.648	S	S	.	*	H	α-helix	trans	-69.4	-29.1	177.8	-55.1	0	0	0	0	112.2	A1123 L1125 R1131	A1123-T1127 WeakPolarHBondContact O-CB 3.39Å; A1123-T1127 PolarHBondContact O-N 3.41Å; A1123-T1127 PolarHBondContact O-OG1 2.84Å; L1125-T1127 VanDerWaalsContact C-N 3.25Å; L1125-T1127 PolarHBondContact O-N 2.82Å; T1127-R1131 WeakPolarHBondContact O-CB 3.23Å; T1127-R1131 PolarHBondContact O-N 3.42Å
1128	R	39.9	Very low	35.8	Very low	211 Å²	211	121 Å²	121	80%	0.796	63%	0.631	S	S	*	*	H	α-helix	trans	-66.6	-39.4	167	-93.3	-175.8	169.8	-177.2	-3.4	111.9	H1124 L1125 L1126	H1124-R1128 PolarHBondContact O-N 2.85Å; L1125-R1128 WeakPolarHBondContact O-CB 3.39Å; L1125-R1128 PolarHBondContact O-N 3.34Å; L1125-R1128 VanDerWaalsContact O-N 3.08Å; L1126-R1128 VanDerWaalsContact C-N 3.32Å; L1126-R1128 PolarHBondContact O-N 2.98Å
1129	V	39.7	Very low	35.8	Very low	111 Å²	111	126.2 Å²	126.2	67%	0.673	64%	0.636	S	S	*	*	H	α-helix	trans	-71.8	-36.3	179.5	177.6	0	0	0	0	112.5	L1125 L1126	L1125-V1129 PolarHBondContact O-N 3.3Å; L1126-V1129 PolarHBondContact O-N 2.92Å; L1126-V1129 VanDerWaalsContact O-N 3.1Å
1130	F	31.3	Very low	35.6	Very low	163 Å²	163	128.6 Å²	128.6	72%	0.715	66%	0.657	S	S	*	*	H	α-helix	trans	-95.7	0.3	-175.6	-77.4	-69.6	0	0	0	115.2	L1126 K1132	L1126-F1130 HydrophobicContact CB-CD2 4.37Å; L1126-F1130 HydrophobicContact CD2-CD2 4.43Å; L1126-F1130 HydrophobicContact CD2-CE2 4.03Å; L1126-F1130 WeakPolarHBondContact O-CB 3.33Å; L1126-F1130 WeakPolarHBondContact O-CD2 3.34Å; L1126-F1130 PolarHBondContact O-N 3.4Å; F1130-K1132 PolarHBondContact O-N 3Å
1131	R	31.9	Very low	35.1	Very low	209 Å²	209	129.9 Å²	129.9	79%	0.789	66%	0.664	S	S	*	*	S	Bend	trans	-71.4	93.5	169.2	-136.8	-176.2	-164.3	-167.3	5.9	108.5	T1127 T1133	T1127-R1131 WeakPolarHBondContact O-CB 3.23Å; T1127-R1131 PolarHBondContact O-N 3.42Å; R1131-T1133 PolarHBondContact O-N 3.19Å
1132	K	31.1	Very low	34.6	Very low	199 Å²	199	125.9 Å²	125.9	87%	0.865	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-49.7	116.1	172.1	-79	-172.9	174.3	-176.1	0	109.2	F1130	F1130-K1132 PolarHBondContact O-N 3Å
1133	T	29.2	Very low	34.2	Very low	124 Å²	124	121.6 Å²	121.6	76%	0.761	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-57.1	139.9	164.2	34.6	0	0	0	0	109	R1131 S1135	R1131-T1133 PolarHBondContact O-N 3.19Å; T1133-S1135 PolarHBondContact O-N 3.49Å
1134	P	31.2	Very low	33.9	Very low	123 Å²	123	126.6 Å²	126.6	80%	0.799	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-53.7	131.4	169.3	-25.8	35.5	0	0	0	110	S1136	P1134-S1136 PolarHBondContact O-N 2.9Å; P1134-S1136 VanDerWaalsContact O-N 3.12Å
1135	S	31.6	Very low	33.7	Very low	99 Å²	99	129 Å²	129	69%	0.692	68%	0.681	S	S	*	*			trans	-71.3	108.1	-170.8	50.6	0	0	0	0	112.1	T1133 V1137	T1133-S1135 PolarHBondContact O-N 3.49Å; S1135-V1137 PolarHBondContact O-N 2.88Å; S1135-V1137 VanDerWaalsContact O-N 3.12Å
1136	S	35.1	Very low	33.5	Very low	109 Å²	109	128.7 Å²	128.7	76%	0.762	68%	0.684	S	S	*	*			trans	49.9	44.5	150.3	62.6	0	0	0	0	117.2	P1134	P1134-S1136 PolarHBondContact O-N 2.9Å; P1134-S1136 VanDerWaalsContact O-N 3.12Å
1137	V	34	Very low	33.7	Very low	113 Å²	113	127.2 Å²	127.2	69%	0.685	68%	0.679	S	S	*	*			trans	-88.3	125.6	167.8	-176	0	0	0	0	109.1	S1135	S1135-V1137 PolarHBondContact O-N 2.88Å; S1135-V1137 VanDerWaalsContact O-N 3.12Å
1138	G	33.2	Very low	34	Very low	34 Å²	34	126 Å²	126	35%	0.351	67%	0.673	S	S	.	*	S	Bend	trans	101.8	-10.9	168	0	0	0	0	0	118.1	S1140 N1141 S1142	G1138-S1140 PolarHBondContact O-N 3.29Å; G1138-N1141 PolarHBondContact O-N 2.87Å; G1138-S1142 PolarHBondContact O-OG 2.9Å; G1138-S1142 PolarHBondContact O-N 3.39Å
1139	R	30.7	Very low	34.8	Very low	202 Å²	202	119 Å²	119	76%	0.762	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	10.3	-172.6	-144.4	-176.5	-168.4	-179.4	3.4	116.2
1140	S	30.9	Very low	35.8	Very low	107 Å²	107	113.8 Å²	113.8	75%	0.748	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-23.9	179.7	48.7	0	0	0	0	114.6	G1138	G1138-S1140 PolarHBondContact O-N 3.29Å
1141	N	30.5	Very low	38	Very low	153 Å²	153	107 Å²	107	82%	0.818	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.2	-17.5	-178.3	-86.8	4.8	0	0	0	114.5	G1138 V1143	G1138-N1141 PolarHBondContact O-N 2.87Å; N1141-V1143 VanDerWaalsContact O-N 3.15Å; N1141-V1143 PolarHBondContact O-N 2.69Å
1142	S	28.6	Very low	39.8	Very low	78 Å²	78	97.2 Å²	97.2	55%	0.545	55%	0.551	S	S	.	*	S	Bend	trans	-73.8	104.5	166.5	61.3	0	0	0	0	108.7	G1138 Q1144	G1138-S1142 PolarHBondContact O-OG 2.9Å; G1138-S1142 PolarHBondContact O-N 3.39Å; S1142-Q1144 PolarHBondContact O-N 2.96Å
1143	V	31.5	Very low	41.7	Very low	122 Å²	122	88 Å²	88	74%	0.739	51%	0.512	S	S	*	.			trans	-55.9	117.2	161.4	-178.9	0	0	0	0	106	N1141 Q1145	N1141-V1143 VanDerWaalsContact O-N 3.15Å; N1141-V1143 PolarHBondContact O-N 2.69Å; V1143-Q1145 HydrophobicContact CG1-CG 4.02Å; V1143-Q1145 PolarHBondContact O-N 3.24Å
1144	Q	30	Very low	43.5	Very low	133 Å²	133	83.8 Å²	83.8	62%	0.621	49%	0.487	S	S	*	.			trans	-77.2	69.3	-179.2	-168.3	169.3	-9.4	0	0	108.7	S1142 T1146	S1142-Q1144 PolarHBondContact O-N 2.96Å; Q1144-T1146 PolarHBondContact O-N 2.73Å
1145	Q	36.4	Very low	45.3	Very low	143 Å²	143	78.4 Å²	78.4	67%	0.668	45%	0.451	S	S	*	.			trans	-65.4	81	166	-77.1	-174.6	-22.5	0	0	108.4	V1143 V1147	V1143-Q1145 HydrophobicContact CG1-CG 4.02Å; V1143-Q1145 PolarHBondContact O-N 3.24Å; Q1145-V1147 PolarHBondContact O-N 3.29Å
1146	T	37.2	Very low	46.7	Very low	106 Å²	106	77 Å²	77	65%	0.65	43%	0.433	S	S	*	.			trans	-47.4	120.6	139.1	43.7	0	0	0	0	106.9	Q1144 S1148	Q1144-T1146 PolarHBondContact O-N 2.73Å; T1146-S1148 PolarHBondContact O-N 3.35Å
1147	V	44.1	Very low	47.7	Very low	62 Å²	62	74.7 Å²	74.7	38%	0.376	41%	0.411	S	S	.	.			trans	-69.4	88	176.5	-177.1	0	0	0	0	106.9	L720 Q1145 H1149	L720-V1147 HydrophobicContact CD1-CG2 4.44Å; Q1145-V1147 PolarHBondContact O-N 3.29Å; V1147-H1149 PolarHBondContact O-N 2.91Å
1148	S	46.2	Very low	48.8	Very low	45 Å²	45	78.1 Å²	78.1	32%	0.315	42%	0.419	S	S	.	.			trans	-73.3	-17.6	-171.4	52.9	0	0	0	0	113.1	E609 T1146	E609-S1148 WeakPolarHBondContact CG-O 3.29Å; T1146-S1148 PolarHBondContact O-N 3.35Å
1149	H	56.9	Low	49.9	Very low	65 Å²	65	78.3 Å²	78.3	30%	0.301	42%	0.42	S	S	.	.			trans	-136.5	120.2	-165.1	-62.3	-31.3	0	0	0	110.6	D587 V1147 Y1151	D587-H1149 WeakPolarHBondContact OD1-CB 3.32Å; D587-H1149 IonicContact OD1-CG 2.63Å; D587-H1149 WeakPolarHBondContact OD2-CB 3.28Å; D587-H1149 IonicContact OD2-CG 3.17Å; D587-H1149 IonicContact OD2-ND1 2.77Å; V1147-H1149 PolarHBondContact O-N 2.91Å; H1149-Y1151 VanDerWaalsContact C-N 3.29Å; H1149-Y1151 PolarHBondContact O-N 2.94Å
1150	G	59.2	Low	51.3	Low	1 Å²	1	70.7 Å²	70.7	1%	0.01	40%	0.396	C	S	.	.			trans	-87.7	20.7	-171.9	0	0	0	0	0	115	R617 T618 N706 A1152	R617-G1150 WeakPolarHBondContact CA-O 3.48Å; T618-G1150 PolarHBondContact N-O 3Å; T618-G1150 VanDerWaalsContact N-O 3.09Å; N706-G1150 PolarHBondContact ND2-O 3.37Å; G1150-A1152 PolarHBondContact O-N 3.45Å
1151	Y	78.3	Confident	52.9	Low	19 Å²	19	65.9 Å²	65.9	8%	0.075	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-63.8	128.2	-171.6	167.5	-98.3	0	0	0	112.8	F561 K566 A586 T618 L619 E702 H1149 F1153	F561-Y1151 VanDerWaalsContact CE2-OH 3.31Å; F561-Y1151 WeakPolarHBondContact CE2-OH 3.45Å; F561-Y1151 WeakPolarHBondContact CZ-OH 3.21Å; K566-Y1151 HydrophobicContact CB-CE1 4.01Å; K566-Y1151 HydrophobicContact CD-CD1 4.28Å; K566-Y1151 HydrophobicContact CD-CE1 3.84Å; K566-Y1151 HydrophobicContact CG-CE1 4.22Å; K566-Y1151 PolarHBondContact O-OH 3.4Å; A586-Y1151 HydrophobicContact CB-CD1 3.67Å; A586-Y1151 HydrophobicContact CB-CD2 3.62Å; A586-Y1151 HydrophobicContact CB-CE1 3.89Å; A586-Y1151 HydrophobicContact CB-CE2 3.82Å; A586-Y1151 HydrophobicContact CB-CG 3.51Å; T618-Y1151 WeakPolarHBondContact O-CD2 3.48Å; T618-Y1151 WeakPolarHBondContact OG1-CA 3.47Å; T618-Y1151 PolarHBondContact OG1-N 3.49Å; T618-Y1151 VanDerWaalsContact OG1-N 3.14Å; L619-Y1151 HydrophobicContact CD2-CD2 4.25Å; L619-Y1151 HydrophobicContact CD2-CE2 3.78Å; E702-Y1151 WeakPolarHBondContact CB-O 3.3Å; H1149-Y1151 VanDerWaalsContact C-N 3.29Å; H1149-Y1151 PolarHBondContact O-N 2.94Å; Y1151-F1153 HydrophobicContact CE2-CB 4.01Å; Y1151-F1153 WeakPolarHBondContact OH-CB 3.42Å
1152	A	69.4	Low	54.8	Low	4 Å²	4	60.2 Å²	60.2	3%	0.033	34%	0.335	C	S	.	.			trans	-149.5	141.7	167.6	0	0	0	0	0	110.3	R617 G1150	R617-A1152 HydrophobicContact CB-CB 4.21Å; R617-A1152 HydrophobicContact CG-CB 4.01Å; G1150-A1152 PolarHBondContact O-N 3.45Å
1153	F	72.3	Confident	57	Low	7 Å²	7	57.4 Å²	57.4	3%	0.031	31%	0.313	C	S	.	.			trans	-148.1	122.9	176.9	-166.7	-124.5	0	0	0	111.2	D519 E520 F561 L619 Y1151 Q1155	D519-F1153 HydrophobicContact CB-CD2 3.81Å; D519-F1153 HydrophobicContact CB-CE2 3.83Å; E520-F1153 HydrophobicContact CG-CE2 4.17Å; E520-F1153 HydrophobicContact CG-CZ 3.81Å; F561-F1153 HydrophobicContact CD1-CD1 4.39Å; F561-F1153 AromaticContact CD2-CD1 3.67Å; F561-F1153 HydrophobicContact CD2-CD1 3.67Å; F561-F1153 AromaticContact CD2-CE1 3.88Å; F561-F1153 HydrophobicContact CD2-CE1 3.88Å; F561-F1153 HydrophobicContact CE1-CD1 4.3Å; F561-F1153 AromaticContact CE2-CD1 3.55Å; F561-F1153 HydrophobicContact CE2-CD1 3.55Å; F561-F1153 HydrophobicContact CE2-CE1 4.25Å; F561-F1153 HydrophobicContact CE2-CG 4.49Å; F561-F1153 HydrophobicContact CG-CD1 4.1Å; F561-F1153 HydrophobicContact CG-CE1 4.11Å; F561-F1153 AromaticContact CZ-CD1 3.9Å; F561-F1153 HydrophobicContact CZ-CD1 3.9Å; L619-F1153 HydrophobicContact CD1-CD2 3.85Å; L619-F1153 HydrophobicContact CD1-CE2 4.09Å; L619-F1153 HydrophobicContact CD2-CD2 4.31Å; Y1151-F1153 HydrophobicContact CE2-CB 4.01Å; Y1151-F1153 WeakPolarHBondContact OH-CB 3.42Å; F1153-Q1155 HydrophobicContact CZ-CB 4.27Å; F1153-Q1155 PolarHBondContact O-N 2.91Å; F1153-Q1155 HydrophobicContact CE1-CB 3.51Å; F1153-Q1155 HydrophobicContact CD1-CB 3.73Å; F1153-Q1155 HydrophobicContact CE1-CG 4.11Å
1154	S	65.4	Low	59.2	Low	34 Å²	34	52.7 Å²	52.7	24%	0.238	29%	0.286	C	S	.	.			trans	-96.8	63.5	-173.9	-68.7	0	0	0	0	111.5	S517 D519 R617	S517-S1154 WeakPolarHBondContact CA-O 3.36Å; S517-S1154 WeakPolarHBondContact CB-O 3.39Å; S517-S1154 PolarHBondContact OG-O 3.27Å; D519-S1154 VanDerWaalsContact OD2-CB 3.31Å; D519-S1154 WeakPolarHBondContact OD2-CB 3.46Å; D519-S1154 PolarHBondContact OD2-N 3.33Å; R617-S1154 PolarHBondContact NH1-OG 2.89Å
1155	Q	70.1	Confident	61.4	Low	11 Å²	11	51.1 Å²	51.1	5%	0.051	28%	0.278	C	S	.	.			trans	-110.2	139.4	176	-175.3	76.7	29.2	0	0	110.5	F561 F1153	F561-Q1155 HydrophobicContact CB-CG 3.98Å; F561-Q1155 HydrophobicContact CD1-CB 3.79Å; F561-Q1155 HydrophobicContact CD1-CG 4Å; F561-Q1155 HydrophobicContact CE1-CB 4.29Å; F561-Q1155 HydrophobicContact CG-CB 4.19Å; F561-Q1155 HydrophobicContact CG-CG 4.17Å; F1153-Q1155 HydrophobicContact CZ-CB 4.27Å; F1153-Q1155 PolarHBondContact O-N 2.91Å; F1153-Q1155 HydrophobicContact CE1-CB 3.51Å; F1153-Q1155 HydrophobicContact CD1-CB 3.73Å; F1153-Q1155 HydrophobicContact CE1-CG 4.11Å
1156	E	61.3	Low	63.3	Low	68 Å²	68	44.8 Å²	44.8	32%	0.318	25%	0.249	S	C	.	.			trans	-79.9	138.5	175.7	-69	178.3	-163.7	0	0	112	N203 Q1163	N203-E1156 PolarHBondContact ND2-OE1 2.68Å; E1156-Q1163 PolarHBondContact O-NE2 3.09Å
1157	E	54.6	Low	65.4	Low	62 Å²	62	39.8 Å²	39.8	29%	0.29	22%	0.219	S	C	.	.	S	Bend	trans	-114.9	-13.3	-166.5	-62.9	168.9	-138.8	0	0	113.2	F561 S563 K700	F561-E1157 HydrophobicContact CD1-CG 3.93Å; F561-E1157 HydrophobicContact CE1-CG 4.07Å; S563-E1157 WeakPolarHBondContact CA-OE2 3.43Å; S563-E1157 WeakPolarHBondContact CB-OE1 3.49Å; S563-E1157 WeakPolarHBondContact CB-OE2 3.3Å; S563-E1157 VanDerWaalsContact N-CD 3.25Å; S563-E1157 PolarHBondContact N-OE2 3.43Å; S563-E1157 VanDerWaalsContact OG-CD 3.22Å; S563-E1157 PolarHBondContact OG-OE1 2.93Å; S563-E1157 PolarHBondContact OG-OE2 2.88Å; S563-E1157 VanDerWaalsContact OG-OE2 3.09Å; K700-E1157 IonicContact NZ-OE1 2.7Å; K700-E1157 PolarHBondContact NZ-OE1 3.18Å
1158	H	58.9	Low	67.2	Low	185 Å²	185	40.3 Å²	40.3	86%	0.856	21%	0.214	S	C	*	.	S	Bend	trans	-128.5	34.4	-178.3	-60.9	-17.1	0	0	0	111.2
1159	G	55.4	Low	68.7	Low	37 Å²	37	39.5 Å²	39.5	38%	0.381	21%	0.208	S	C	.	.			trans	-62.5	141.2	171.8	0	0	0	0	0	111.2	V1161	G1159-V1161 PolarHBondContact O-N 2.89Å; G1159-V1161 VanDerWaalsContact O-N 3.16Å
1160	V	60.2	Low	69.6	Low	42 Å²	42	37.2 Å²	37.2	26%	0.255	20%	0.197	S	C	.	.	S	Bend	trans	-52.7	-37.7	-178	-176.8	0	0	0	0	112.5	I206 Q208 D258	I206-V1160 VanDerWaalsContact O-CG2 3.23Å; I206-V1160 WeakPolarHBondContact O-CG2 3.26Å; Q208-V1160 HydrophobicContact CB-CG1 3.78Å; D258-V1160 HydrophobicContact CB-CB 4.43Å; D258-V1160 HydrophobicContact CB-CG1 3.74Å; D258-V1160 HydrophobicContact CB-CG2 3.77Å; D258-V1160 VanDerWaalsContact CG-CG2 3.47Å; D258-V1160 VanDerWaalsContact OD1-CG2 3.23Å; D258-V1160 WeakPolarHBondContact OD1-CG2 3.29Å
1161	V	65.1	Low	70.7	Confident	7 Å²	7	38.9 Å²	38.9	4%	0.042	21%	0.206	C	C	.	.	S	Bend	trans	-111.9	128.9	178	-176.9	0	0	0	0	107.1	M190 I206 Q208 G1159 Q1165 V1166	M190-V1161 HydrophobicContact CG-CG2 4.12Å; M190-V1161 HydrophobicContact SD-CB 4.36Å; M190-V1161 HydrophobicContact SD-CG1 3.97Å; M190-V1161 HydrophobicContact SD-CG2 3.76Å; I206-V1161 HydrophobicContact CG2-CB 4.29Å; I206-V1161 HydrophobicContact CG2-CG2 3.85Å; Q208-V1161 HydrophobicContact CB-CG2 4.43Å; G1159-V1161 PolarHBondContact O-N 2.89Å; G1159-V1161 VanDerWaalsContact O-N 3.16Å; V1161-Q1165 HydrophobicContact CG1-CB 3.55Å; V1161-V1166 HydrophobicContact CB-CG2 4.05Å; V1161-V1166 HydrophobicContact CG1-CG2 3.76Å
1162	S	70.7	Confident	70.9	Confident	34 Å²	34	40 Å²	40	24%	0.238	21%	0.214	C	C	.	.			trans	-68.2	156.4	-173.5	96.4	0	0	0	0	111.8	E560 S1164 Q1165 V1166	E560-S1162 VanDerWaalsContact OE1-CB 3.25Å; E560-S1162 WeakPolarHBondContact OE1-CB 3.35Å; E560-S1162 PolarHBondContact OE1-OG 3.39Å; E560-S1162 WeakPolarHBondContact OE2-CB 3.43Å; S1162-S1164 PolarHBondContact O-N 3.17Å; S1162-S1164 VanDerWaalsContact OG-OG 3.13Å; S1162-S1164 PolarHBondContact OG-OG 2.84Å; S1162-Q1165 VanDerWaalsContact N-OE1 3.1Å; S1162-Q1165 WeakPolarHBondContact O-CA 3.49Å; S1162-Q1165 WeakPolarHBondContact O-CB 3.42Å; S1162-Q1165 PolarHBondContact O-N 2.87Å; S1162-Q1165 WeakPolarHBondContact OG-CG 3.4Å; S1162-Q1165 PolarHBondContact OG-N 2.96Å; S1162-V1166 WeakPolarHBondContact O-CG2 3.34Å; S1162-V1166 PolarHBondContact O-N 3.21Å
1163	Q	74.5	Confident	71.4	Confident	19 Å²	19	43.9 Å²	43.9	9%	0.089	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-36.4	-174.6	-66	170.7	12.2	0	0	111.6	T501 E560 E1156 V1167	T501-Q1163 HydrophobicContact CG2-CB 3.98Å; T501-Q1163 HydrophobicContact CG2-CG 4.37Å; E560-Q1163 HydrophobicContact CB-CB 4.16Å; E560-Q1163 VanDerWaalsContact CD-N 3.28Å; E560-Q1163 HydrophobicContact CG-CB 3.91Å; E560-Q1163 PolarHBondContact OE1-N 3.37Å; E560-Q1163 PolarHBondContact OE2-N 2.95Å; E1156-Q1163 PolarHBondContact O-NE2 3.09Å; Q1163-V1167 VanDerWaalsContact O-CG2 3.27Å; Q1163-V1167 PolarHBondContact O-N 3.31Å; Q1163-V1167 WeakPolarHBondContact O-CG2 3.4Å
1164	S	76.8	Confident	71.5	Confident	23 Å²	23	52.3 Å²	52.3	16%	0.161	27%	0.27	C	S	.	.	H	α-helix	trans	-69.5	-40.3	172.7	64	0	0	0	0	112.5	E560 S1162 V1167 R1168	E560-S1164 WeakPolarHBondContact OE1-CB 3.4Å; E560-S1164 PolarHBondContact OE1-N 3.01Å; E560-S1164 PolarHBondContact OE1-OG 3.29Å; S1162-S1164 PolarHBondContact O-N 3.17Å; S1162-S1164 VanDerWaalsContact OG-OG 3.13Å; S1162-S1164 PolarHBondContact OG-OG 2.84Å; S1164-V1167 PolarHBondContact O-N 3.21Å; S1164-R1168 WeakPolarHBondContact O-CB 3.45Å; S1164-R1168 VanDerWaalsContact O-CG 3.26Å; S1164-R1168 WeakPolarHBondContact O-CG 3.13Å; S1164-R1168 PolarHBondContact O-N 2.98Å
1165	Q	77.1	Confident	71.3	Confident	100 Å²	100	59.8 Å²	59.8	47%	0.467	30%	0.301	S	S	.	.	H	α-helix	trans	-63.4	-43.6	177.2	-72.3	175.2	-21.6	0	0	112.6	V1161 S1162 V1167 R1168 S1169	V1161-Q1165 HydrophobicContact CG1-CB 3.55Å; S1162-Q1165 VanDerWaalsContact N-OE1 3.1Å; S1162-Q1165 WeakPolarHBondContact O-CA 3.49Å; S1162-Q1165 WeakPolarHBondContact O-CB 3.42Å; S1162-Q1165 PolarHBondContact O-N 2.87Å; S1162-Q1165 WeakPolarHBondContact OG-CG 3.4Å; S1162-Q1165 PolarHBondContact OG-N 2.96Å; Q1165-V1167 VanDerWaalsContact C-N 3.33Å; Q1165-V1167 PolarHBondContact O-N 3.31Å; Q1165-R1168 PolarHBondContact O-N 3.49Å; Q1165-S1169 WeakPolarHBondContact O-CB 3.44Å; Q1165-S1169 PolarHBondContact O-N 3.35Å; Q1165-S1169 PolarHBondContact O-OG 2.95Å
1166	V	75.7	Confident	70.8	Confident	10 Å²	10	63.5 Å²	63.5	6%	0.061	31%	0.314	C	S	.	.	H	α-helix	trans	-54.3	-53.8	172.8	176	0	0	0	0	109.1	I206 V1161 S1162 R1168 S1169 Y1170	I206-V1166 HydrophobicContact CD1-CG2 3.65Å; V1161-V1166 HydrophobicContact CB-CG2 4.05Å; V1161-V1166 HydrophobicContact CG1-CG2 3.76Å; S1162-V1166 WeakPolarHBondContact O-CG2 3.34Å; S1162-V1166 PolarHBondContact O-N 3.21Å; V1166-R1168 VanDerWaalsContact C-N 3.31Å; V1166-R1168 PolarHBondContact O-N 3.29Å; V1166-S1169 PolarHBondContact O-N 2.96Å; V1166-S1169 PolarHBondContact O-OG 3.27Å; V1166-Y1170 HydrophobicContact CG1-CE2 4.25Å; V1166-Y1170 WeakPolarHBondContact O-CD2 3.42Å
1167	V	80.9	Confident	70.3	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.006	33%	0.332	C	S	.	.	H	α-helix	trans	-60.8	-33.5	-179.8	169.2	0	0	0	0	113.7	T501 R537 L555 V558 Q1163 S1164 Q1165	T501-V1167 HydrophobicContact CG2-CG2 4.31Å; R537-V1167 VanDerWaalsContact NH1-CG2 3.35Å; L555-V1167 HydrophobicContact CD2-CG1 3.4Å; V558-V1167 HydrophobicContact CG2-CG1 4.35Å; Q1163-V1167 VanDerWaalsContact O-CG2 3.27Å; Q1163-V1167 PolarHBondContact O-N 3.31Å; Q1163-V1167 WeakPolarHBondContact O-CG2 3.4Å; S1164-V1167 PolarHBondContact O-N 3.21Å; Q1165-V1167 VanDerWaalsContact C-N 3.33Å; Q1165-V1167 PolarHBondContact O-N 3.31Å
1168	R	82.8	Confident	69.7	Low	73 Å²	73	67.9 Å²	67.9	28%	0.275	36%	0.357	S	S	.	.	H	α-helix	trans	-78.2	-16.6	175.6	-68.5	-58.3	-171.7	-163.5	-1.3	114.2	P539 L555 L556 S1164 Q1165 V1166	P539-R1168 VanDerWaalsContact CB-O 3.3Å; P539-R1168 WeakPolarHBondContact CB-O 3.04Å; P539-R1168 WeakPolarHBondContact O-CD 3.17Å; P539-R1168 PolarHBondContact O-NH1 2.95Å; L555-R1168 VanDerWaalsContact O-CZ 3.29Å; L555-R1168 PolarHBondContact O-NH1 3.45Å; L555-R1168 PolarHBondContact O-NH2 3.35Å; L556-R1168 VanDerWaalsContact C-NH2 3.34Å; L556-R1168 PolarHBondContact O-NH2 3.1Å; S1164-R1168 WeakPolarHBondContact O-CB 3.45Å; S1164-R1168 VanDerWaalsContact O-CG 3.26Å; S1164-R1168 WeakPolarHBondContact O-CG 3.13Å; S1164-R1168 PolarHBondContact O-N 2.98Å; Q1165-R1168 PolarHBondContact O-N 3.49Å; V1166-R1168 VanDerWaalsContact C-N 3.31Å; V1166-R1168 PolarHBondContact O-N 3.29Å
1169	S	77.2	Confident	68.9	Low	28 Å²	28	65.6 Å²	65.6	20%	0.196	35%	0.35	C	S	.	.	H	α-helix	trans	-88.4	-16.7	-172.9	65.5	0	0	0	0	115	Q1165 V1166	Q1165-S1169 WeakPolarHBondContact O-CB 3.44Å; Q1165-S1169 PolarHBondContact O-N 3.35Å; Q1165-S1169 PolarHBondContact O-OG 2.95Å; V1166-S1169 PolarHBondContact O-N 2.96Å; V1166-S1169 PolarHBondContact O-OG 3.27Å
1170	Y	76.7	Confident	69.6	Low	16 Å²	16	67.1 Å²	67.1	6%	0.063	35%	0.349	C	S	.	.			trans	-96.7	134.5	-178.4	-76.3	-77.6	0	0	0	113.8	Y192 V503 T538 P539 V1166	Y192-Y1170 WeakPolarHBondContact CE2-OH 3.36Å; Y192-Y1170 WeakPolarHBondContact OH-CE2 3.44Å; Y192-Y1170 PolarHBondContact OH-OH 3.28Å; V503-Y1170 HydrophobicContact CG1-CD1 4.25Å; V503-Y1170 HydrophobicContact CG1-CD2 4.44Å; V503-Y1170 HydrophobicContact CG1-CG 4.12Å; V503-Y1170 HydrophobicContact CG2-CD2 3.92Å; V503-Y1170 HydrophobicContact CG2-CE2 4.3Å; V503-Y1170 HydrophobicContact CG2-CG 4.37Å; T538-Y1170 CarbonylContact C-O 3.6Å; T538-Y1170 VanDerWaalsContact C-O 3.31Å; P539-Y1170 WeakPolarHBondContact CD-O 3.49Å; V1166-Y1170 HydrophobicContact CG1-CE2 4.25Å; V1166-Y1170 WeakPolarHBondContact O-CD2 3.42Å
1171	D	82.4	Confident	70.1	Confident	36 Å²	36	68.4 Å²	68.4	19%	0.193	35%	0.354	C	S	.	.			trans	-124.6	89.6	162.8	-169	-14.9	0	0	0	109.2	P539 T1173 R1174	P539-D1171 HydrophobicContact CG-CB 4.3Å; D1171-T1173 PolarHBondContact O-N 3.33Å; D1171-T1173 VanDerWaalsContact O-N 3.14Å; D1171-T1173 WeakPolarHBondContact OD1-CB 3.17Å; D1171-T1173 PolarHBondContact OD1-N 2.94Å; D1171-T1173 PolarHBondContact OD1-OG1 3.36Å; D1171-R1174 HydrophobicContact CB-CG 4.34Å; D1171-R1174 PolarHBondContact OD2-NH2 2.98Å; D1171-R1174 IonicContact OD2-NH2 2.9Å; D1171-R1174 PolarHBondContact OD2-NE 2.96Å; D1171-R1174 IonicContact OD2-NE 2.71Å; D1171-R1174 VanDerWaalsContact OD2-CZ 3.24Å; D1171-R1174 IonicContact OD2-CZ 3.24Å; D1171-R1174 PolarHBondContact O-N 3.36Å
1172	T	82.1	Confident	70.4	Confident	42 Å²	42	71.8 Å²	71.8	26%	0.258	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	4.8	-175.5	74.8	0	0	0	0	113.1	V503 P504 A536 R537	V503-T1172 HydrophobicContact CG1-CG2 3.94Å; P504-T1172 HydrophobicContact CG-CG2 4.4Å; A536-T1172 WeakPolarHBondContact CA-OG1 3.47Å; R537-T1172 PolarHBondContact N-OG1 3.37Å; R537-T1172 PolarHBondContact O-N 3.47Å; R537-T1172 PolarHBondContact O-OG1 3Å
1173	T	79.2	Confident	70.4	Confident	86 Å²	86	74 Å²	74	53%	0.528	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-13.9	171.3	72.6	0	0	0	0	112.4	A536 T538 D1171	A536-T1173 HydrophobicContact CB-CG2 4.36Å; T538-T1173 HydrophobicContact CG2-CG2 3.98Å; D1171-T1173 PolarHBondContact O-N 3.33Å; D1171-T1173 VanDerWaalsContact O-N 3.14Å; D1171-T1173 WeakPolarHBondContact OD1-CB 3.17Å; D1171-T1173 PolarHBondContact OD1-N 2.94Å; D1171-T1173 PolarHBondContact OD1-OG1 3.36Å
1174	R	74.1	Confident	70.1	Confident	185 Å²	185	77.4 Å²	77.4	70%	0.698	40%	0.397	S	S	*	.	S	Bend	trans	-96.5	141.5	-179	-56.8	-174	-162.7	-158	4.7	111.7	D1171	D1171-R1174 HydrophobicContact CB-CG 4.34Å; D1171-R1174 PolarHBondContact OD2-NH2 2.98Å; D1171-R1174 IonicContact OD2-NH2 2.9Å; D1171-R1174 PolarHBondContact OD2-NE 2.96Å; D1171-R1174 IonicContact OD2-NE 2.71Å; D1171-R1174 VanDerWaalsContact OD2-CZ 3.24Å; D1171-R1174 IonicContact OD2-CZ 3.24Å; D1171-R1174 PolarHBondContact O-N 3.36Å
1175	Q	61.9	Low	69.7	Low	191 Å²	191	81.1 Å²	81.1	89%	0.893	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-71.2	136.8	166.8	-67.6	-177.4	-17.2	0	0	110.1
1176	R	59.9	Low	69.1	Low	89 Å²	89	79.7 Å²	79.7	34%	0.336	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-68.5	137.7	178.3	-75.1	-179.2	164.1	129.5	-6.1	110.8	E186 E505 S1178	E186-R1176 IonicContact OE2-CZ 3.09Å; E186-R1176 IonicContact OE2-NE 2.77Å; E186-R1176 IonicContact OE2-NH2 3.91Å; E186-R1176 PolarHBondContact OE2-NH2 3.29Å; E505-R1176 IonicContact OE1-CZ 3.05Å; E505-R1176 IonicContact OE1-NH1 3.28Å; E505-R1176 PolarHBondContact OE1-NH1 3.14Å; E505-R1176 VanDerWaalsContact OE1-NH1 3.09Å; E505-R1176 IonicContact OE1-NH2 3.37Å; E505-R1176 PolarHBondContact OE1-NH2 3.34Å; E505-R1176 IonicContact OE2-CZ 2.74Å; E505-R1176 IonicContact OE2-NH1 3.09Å; E505-R1176 PolarHBondContact OE2-NH1 3.09Å; E505-R1176 IonicContact OE2-NH2 3.38Å; R1176-S1178 PolarHBondContact O-N 2.69Å
1177	P	49.3	Very low	68.6	Low	107 Å²	107	85.1 Å²	85.1	70%	0.695	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-71.8	122.8	175.7	29.5	-33.6	0	0	0	111.3
1178	S	43.9	Very low	67.6	Low	115 Å²	115	92.1 Å²	92.1	80%	0.804	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-79.4	135.4	174.8	54.2	0	0	0	0	112	R1176	R1176-S1178 PolarHBondContact O-N 2.69Å
1179	L	41.8	Very low	66.2	Low	137 Å²	137	93.8 Å²	93.8	72%	0.717	49%	0.489	S	S	*	.			trans	-140	0	-171.1	-139	-177.4	0	0	0	114.2	K168 W272	K168-L1179 PolarHBondContact NZ-O 2.63Å; W272-L1179 HydrophobicContact CH2-CD1 4.48Å; W272-L1179 HydrophobicContact CZ2-CD1 3.61Å

Retrieved 1,179 of 1,179 residues in 618.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).